data_2my1_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 2my1 _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 ' 12' ' ' ALA . . . . . 0.432 ' HB1' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.501 2.095 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -70.58 161.73 45.01 Favored 'Trans proline' 0 C--N 1.317 -1.108 0 O-C-N 123.382 1.201 . . . . 0.0 110.81 -179.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -48.95 -31.69 7.82 Favored 'General case' 0 N--CA 1.514 2.758 0 O-C-N 121.42 -0.8 . . . . 0.0 111.384 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.71 -33.81 35.2 Favored Glycine 0 N--CA 1.499 2.855 0 O-C-N 120.925 -1.109 . . . . 0.0 110.671 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -55.42 -33.51 63.6 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 120.929 -1.336 . . . . 0.0 110.623 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -54.13 -36.8 63.67 Favored 'General case' 0 N--CA 1.512 2.654 0 O-C-N 121.01 -1.056 . . . . 0.0 110.331 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.4 mtpp -58.13 -36.22 72.63 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.248 -0.908 . . . . 0.0 110.261 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.9 pt -116.33 35.8 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 O-C-N 121.192 -0.942 . . . . 0.0 110.602 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.425 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 3.9 tmtt? -83.59 -43.16 0.81 Allowed Pre-proline 0 N--CA 1.508 2.451 0 O-C-N 121.04 -1.038 . . . . 0.0 113.12 -179.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.425 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.6 Cg_endo -76.24 -35.69 2.2 Favored 'Trans proline' 0 N--CA 1.486 1.061 0 O-C-N 122.582 0.78 . . . . 0.0 111.725 -178.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.42 HG23 ' CE2' ' A' ' 62' ' ' TYR . 85.3 m -59.6 -43.8 93.59 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 120.921 -1.112 . . . . 0.0 109.973 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.2 mt -64.78 -39.88 94.33 Favored 'General case' 0 N--CA 1.506 2.349 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.472 179.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.8 m -58.23 -35.22 71.37 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.119 -0.988 . . . . 0.0 110.168 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -56.57 -35.88 68.69 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.037 -1.039 . . . . 0.0 110.383 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.427 ' CD2' ' HD3' ' A' ' 59' ' ' ARG . 11.7 m-85 -57.16 -38.27 73.32 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.085 -1.009 . . . . 0.0 110.578 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 55.2 mm-40 -58.64 -39.61 81.06 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.23 -0.919 . . . . 0.0 110.49 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.2 mp -65.75 -41.26 89.94 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.385 0 C-N-CA 119.187 -1.005 . . . . 0.0 108.77 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -69.18 -50.33 48.57 Favored 'General case' 0 N--CA 1.506 2.336 0 C-N-CA 119.244 -0.982 . . . . 0.0 108.534 178.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.1 tp -59.73 -35.29 74.25 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.254 -0.904 . . . . 0.0 109.453 178.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.63 -37.32 73.12 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.035 -1.041 . . . . 0.0 110.352 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -62.92 -51.61 66.28 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.201 -1.0 . . . . 0.0 109.588 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.408 ' HB2' ' CG1' ' A' ' 52' ' ' ILE . . . -69.76 -41.2 75.49 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 119.029 -1.069 . . . . 0.0 108.726 178.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -62.5 -34.85 77.69 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.242 -0.911 . . . . 0.0 109.868 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.8 mmtm -70.44 -38.68 74.56 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 120.984 -1.072 . . . . 0.0 110.183 179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 N--CA 1.51 2.547 0 O-C-N 121.16 -0.962 . . . . 0.0 110.107 179.839 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.497 1.886 0 CA-C-O 120.614 0.245 . . . . 0.0 110.423 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.413 ' HB3' ' CZ2' ' A' ' 50' ' ' TRP . 5.3 m-20 -56.65 -39.66 74.08 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.194 -0.941 . . . . 0.0 109.989 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -60.1 -38.08 81.88 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.26 -0.9 . . . . 0.0 109.922 179.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.408 ' HG2' ' CB ' ' A' ' 33' ' ' ALA . 0.3 OUTLIER -60.02 -45.87 91.36 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.086 -1.008 . . . . 0.0 109.656 179.727 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 30.3 mt -65.39 -36.72 84.84 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.391 -0.924 . . . . 0.0 110.146 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.444 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.0 m0 -59.1 -38.57 79.85 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.058 -1.026 . . . . 0.0 109.635 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -63.01 -31.95 73.2 Favored 'General case' 0 N--CA 1.503 2.221 0 C-N-CA 119.097 -1.041 . . . . 0.0 109.464 178.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.408 ' CG1' ' HB2' ' A' ' 33' ' ' ALA . 11.3 mt -71.61 -58.55 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.184 0 O-C-N 121.0 -1.062 . . . . 0.0 109.111 179.205 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.7 ptm -59.87 -28.33 67.44 Favored 'General case' 0 N--CA 1.509 2.484 0 C-N-CA 118.601 -1.239 . . . . 0.0 109.988 178.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -69.24 -37.93 78.21 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.826 -1.171 . . . . 0.0 109.153 178.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.419 HD22 ' CD1' ' A' ' 26' ' ' PHE . 11.0 mt -53.66 -33.28 54.71 Favored 'General case' 0 N--CA 1.512 2.654 0 O-C-N 120.956 -1.09 . . . . 0.0 110.098 179.059 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.437 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 13.7 t60 -54.87 -36.27 64.93 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.082 -1.011 . . . . 0.0 110.137 179.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.435 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 8.0 m170 -59.64 -49.33 78.17 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.029 -1.045 . . . . 0.0 109.381 179.303 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -58.48 -34.46 70.91 Favored 'General case' 0 N--CA 1.507 2.421 0 C-N-CA 119.526 -0.87 . . . . 0.0 109.729 179.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.427 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -64.18 -50.58 67.58 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.068 -1.02 . . . . 0.0 109.545 179.363 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 87.9 p -63.49 -39.67 95.06 Favored 'General case' 0 N--CA 1.504 2.237 0 C-N-CA 119.25 -0.98 . . . . 0.0 109.296 179.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.425 ' O ' ' OG1' ' A' ' 65' ' ' THR . 18.9 ttt85 -63.99 -39.24 93.67 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 119.255 -0.978 . . . . 0.0 109.264 178.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.42 ' CE2' HG23 ' A' ' 22' ' ' THR . 40.4 t80 -63.49 -52.28 61.96 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.175 -0.953 . . . . 0.0 109.416 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.449 HG21 HD12 ' A' ' 63' ' ' ILE . 77.5 mt -70.2 -36.71 68.88 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 C-N-CA 119.163 -1.015 . . . . 0.0 109.34 179.44 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -66.83 -43.08 84.66 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.057 -1.027 . . . . 0.0 108.907 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.425 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 90.0 m -61.35 -40.46 94.36 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.132 -0.98 . . . . 0.0 110.475 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.7 pp -83.05 -33.32 26.47 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 120.921 -1.112 . . . . 0.0 112.353 -178.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.419 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 46.9 t80 -86.35 -32.16 21.13 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 120.64 -1.288 . . . . 0.0 111.807 -179.413 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -98.26 -19.32 17.9 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.817 -1.177 . . . . 0.0 112.645 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 9.1 mtpt -120.35 -59.28 1.79 Allowed 'General case' 0 N--CA 1.502 2.135 0 O-C-N 120.488 -1.382 . . . . 0.0 110.704 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.0 ttt85 -62.67 -30.83 71.68 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.164 -0.96 . . . . 0.0 110.837 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 56.86 42.16 26.89 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 120.77 -1.207 . . . . 0.0 109.994 -179.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.66 35.4 3.87 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.38 -0.825 . . . . 0.0 109.991 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.433 HD11 HG23 ' A' ' 73' ' ' ILE . 14.3 tt -153.73 162.6 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.199 -0.938 . . . . 0.0 109.909 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -108.73 146.76 33.02 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.102 -0.999 . . . . 0.0 110.298 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -46.04 -32.11 2.66 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.341 -0.849 . . . . 0.0 111.586 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 38.4 m-20 -61.65 -49.95 74.47 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 120.895 -1.128 . . . . 0.0 109.352 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 28.9 tp -67.9 -44.28 77.31 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.16 -1.016 . . . . 0.0 108.408 178.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.419 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 18.3 t80 -60.03 -37.88 81.05 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.326 -0.859 . . . . 0.0 109.393 179.037 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -74.14 -42.66 59.61 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.154 -0.966 . . . . 0.0 108.695 178.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.432 ' CH2' ' HB1' ' A' ' 12' ' ' ALA . 77.7 t90 -57.43 -36.37 71.27 Favored 'General case' 0 N--CA 1.51 2.557 0 O-C-N 121.278 -0.889 . . . . 0.0 109.716 178.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.458 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 12.1 mt -69.92 -48.7 57.51 Favored 'General case' 0 N--CA 1.505 2.308 0 O-C-N 121.163 -0.961 . . . . 0.0 108.858 179.079 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 33.8 mm -56.9 -32.27 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.629 0 O-C-N 121.259 -0.901 . . . . 0.0 110.11 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.8 tmtt? -89.23 -17.9 28.13 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 120.958 -1.089 . . . . 0.0 112.074 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.428 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 21.3 mm-40 -103.68 21.71 15.69 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 120.645 -1.284 . . . . 0.0 112.087 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.7 tttp 74.6 75.07 0.11 Allowed 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.108 -0.995 . . . . 0.0 111.729 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.458 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 33.6 m-85 -135.94 -63.42 0.65 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.458 -0.776 . . . . 0.0 109.334 179.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -123.05 -171.23 2.25 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.401 -0.812 . . . . 0.0 109.276 179.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.437 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 5.5 t0 -131.09 120.25 23.13 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.086 -1.009 . . . . 0.0 110.522 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 10.8 mmtp -77.34 -39.84 46.23 Favored 'General case' 0 N--CA 1.505 2.306 0 C-N-CA 119.528 -0.869 . . . . 0.0 109.649 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 33.0 tp -60.64 -39.96 90.23 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.196 -0.94 . . . . 0.0 109.74 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.5 tp -69.85 -49.92 47.73 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.101 -0.999 . . . . 0.0 108.788 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.468 HG22 HD12 ' A' ' 92' ' ' ILE . 58.1 mt -58.87 -32.35 47.0 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.392 0 C-N-CA 119.361 -0.936 . . . . 0.0 108.993 178.25 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.04 -44.03 70.06 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 120.962 -1.087 . . . . 0.0 109.358 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.418 ' CD ' ' CD2' ' A' ' 106' ' ' LEU . 5.1 mttp -58.21 -39.14 78.24 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.099 -1.001 . . . . 0.0 110.106 179.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.0 m0 -69.09 -39.77 78.81 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.109 -0.995 . . . . 0.0 109.767 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.84 -33.95 75.75 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.245 -0.91 . . . . 0.0 110.349 179.494 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 10.3 mmtm -54.17 -177.18 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.679 0 O-C-N 121.081 -1.012 . . . . 0.0 110.526 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.96 131.75 53.69 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.217 -0.927 . . . . 0.0 109.614 179.246 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 101.44 1.91 53.58 Favored Glycine 0 N--CA 1.492 2.398 0 C-N-CA 120.066 -1.064 . . . . 0.0 111.192 -179.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 41.2 m-85 -105.64 64.03 0.69 Allowed 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 119.595 1.698 . . . . 0.0 109.903 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -88.82 -36.57 15.97 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.102 -0.998 . . . . 0.0 110.121 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -108.23 71.24 0.79 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.153 -0.967 . . . . 0.0 109.786 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 7.2 tp -117.84 133.08 56.28 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.223 -0.923 . . . . 0.0 109.627 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.435 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.3 p -109.72 -37.44 5.66 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.242 -0.911 . . . . 0.0 112.361 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.59 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 6.6 m -141.04 -169.06 2.75 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.217 -1.552 . . . . 0.0 110.1 178.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.418 ' CD2' ' CD ' ' A' ' 94' ' ' LYS . 27.9 mt -97.34 -38.07 9.79 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.186 -0.946 . . . . 0.0 110.282 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 8.7 ttt-85 -101.15 30.06 4.34 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 120.966 -1.084 . . . . 0.0 109.734 177.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.59 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.3 1.7 t -126.56 15.07 7.63 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.07 -1.019 . . . . 0.0 108.995 -179.375 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.1 pt -159.07 37.26 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.404 0 O-C-N 120.788 -1.195 . . . . 0.0 110.759 -179.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 . . . . . 0 N--CA 1.5 2.061 0 O-C-N 120.643 -1.286 . . . . 0.0 111.767 -178.42 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.494 1.766 0 CA-C-O 120.735 0.302 . . . . 0.0 110.321 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 47.9 t -105.37 155.37 19.18 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.395 -0.816 . . . . 0.0 109.385 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.457 HG21 HD12 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -71.41 -35.94 59.05 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.344 0 O-C-N 121.113 -0.992 . . . . 0.0 110.801 -179.471 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.461 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.3 p -55.59 -34.27 64.67 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 120.8 -1.187 . . . . 0.0 110.929 -179.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -35.83 78.17 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 120.957 -1.09 . . . . 0.0 109.607 178.39 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.2 t -77.63 124.98 86.54 Favored Pre-proline 0 N--CA 1.505 2.291 0 O-C-N 121.167 -0.958 . . . . 0.0 109.952 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -64.94 178.92 1.61 Allowed 'Trans proline' 0 N--CA 1.489 1.237 0 O-C-N 123.176 1.093 . . . . 0.0 110.718 179.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -75.01 -36.96 61.93 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.287 -0.883 . . . . 0.0 110.627 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.61 -41.57 81.52 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 120.985 -1.072 . . . . 0.0 109.886 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -70.1 -41.19 74.35 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.338 -0.945 . . . . 0.0 108.966 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.2 mt -64.94 -39.3 93.3 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.27 -0.894 . . . . 0.0 109.465 179.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -60.41 -40.0 89.41 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.134 -0.979 . . . . 0.0 109.806 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -59.29 -37.67 78.28 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.152 -0.968 . . . . 0.0 110.251 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -59.37 -41.69 89.91 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.178 -0.951 . . . . 0.0 110.042 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.75 -48.23 80.09 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.192 -0.943 . . . . 0.0 109.614 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 1.1 ttt-85 -60.82 -37.1 80.85 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.211 -0.931 . . . . 0.0 110.067 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 33.4 mmtm -67.96 -34.12 75.96 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.103 -0.998 . . . . 0.0 110.781 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 18.4 mtmt -102.82 23.28 12.37 Favored 'General case' 0 N--CA 1.502 2.165 0 O-C-N 120.925 -1.109 . . . . 0.0 111.718 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.53 46.5 53.11 Favored Glycine 0 N--CA 1.499 2.866 0 O-C-N 120.715 -1.24 . . . . 0.0 110.851 179.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.2 t -147.18 -167.7 2.85 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.132 -1.216 . . . . 0.0 110.433 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -123.81 174.61 7.41 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.239 -0.913 . . . . 0.0 110.317 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.6 p -157.35 159.81 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.253 -0.904 . . . . 0.0 110.855 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 29.6 t -170.24 85.95 0.12 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.243 -0.911 . . . . 0.0 110.924 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.461 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 47.1 t80 -97.85 161.5 13.71 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.197 -0.939 . . . . 0.0 110.612 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 13.3 m80 -140.63 -61.08 0.5 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.521 -0.737 . . . . 0.0 109.104 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.7 151.48 51.1 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.413 -0.805 . . . . 0.0 109.037 178.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 29.2 p -95.79 153.26 17.83 Favored 'General case' 0 N--CA 1.503 2.203 0 C-N-CA 119.163 -1.015 . . . . 0.0 111.102 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.4 m -72.08 -25.7 24.07 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 O-C-N 121.44 -0.787 . . . . 0.0 111.563 -179.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -50.08 -60.41 2.97 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 120.868 -1.145 . . . . 0.0 110.219 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.444 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 25.0 p -125.83 -165.93 1.49 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.295 -0.878 . . . . 0.0 110.574 179.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -98.59 59.09 0.93 Allowed Glycine 0 N--CA 1.492 2.373 0 N-CA-C 108.16 -1.976 . . . . 0.0 108.16 178.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.7 t -103.84 143.97 32.13 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.316 -1.108 . . . . 0.0 109.931 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 14.0 ttt-85 -98.67 49.78 0.98 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.289 -0.882 . . . . 0.0 109.545 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.25 97.57 0.05 OUTLIER Glycine 0 N--CA 1.488 2.105 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.7 p -109.51 123.79 49.99 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.293 -1.122 . . . . 0.0 110.221 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -140.02 121.56 15.18 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.108 -0.995 . . . . 0.0 109.605 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.502 2.171 0 O-C-N 121.121 -0.987 . . . . 0.0 110.419 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.438 ' HB3' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.503 2.197 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -70.7 162.77 41.37 Favored 'Trans proline' 0 C--N 1.317 -1.109 0 O-C-N 123.405 1.213 . . . . 0.0 110.879 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -48.64 -31.88 7.39 Favored 'General case' 0 N--CA 1.514 2.764 0 O-C-N 121.443 -0.785 . . . . 0.0 111.375 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.03 -35.14 40.22 Favored Glycine 0 N--CA 1.5 2.931 0 O-C-N 121.046 -1.034 . . . . 0.0 110.542 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -56.03 -32.93 64.47 Favored 'General case' 0 N--CA 1.511 2.621 0 O-C-N 120.973 -1.31 . . . . 0.0 110.554 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -54.61 -38.5 66.87 Favored 'General case' 0 N--CA 1.511 2.62 0 O-C-N 120.98 -1.075 . . . . 0.0 110.123 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.0 mtmt -58.64 -37.44 75.93 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.315 -0.866 . . . . 0.0 110.087 179.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.1 pt -114.86 34.79 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.152 -0.967 . . . . 0.0 110.452 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.5 OUTLIER -83.57 -43.79 0.81 Allowed Pre-proline 0 N--CA 1.509 2.48 0 O-C-N 121.052 -1.03 . . . . 0.0 113.12 -179.177 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.2 Cg_endo -76.13 -36.96 1.67 Allowed 'Trans proline' 0 N--CA 1.486 1.079 0 O-C-N 122.712 0.849 . . . . 0.0 111.455 -178.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 62.7 m -60.39 -44.24 95.84 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.004 -1.06 . . . . 0.0 109.972 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.3 mt -65.25 -40.06 93.51 Favored 'General case' 0 N--CA 1.506 2.327 0 C-N-CA 119.411 -0.916 . . . . 0.0 109.453 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 47.9 m -57.93 -35.51 71.19 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.25 -0.906 . . . . 0.0 110.1 179.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.59 -36.92 69.94 Favored 'General case' 0 N--CA 1.511 2.606 0 O-C-N 121.05 -1.031 . . . . 0.0 110.252 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.428 ' CD2' ' HD3' ' A' ' 59' ' ' ARG . 14.9 m-85 -58.57 -39.47 80.41 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.094 -1.004 . . . . 0.0 110.457 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -59.89 -38.74 83.09 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.073 -1.017 . . . . 0.0 110.662 -179.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.2 mp -66.7 -40.27 85.7 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.412 0 C-N-CA 119.196 -1.001 . . . . 0.0 109.241 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.6 tp60 -69.58 -46.5 66.21 Favored 'General case' 0 N--CA 1.506 2.342 0 C-N-CA 119.211 -0.996 . . . . 0.0 108.821 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.21 -35.28 80.28 Favored 'General case' 0 N--CA 1.508 2.469 0 C-N-CA 119.283 -0.967 . . . . 0.0 108.923 178.359 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.31 -40.04 77.05 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 120.959 -1.088 . . . . 0.0 110.075 179.338 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -62.58 -50.24 72.08 Favored 'General case' 0 N--CA 1.507 2.392 0 C-N-CA 119.262 -0.975 . . . . 0.0 109.37 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.413 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -65.9 -41.5 91.4 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.38 -0.928 . . . . 0.0 109.088 179.002 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -63.18 -34.99 78.84 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.22 -0.925 . . . . 0.0 110.03 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.6 mtpt -84.1 -37.09 22.46 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.998 -1.064 . . . . 0.0 110.318 179.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 19.2 t70 . . . . . 0 N--CA 1.51 2.543 0 O-C-N 121.044 -1.035 . . . . 0.0 110.032 179.778 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.6 p . . . . . 0 N--CA 1.498 1.932 0 CA-C-O 120.586 0.232 . . . . 0.0 110.491 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -55.31 -37.19 67.04 Favored 'General case' 0 N--CA 1.511 2.6 0 O-C-N 121.153 -0.967 . . . . 0.0 110.172 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -59.05 -39.48 82.17 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.142 -0.974 . . . . 0.0 110.042 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 50.1 tp60 -61.6 -41.23 97.15 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.119 -0.988 . . . . 0.0 109.888 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.6 mt -59.46 -38.36 80.55 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.273 -0.892 . . . . 0.0 110.319 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.445 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.5 m0 -59.91 -36.79 77.74 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.165 -0.96 . . . . 0.0 110.174 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -60.36 -30.33 69.49 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.065 -1.022 . . . . 0.0 110.126 178.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.413 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 75.0 mt -72.33 -58.68 4.53 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.276 0 O-C-N 120.879 -1.138 . . . . 0.0 109.209 179.253 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 ptm -61.55 -29.55 70.08 Favored 'General case' 0 N--CA 1.508 2.465 0 C-N-CA 118.504 -1.278 . . . . 0.0 109.683 178.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 -68.85 -37.25 79.0 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.79 -1.194 . . . . 0.0 109.063 178.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.42 HD23 ' CD2' ' A' ' 26' ' ' PHE . 11.1 mt -53.02 -32.19 45.33 Favored 'General case' 0 N--CA 1.512 2.659 0 O-C-N 121.045 -1.035 . . . . 0.0 110.155 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.439 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 66.0 t60 -54.63 -38.06 66.4 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.062 -1.024 . . . . 0.0 110.072 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.429 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 5.5 m170 -61.35 -51.19 69.86 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.17 -0.956 . . . . 0.0 109.362 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -59.38 -33.98 71.87 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 119.474 -0.89 . . . . 0.0 109.668 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.428 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -68.18 -50.2 55.91 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.067 -1.021 . . . . 0.0 109.191 179.15 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 77.3 p -63.38 -38.44 91.16 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.093 -1.004 . . . . 0.0 109.154 178.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.428 ' O ' ' OG1' ' A' ' 65' ' ' THR . 10.4 ttm-85 -64.28 -39.86 94.79 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.165 -0.96 . . . . 0.0 109.184 178.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -62.85 -51.26 67.73 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.113 -0.992 . . . . 0.0 109.292 179.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.411 HG23 HD12 ' A' ' 63' ' ' ILE . 77.5 mt -69.65 -38.99 77.65 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 O-C-N 121.257 -0.902 . . . . 0.0 109.179 179.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -65.48 -43.25 90.83 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.195 -0.941 . . . . 0.0 109.05 179.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.428 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 88.2 m -61.04 -41.26 96.25 Favored 'General case' 0 N--CA 1.503 2.186 0 C-N-CA 119.331 -0.948 . . . . 0.0 110.546 -179.501 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.7 pp -83.22 -33.35 26.13 Favored 'General case' 0 N--CA 1.504 2.245 0 C-N-CA 118.926 -1.11 . . . . 0.0 112.52 -178.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.428 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 52.0 t80 -86.33 -32.7 20.87 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 120.738 -1.226 . . . . 0.0 111.779 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -98.26 -15.74 19.69 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.752 -1.217 . . . . 0.0 112.759 -178.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.2 mtpt -124.88 -59.38 1.43 Allowed 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.394 -1.441 . . . . 0.0 110.778 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 4.5 ttp85 -62.43 -30.59 71.33 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.153 -0.967 . . . . 0.0 110.829 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.4 tttp 57.68 42.49 23.72 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 120.816 -1.178 . . . . 0.0 110.073 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.82 36.3 3.71 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.404 -0.81 . . . . 0.0 109.82 179.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.443 HD11 HG22 ' A' ' 73' ' ' ILE . 14.2 tt -154.53 162.7 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.126 -0.984 . . . . 0.0 110.011 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 73.3 m -109.8 146.81 34.38 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.174 -0.954 . . . . 0.0 110.065 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -45.25 -32.45 1.94 Allowed 'General case' 0 N--CA 1.515 2.819 0 O-C-N 121.323 -0.861 . . . . 0.0 111.7 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -61.88 -50.63 71.45 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.956 -1.09 . . . . 0.0 109.374 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 30.6 tp -66.98 -43.75 82.21 Favored 'General case' 0 N--CA 1.505 2.296 0 C-N-CA 119.155 -1.018 . . . . 0.0 108.584 178.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.428 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 15.7 t80 -60.78 -38.38 85.07 Favored 'General case' 0 N--CA 1.506 2.344 0 C-N-CA 119.645 -0.822 . . . . 0.0 109.317 178.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.1 t0 -74.63 -41.19 60.82 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.136 -0.977 . . . . 0.0 108.892 178.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.438 ' CH2' ' HB3' ' A' ' 12' ' ' ALA . 86.6 t90 -59.13 -39.14 81.41 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.184 -0.947 . . . . 0.0 109.259 178.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.453 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 14.8 mt -65.61 -54.75 23.4 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.211 -0.93 . . . . 0.0 109.223 179.072 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -55.9 -27.63 22.94 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.423 0 O-C-N 121.123 -0.986 . . . . 0.0 110.701 -179.745 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.2 tttm -88.2 -19.46 26.86 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 120.899 -1.126 . . . . 0.0 111.628 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.427 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 77.0 mm-40 -102.77 23.74 11.65 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 120.623 -1.298 . . . . 0.0 111.843 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.41 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 15.6 tttt 76.34 69.57 0.07 Allowed 'General case' 0 N--CA 1.513 2.696 0 O-C-N 121.175 -0.953 . . . . 0.0 111.916 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.453 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 28.3 m-85 -132.04 -63.1 0.82 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.467 -0.771 . . . . 0.0 109.134 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -131.2 167.43 19.17 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.477 -0.764 . . . . 0.0 109.464 179.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.439 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 24.2 t70 -120.35 121.1 37.86 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.091 -1.006 . . . . 0.0 110.599 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 29.5 mtpt -67.75 -35.39 78.64 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 121.304 -0.873 . . . . 0.0 110.227 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 25.7 tp -58.56 -40.87 84.3 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.017 -1.052 . . . . 0.0 109.965 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.424 HD21 ' CD2' ' A' ' 57' ' ' HIS . 58.5 tp -70.58 -50.62 35.41 Favored 'General case' 0 N--CA 1.506 2.343 0 C-N-CA 119.185 -1.006 . . . . 0.0 108.652 179.145 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.435 HG22 HD11 ' A' ' 92' ' ' ILE . 63.2 mt -58.45 -34.83 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.457 0 C-N-CA 119.209 -0.996 . . . . 0.0 108.823 178.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.95 -39.51 87.29 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.049 -1.032 . . . . 0.0 109.135 178.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.413 ' HD2' ' CE1' ' A' ' 100' ' ' TYR . 4.9 mmtt -57.27 -44.66 84.17 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.098 -1.001 . . . . 0.0 109.174 179.176 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.3 m0 -63.41 -35.41 80.33 Favored 'General case' 0 N--CA 1.509 2.477 0 C-N-CA 119.562 -0.855 . . . . 0.0 110.1 179.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.01 -32.53 45.15 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.087 -1.008 . . . . 0.0 110.723 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.5 mmtt -53.69 -176.91 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.714 0 O-C-N 120.989 -1.069 . . . . 0.0 110.715 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.2 m -102.91 135.07 45.27 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.099 -1.001 . . . . 0.0 109.711 179.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.03 11.71 54.07 Favored Glycine 0 N--CA 1.494 2.524 0 C-N-CA 120.183 -1.008 . . . . 0.0 111.056 -179.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.413 ' CE1' ' HD2' ' A' ' 94' ' ' LYS . 50.4 m-85 -119.97 71.94 0.91 Allowed 'General case' 0 N--CA 1.492 1.641 0 CA-C-N 119.41 1.605 . . . . 0.0 109.823 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -97.37 -34.24 11.12 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.192 -0.942 . . . . 0.0 111.18 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.1 63.4 1.15 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.974 -1.079 . . . . 0.0 111.044 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.1 pp -111.57 152.98 26.95 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.0 -1.062 . . . . 0.0 109.67 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.429 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.8 p -113.17 -30.28 7.01 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.156 -0.965 . . . . 0.0 113.463 -179.138 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.553 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.9 m -143.47 -169.03 2.97 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 120.161 -1.587 . . . . 0.0 110.175 179.372 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 16.4 mt -95.39 -38.74 10.35 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.173 -0.954 . . . . 0.0 109.95 178.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 5.6 ttt85 -102.02 29.81 4.83 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.928 -1.108 . . . . 0.0 110.092 178.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.553 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.301 1.8 t -127.65 17.57 6.89 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.035 -1.041 . . . . 0.0 108.847 -179.564 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.3 pt -158.36 38.66 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.277 0 O-C-N 120.982 -1.074 . . . . 0.0 110.216 -178.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.43 ' O ' ' OG1' ' A' ' 119' ' ' THR . 25.6 mt-30 . . . . . 0 N--CA 1.506 2.366 0 O-C-N 120.91 -1.119 . . . . 0.0 111.02 -178.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.43 ' OG1' ' O ' ' A' ' 110' ' ' GLN . 1.4 m . . . . . 0 N--CA 1.494 1.754 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 48.7 t -94.37 154.21 17.59 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 119.401 -0.92 . . . . 0.0 108.804 178.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.452 ' CG2' ' CE1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -74.66 -30.6 25.22 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.381 0 O-C-N 121.021 -1.05 . . . . 0.0 111.654 -178.706 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.502 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.7 p -59.46 -35.75 74.67 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 120.594 -1.316 . . . . 0.0 110.639 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.82 -31.1 64.38 Favored 'General case' 0 N--CA 1.512 2.655 0 O-C-N 120.95 -1.093 . . . . 0.0 109.998 178.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 60.7 t -82.61 124.54 77.45 Favored Pre-proline 0 N--CA 1.504 2.256 0 O-C-N 121.061 -1.024 . . . . 0.0 109.974 179.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -66.21 176.03 4.31 Favored 'Trans proline' 0 N--CA 1.489 1.242 0 O-C-N 123.172 1.09 . . . . 0.0 110.871 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.0 mmm-85 -75.15 -38.37 60.98 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.292 -0.88 . . . . 0.0 110.162 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.47 -40.01 77.63 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 121.042 -1.036 . . . . 0.0 109.994 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -68.38 -42.59 78.87 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.228 -0.92 . . . . 0.0 109.192 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 11.7 mt -65.1 -39.36 93.03 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.413 -0.915 . . . . 0.0 109.362 179.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -59.04 -37.96 78.19 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.116 -0.99 . . . . 0.0 110.061 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -58.34 -39.03 78.38 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 121.123 -0.986 . . . . 0.0 110.195 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -62.41 -46.93 86.35 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.268 -0.895 . . . . 0.0 109.724 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -59.21 -38.39 79.8 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.167 -0.958 . . . . 0.0 110.2 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 25.6 ttt85 -67.59 -38.97 84.79 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.19 -0.944 . . . . 0.0 110.107 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 16.9 mttp -72.01 -34.67 69.04 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.067 -1.02 . . . . 0.0 110.511 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -88.61 -19.67 25.96 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.044 -1.035 . . . . 0.0 111.626 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.38 33.36 9.45 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.6 t -133.07 -160.67 1.07 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.066 -1.256 . . . . 0.0 109.737 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -134.19 144.45 48.47 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.076 -1.015 . . . . 0.0 110.098 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.7 p -131.45 160.58 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.169 -0.957 . . . . 0.0 110.349 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 39.2 t -169.26 95.16 0.32 Allowed 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.219 -0.925 . . . . 0.0 110.928 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.502 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 72.9 t80 -99.25 159.88 14.68 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.273 -0.892 . . . . 0.0 110.767 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 10.1 m170 -138.43 -61.12 0.6 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -138.57 150.82 46.72 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.429 -0.794 . . . . 0.0 109.227 178.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . 0.42 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 30.6 p -93.6 154.12 18.02 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.015 -1.053 . . . . 0.0 110.941 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 19.7 m -73.55 -23.14 19.27 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.46 0 O-C-N 121.363 -0.835 . . . . 0.0 111.669 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -51.39 -62.06 1.85 Allowed 'General case' 0 N--CA 1.515 2.793 0 O-C-N 120.742 -1.224 . . . . 0.0 110.066 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.445 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 21.6 p -124.17 -163.8 1.19 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.265 -0.897 . . . . 0.0 110.385 179.543 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.33 63.86 0.61 Allowed Glycine 0 N--CA 1.491 2.333 0 N-CA-C 107.997 -2.041 . . . . 0.0 107.997 178.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 34.4 t -101.09 142.41 32.59 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.289 -1.124 . . . . 0.0 109.687 -179.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -101.09 43.44 1.06 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.233 -0.917 . . . . 0.0 109.78 179.388 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 80.62 94.81 0.41 Allowed Glycine 0 N--CA 1.486 2.009 0 N-CA-C 109.87 -1.292 . . . . 0.0 109.87 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.8 p -107.85 123.95 49.36 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.272 -1.134 . . . . 0.0 110.205 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -143.1 141.66 31.3 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.081 -1.012 . . . . 0.0 110.089 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.497 1.897 0 O-C-N 121.167 -0.958 . . . . 0.0 109.617 179.544 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.425 ' HB3' ' CZ2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.506 2.365 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.26 162.12 42.51 Favored 'Trans proline' 0 C--N 1.317 -1.092 0 O-C-N 123.311 1.164 . . . . 0.0 110.794 -179.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -48.99 -31.77 8.02 Favored 'General case' 0 N--CA 1.514 2.758 0 O-C-N 121.474 -0.767 . . . . 0.0 111.339 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.53 -34.45 42.69 Favored Glycine 0 N--CA 1.5 2.909 0 O-C-N 120.987 -1.071 . . . . 0.0 110.431 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -54.65 -32.35 59.0 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 120.968 -1.313 . . . . 0.0 110.649 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -55.21 -38.95 69.09 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.012 -1.055 . . . . 0.0 110.194 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 29.5 mttt -58.2 -37.28 74.49 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.236 -0.915 . . . . 0.0 110.078 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.453 ' CG2' ' OH ' ' A' ' 62' ' ' TYR . 1.6 pt -114.62 34.61 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.2 -0.938 . . . . 0.0 110.323 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.442 ' NZ ' ' OG1' ' A' ' 24' ' ' THR . 0.0 OUTLIER -84.73 -43.04 0.7 Allowed Pre-proline 0 N--CA 1.51 2.534 0 O-C-N 120.974 -1.079 . . . . 0.0 113.331 -179.024 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.1 Cg_endo -75.6 -36.66 2.1 Favored 'Trans proline' 0 N--CA 1.487 1.092 0 O-C-N 122.566 0.772 . . . . 0.0 111.583 -178.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 75.2 m -60.4 -43.5 96.63 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.046 -1.034 . . . . 0.0 109.936 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.3 mt -64.05 -39.38 93.96 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.233 -0.917 . . . . 0.0 109.571 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.442 ' OG1' ' NZ ' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -58.95 -37.0 75.74 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.062 -1.024 . . . . 0.0 110.15 179.595 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -57.38 -36.41 71.22 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.167 -0.958 . . . . 0.0 110.29 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.423 ' CD2' ' HD3' ' A' ' 59' ' ' ARG . 16.9 m-85 -57.43 -38.54 74.55 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.085 -1.009 . . . . 0.0 110.47 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -62.96 -22.48 66.84 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.168 -0.958 . . . . 0.0 111.854 -179.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 2.8 mp -81.26 -33.94 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.738 -1.226 . . . . 0.0 109.954 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -81.66 -34.59 30.68 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 120.949 -1.094 . . . . 0.0 109.438 178.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.83 -32.08 59.64 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.1 -1.0 . . . . 0.0 109.942 178.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.2 ptt85 -68.55 -34.84 76.54 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 120.874 -1.141 . . . . 0.0 109.998 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -68.15 -41.1 82.08 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.01 -1.056 . . . . 0.0 109.54 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.419 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -67.21 -43.35 82.29 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.269 -0.895 . . . . 0.0 109.325 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.6 mm100 -61.99 -38.79 89.92 Favored 'General case' 0 N--CA 1.506 2.373 0 C-N-CA 119.454 -0.898 . . . . 0.0 109.815 179.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 37.2 mmtm -62.41 -36.7 83.18 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.101 -1.0 . . . . 0.0 110.422 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.5 t70 . . . . . 0 N--CA 1.509 2.52 0 O-C-N 121.059 -1.026 . . . . 0.0 110.04 -179.891 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 18.7 m . . . . . 0 N--CA 1.499 1.984 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -57.74 -39.62 77.75 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.2 -0.937 . . . . 0.0 109.813 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -60.05 -38.55 83.11 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.15 -0.969 . . . . 0.0 109.917 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 34.2 tp60 -59.09 -42.54 90.7 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 121.068 -1.02 . . . . 0.0 109.895 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.96 -37.93 77.9 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.224 -0.923 . . . . 0.0 109.993 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.446 ' CE3' ' CA ' ' A' ' 149' ' ' GLY . 37.5 m0 -59.95 -36.16 76.48 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.198 -0.939 . . . . 0.0 109.435 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -64.74 -33.11 75.19 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 120.696 -1.252 . . . . 0.0 109.502 178.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.419 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 73.4 mt -71.24 -55.17 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.315 0 O-C-N 120.981 -1.074 . . . . 0.0 109.377 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.464 ' CE ' ' HB2' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -60.56 -32.22 71.3 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 118.687 -1.205 . . . . 0.0 109.5 179.015 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.18 -41.35 96.65 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 120.856 -1.153 . . . . 0.0 108.975 178.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.422 HD22 ' CD2' ' A' ' 26' ' ' PHE . 18.2 mt -54.27 -33.76 59.34 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.242 -0.911 . . . . 0.0 109.779 178.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.442 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 13.8 t60 -56.58 -40.62 75.53 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.105 -0.997 . . . . 0.0 109.545 179.238 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.446 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 7.5 m170 -61.13 -49.84 75.61 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.212 -0.93 . . . . 0.0 108.981 178.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -60.57 -38.46 84.66 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.289 -0.882 . . . . 0.0 109.302 179.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.423 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.71 -48.98 74.91 Favored 'General case' 0 N--CA 1.507 2.381 0 C-N-CA 119.33 -0.948 . . . . 0.0 109.015 179.187 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 76.8 p -66.71 -40.43 88.45 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.159 -0.963 . . . . 0.0 108.881 178.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.405 ' O ' ' OG1' ' A' ' 65' ' ' THR . 39.4 ttt85 -64.17 -37.16 86.46 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.115 -0.99 . . . . 0.0 109.502 178.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.453 ' OH ' ' CG2' ' A' ' 19' ' ' ILE . 40.7 t80 -60.98 -49.73 76.25 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.078 -1.014 . . . . 0.0 109.332 179.473 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.452 HG21 HD12 ' A' ' 63' ' ' ILE . 83.9 mt -75.87 -42.75 39.82 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.32 0 O-C-N 121.207 -0.933 . . . . 0.0 109.011 179.108 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.434 ' CE1' HG21 ' A' ' 92' ' ' ILE . 34.8 t80 -59.05 -26.73 64.85 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.384 -0.822 . . . . 0.0 110.352 178.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.405 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 67.1 m -87.28 -34.69 18.82 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.787 -1.195 . . . . 0.0 110.533 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.406 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -82.9 -34.17 26.71 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 120.77 -1.207 . . . . 0.0 112.151 -179.19 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.439 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 54.2 t80 -86.54 -36.65 18.82 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 120.672 -1.267 . . . . 0.0 111.873 -179.395 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -95.83 -20.58 18.71 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.901 -1.124 . . . . 0.0 112.84 -178.255 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -119.34 -58.05 1.95 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 120.574 -1.329 . . . . 0.0 111.164 -179.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.77 -30.48 71.49 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.004 -1.06 . . . . 0.0 110.655 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 58.74 44.26 17.42 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 120.852 -1.155 . . . . 0.0 110.047 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -115.91 37.61 3.59 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.416 -0.802 . . . . 0.0 109.836 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.458 HD13 HG21 ' A' ' 73' ' ' ILE . 14.2 tt -156.09 162.8 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.182 -0.949 . . . . 0.0 110.118 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.3 p -108.47 147.63 31.39 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.101 -0.999 . . . . 0.0 110.102 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.4 tttp -45.9 -32.67 2.79 Favored 'General case' 0 N--CA 1.516 2.861 0 O-C-N 121.381 -0.825 . . . . 0.0 111.574 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -61.75 -49.33 76.81 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.886 -1.134 . . . . 0.0 109.467 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 50.4 tp -67.42 -44.08 79.64 Favored 'General case' 0 N--CA 1.505 2.317 0 C-N-CA 119.212 -0.995 . . . . 0.0 108.606 178.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.439 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 21.8 t80 -60.98 -38.48 86.1 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.304 -0.872 . . . . 0.0 109.43 178.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -73.89 -42.3 60.9 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.083 -1.011 . . . . 0.0 108.942 178.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.426 ' CE2' ' HG3' ' A' ' 84' ' ' GLU . 81.6 t90 -58.3 -37.04 74.25 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.24 -0.913 . . . . 0.0 109.667 178.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.469 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 13.6 mt -68.96 -48.68 62.6 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.175 -0.953 . . . . 0.0 108.981 179.209 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.436 HG21 HD11 ' A' ' 82' ' ' ILE . 32.4 mm -57.1 -30.89 35.64 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.553 0 O-C-N 121.145 -0.972 . . . . 0.0 110.1 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -87.86 -22.24 24.55 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.896 -1.128 . . . . 0.0 111.804 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.426 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 72.9 mm-40 -100.42 21.17 13.57 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 120.696 -1.253 . . . . 0.0 111.998 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt 73.56 79.42 0.13 Allowed 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.021 -1.049 . . . . 0.0 111.472 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.469 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 31.5 m-85 -137.35 -64.92 0.55 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.554 -0.716 . . . . 0.0 109.669 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -115.47 173.08 6.71 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.425 -0.797 . . . . 0.0 109.212 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.442 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 3.5 t0 -116.95 104.13 10.97 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.072 -1.017 . . . . 0.0 110.403 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.77 -39.23 84.17 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.225 -0.922 . . . . 0.0 109.857 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 18.1 tp -60.92 -40.54 93.58 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.219 -0.925 . . . . 0.0 109.947 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.41 HD23 ' CD2' ' A' ' 57' ' ' HIS . 45.5 tp -70.65 -49.06 51.43 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.266 -0.973 . . . . 0.0 108.875 179.346 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.434 HG21 ' CE1' ' A' ' 64' ' ' TYR . 49.6 mt -62.29 -32.08 53.71 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.32 0 C-N-CA 119.287 -0.965 . . . . 0.0 108.917 178.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -71.76 -42.08 67.64 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.02 -1.05 . . . . 0.0 109.157 178.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.424 ' CD ' ' CD2' ' A' ' 106' ' ' LEU . 13.0 mttp -60.73 -40.1 91.13 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.073 -1.017 . . . . 0.0 110.07 179.346 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 3.4 m0 -66.03 -38.01 87.33 Favored 'General case' 0 N--CA 1.509 2.514 0 C-N-CA 119.188 -1.005 . . . . 0.0 109.967 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.19 -35.27 63.96 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.113 -0.992 . . . . 0.0 110.179 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 17.0 mmtt -53.31 -178.82 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.671 0 O-C-N 121.124 -0.985 . . . . 0.0 110.639 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 18.4 m -107.09 142.05 37.37 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.261 -0.899 . . . . 0.0 109.438 179.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 101.98 -25.39 28.02 Favored Glycine 0 N--CA 1.494 2.508 0 C-N-CA 119.793 -1.194 . . . . 0.0 110.32 -179.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -91.71 57.88 3.34 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 120.691 -1.476 . . . . 0.0 110.111 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -70.65 -38.3 73.82 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.07 -1.019 . . . . 0.0 109.934 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.26 87.88 2.81 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.177 -0.952 . . . . 0.0 110.153 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 15.8 tp -120.35 133.01 55.52 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.187 -0.946 . . . . 0.0 109.733 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.446 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.1 p -106.21 -36.03 7.01 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.175 -0.953 . . . . 0.0 112.165 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.608 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.1 m -140.17 -169.11 2.68 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.26 -1.525 . . . . 0.0 109.461 178.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.424 ' CD2' ' CD ' ' A' ' 94' ' ' LYS . 15.3 mt -98.45 -36.1 10.05 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.064 -1.022 . . . . 0.0 110.662 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 18.3 ttm-85 -103.57 35.25 2.66 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 120.903 -1.123 . . . . 0.0 109.06 177.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.608 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.306 1.7 t -129.12 18.91 5.97 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.273 -0.892 . . . . 0.0 109.011 -178.907 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.3 pt -158.14 38.31 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 O-C-N 120.929 -1.107 . . . . 0.0 110.288 -178.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.415 ' O ' ' OG1' ' A' ' 119' ' ' THR . 11.7 tm0? . . . . . 0 N--CA 1.509 2.525 0 O-C-N 120.878 -1.139 . . . . 0.0 110.79 -178.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.415 ' OG1' ' O ' ' A' ' 110' ' ' GLN . 2.8 m . . . . . 0 N--CA 1.495 1.821 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 48.9 t -102.4 154.98 18.56 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.241 -0.912 . . . . 0.0 109.74 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.472 HG21 HD12 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -73.39 -36.83 49.73 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.348 0 O-C-N 121.202 -0.936 . . . . 0.0 111.016 -179.422 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.472 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 6.5 p -53.35 -31.39 44.26 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 120.775 -1.203 . . . . 0.0 111.262 -178.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.73 -32.89 72.15 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 120.98 -1.075 . . . . 0.0 109.765 178.334 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 53.0 t -81.57 125.5 78.3 Favored Pre-proline 0 N--CA 1.505 2.319 0 O-C-N 121.032 -1.042 . . . . 0.0 110.075 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -67.18 175.9 5.24 Favored 'Trans proline' 0 N--CA 1.488 1.199 0 O-C-N 123.191 1.1 . . . . 0.0 110.639 179.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.11 -36.74 61.65 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.241 -0.912 . . . . 0.0 110.739 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.98 -41.65 83.41 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 120.946 -1.096 . . . . 0.0 110.024 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -68.16 -41.63 81.28 Favored 'General case' 0 N--CA 1.506 2.356 0 C-N-CA 119.317 -0.953 . . . . 0.0 109.221 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.5 mt -62.79 -39.52 94.51 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.236 -0.915 . . . . 0.0 109.669 179.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -59.24 -39.56 83.14 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.191 -0.943 . . . . 0.0 110.027 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -60.19 -39.26 85.89 Favored 'General case' 0 N--CA 1.508 2.46 0 C-N-CA 119.385 -0.926 . . . . 0.0 110.05 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -61.86 -46.09 90.92 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.231 -0.918 . . . . 0.0 109.812 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.53 -41.21 97.0 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.177 -0.952 . . . . 0.0 109.916 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 10.0 mmt-85 -65.57 -33.89 76.98 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.228 -0.92 . . . . 0.0 110.343 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 26.2 ttmt -76.82 -31.67 57.07 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.042 -1.036 . . . . 0.0 111.016 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 4.0 tppt? -99.93 23.38 9.87 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 120.945 -1.097 . . . . 0.0 111.762 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.89 46.74 49.11 Favored Glycine 0 N--CA 1.5 2.913 0 O-C-N 120.732 -1.23 . . . . 0.0 110.951 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 10.1 t -146.61 -163.54 1.77 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.065 -1.256 . . . . 0.0 110.295 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -137.12 151.02 48.38 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.105 -0.997 . . . . 0.0 110.396 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.3 p -132.9 161.1 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.23 -0.919 . . . . 0.0 110.004 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 47.3 t -169.3 75.73 0.09 Allowed 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.172 -0.955 . . . . 0.0 111.211 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.472 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 36.8 t80 -91.86 161.62 14.77 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.263 -0.898 . . . . 0.0 109.975 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 3.3 m80 -139.54 -60.91 0.55 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.517 -0.739 . . . . 0.0 109.157 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.26 152.27 50.69 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 179.259 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 25.4 p -98.66 155.24 17.42 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.313 -0.867 . . . . 0.0 110.532 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.3 p -75.33 -23.31 16.92 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.572 0 O-C-N 121.271 -0.893 . . . . 0.0 112.045 -179.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -52.27 -44.54 65.02 Favored 'General case' 0 N--CA 1.516 2.867 0 O-C-N 120.667 -1.27 . . . . 0.0 109.592 179.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.464 ' HB2' ' CE ' ' A' ' 53' ' ' MET . 29.3 p -140.15 -169.41 2.74 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.34 -0.85 . . . . 0.0 110.599 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . 0.446 ' CA ' ' CE3' ' A' ' 50' ' ' TRP . . . -98.98 56.93 0.93 Allowed Glycine 0 N--CA 1.489 2.169 0 N-CA-C 107.426 -2.27 . . . . 0.0 107.426 178.268 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 24.1 t -101.19 142.51 32.52 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.466 -1.02 . . . . 0.0 109.672 -178.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 2.4 ttp85 -97.4 53.02 1.13 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.258 -0.901 . . . . 0.0 109.379 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.42 97.55 0.03 OUTLIER Glycine 0 N--CA 1.488 2.139 0 N-CA-C 109.559 -1.417 . . . . 0.0 109.559 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 p -107.57 128.69 54.75 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.319 -1.106 . . . . 0.0 110.338 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -136.79 141.58 42.92 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.157 -0.964 . . . . 0.0 110.108 -179.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.498 1.927 0 O-C-N 121.211 -0.931 . . . . 0.0 109.672 179.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.439 ' HB1' ' CE3' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.503 2.198 0 CA-C-O 120.45 0.167 . . . . 0.0 110.69 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -73.75 162.71 38.93 Favored 'Trans proline' 0 C--N 1.318 -1.037 0 O-C-N 123.272 1.143 . . . . 0.0 110.52 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -48.94 -31.95 8.23 Favored 'General case' 0 N--CA 1.516 2.845 0 O-C-N 121.317 -0.864 . . . . 0.0 111.327 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.93 -34.46 51.77 Favored Glycine 0 N--CA 1.498 2.775 0 O-C-N 121.01 -1.056 . . . . 0.0 110.517 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -54.62 -31.8 57.83 Favored 'General case' 0 N--CA 1.511 2.621 0 O-C-N 120.924 -1.339 . . . . 0.0 110.821 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -54.24 -37.83 65.07 Favored 'General case' 0 N--CA 1.512 2.652 0 O-C-N 120.886 -1.134 . . . . 0.0 110.286 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 15.8 mttm -59.27 -37.62 78.07 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.254 -0.904 . . . . 0.0 110.139 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.426 HG23 ' OH ' ' A' ' 62' ' ' TYR . 1.7 pt -116.3 34.78 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 O-C-N 121.166 -0.959 . . . . 0.0 110.498 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.42 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.4 OUTLIER -85.1 -43.72 0.67 Allowed Pre-proline 0 N--CA 1.509 2.52 0 O-C-N 121.038 -1.039 . . . . 0.0 113.529 -178.911 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.42 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.1 Cg_endo -74.8 -34.14 4.32 Favored 'Trans proline' 0 N--CA 1.487 1.095 0 O-C-N 122.529 0.752 . . . . 0.0 111.96 -177.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 91.6 m -62.06 -47.78 83.16 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 120.909 -1.119 . . . . 0.0 109.792 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.7 mt -62.45 -39.53 93.68 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.27 -0.894 . . . . 0.0 109.519 179.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.7 m -57.1 -34.82 68.73 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.17 -0.956 . . . . 0.0 110.206 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -56.62 -37.13 70.27 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.094 -1.004 . . . . 0.0 110.266 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.449 ' CD1' ' CD ' ' A' ' 59' ' ' ARG . 20.2 m-85 -56.97 -37.4 71.54 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.141 -0.974 . . . . 0.0 110.254 179.576 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -56.45 -27.81 57.86 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.23 -0.919 . . . . 0.0 110.975 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 2.7 mp -77.75 -35.82 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.45 0 O-C-N 121.044 -1.035 . . . . 0.0 109.411 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -79.83 -40.03 29.41 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.006 -1.059 . . . . 0.0 108.603 178.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.415 ' CD1' ' CG2' ' A' ' 52' ' ' ILE . 7.0 tp -69.46 -34.04 73.81 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.238 -0.914 . . . . 0.0 110.364 179.066 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -71.41 -35.72 71.09 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 118.833 -1.147 . . . . 0.0 109.854 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -65.33 -39.95 93.05 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.106 -0.996 . . . . 0.0 109.645 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.406 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -72.76 -42.02 64.45 Favored 'General case' 0 N--CA 1.504 2.265 0 C-N-CA 119.167 -1.013 . . . . 0.0 109.031 179.01 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -62.92 -34.11 76.76 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.282 -0.887 . . . . 0.0 109.936 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 40.7 mmtt -84.4 -32.68 24.01 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.036 -1.04 . . . . 0.0 110.78 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.1 t70 . . . . . 0 N--CA 1.511 2.616 0 O-C-N 120.985 -1.072 . . . . 0.0 110.392 179.88 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.8 t . . . . . 0 N--CA 1.504 2.236 0 CA-C-O 120.432 0.158 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 50.0 m-20 -55.85 -38.99 70.83 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 120.982 -1.074 . . . . 0.0 110.122 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -62.36 -41.57 98.72 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.236 -0.915 . . . . 0.0 109.67 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 55.7 tp60 -61.98 -40.62 96.24 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.19 -0.944 . . . . 0.0 109.681 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -58.68 -39.02 79.51 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.172 -0.955 . . . . 0.0 109.979 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.429 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 52.8 m0 -58.56 -36.84 74.55 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.153 -0.967 . . . . 0.0 109.826 179.398 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -60.71 -30.19 69.81 Favored 'General case' 0 N--CA 1.506 2.325 0 O-C-N 121.08 -1.013 . . . . 0.0 109.733 178.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.415 ' CG2' ' CD1' ' A' ' 30' ' ' LEU . 22.6 mt -71.36 -60.64 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.226 0 O-C-N 120.952 -1.092 . . . . 0.0 108.845 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -60.51 -28.69 68.58 Favored 'General case' 0 N--CA 1.51 2.537 0 C-N-CA 118.547 -1.261 . . . . 0.0 109.774 178.61 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -72.24 -39.22 68.62 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 120.875 -1.14 . . . . 0.0 108.89 178.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 11.0 mt -54.04 -33.71 58.06 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 121.105 -0.997 . . . . 0.0 110.269 178.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.439 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 12.9 t60 -57.03 -35.39 69.22 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.089 -1.007 . . . . 0.0 110.438 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.444 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.3 m170 -60.56 -50.65 72.69 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 120.981 -1.074 . . . . 0.0 109.603 179.314 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -58.72 -35.83 73.29 Favored 'General case' 0 N--CA 1.508 2.449 0 C-N-CA 119.501 -0.88 . . . . 0.0 109.596 179.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.449 ' CD ' ' CD1' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -68.27 -49.61 59.37 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.079 -1.013 . . . . 0.0 109.176 179.003 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.1 p -62.12 -38.46 89.02 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.201 -0.937 . . . . 0.0 109.356 179.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.407 ' O ' ' OG1' ' A' ' 65' ' ' THR . 37.5 ttt-85 -65.12 -38.22 89.97 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.092 -1.005 . . . . 0.0 109.384 179.075 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.426 ' OH ' HG23 ' A' ' 19' ' ' ILE . 34.1 t80 -59.78 -48.87 79.95 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.211 -0.93 . . . . 0.0 109.368 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.402 ' CG2' ' CD1' ' A' ' 78' ' ' TYR . 92.0 mt -76.27 -44.25 36.42 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.266 0 C-N-CA 119.505 -0.878 . . . . 0.0 108.869 179.121 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.432 ' CE1' HG21 ' A' ' 92' ' ' ILE . 40.9 t80 -58.92 -25.7 63.67 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.323 -0.86 . . . . 0.0 110.365 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.407 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 88.4 m -87.25 -36.09 18.13 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.756 -1.215 . . . . 0.0 110.373 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.7 pp -82.92 -33.08 26.93 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 120.813 -1.179 . . . . 0.0 112.34 -179.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.404 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 33.3 t80 -86.42 -34.61 20.1 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 120.707 -1.246 . . . . 0.0 111.922 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -96.21 -22.02 17.52 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 120.903 -1.123 . . . . 0.0 112.986 -178.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.5 mtpt -112.59 -58.13 2.19 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 120.527 -1.358 . . . . 0.0 110.979 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.2 mmm-85 -71.7 -29.39 64.51 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.139 -0.975 . . . . 0.0 110.919 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 58.83 43.91 17.61 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.815 -1.178 . . . . 0.0 109.953 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.01 35.08 3.52 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.302 -0.874 . . . . 0.0 109.807 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.452 HD11 HG23 ' A' ' 73' ' ' ILE . 13.4 tt -153.1 162.7 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.23 -0.919 . . . . 0.0 109.784 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.4 p -107.44 146.76 31.31 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.089 -1.007 . . . . 0.0 110.415 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -46.34 -32.31 3.09 Favored 'General case' 0 N--CA 1.516 2.869 0 O-C-N 121.307 -0.87 . . . . 0.0 111.469 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -62.14 -49.68 74.88 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 120.894 -1.129 . . . . 0.0 109.302 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.5 tp -67.28 -43.46 81.74 Favored 'General case' 0 N--CA 1.505 2.295 0 C-N-CA 119.185 -1.006 . . . . 0.0 108.552 178.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.404 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 17.5 t80 -61.64 -38.87 89.27 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.291 -0.88 . . . . 0.0 109.432 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -72.22 -42.41 65.77 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 120.998 -1.064 . . . . 0.0 108.991 178.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.439 ' CE3' ' HB1' ' A' ' 12' ' ' ALA . 84.2 t90 -57.94 -36.89 73.16 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.214 -0.929 . . . . 0.0 109.691 179.159 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.462 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 30.7 mt -68.75 -46.06 69.82 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.129 -0.982 . . . . 0.0 109.116 179.296 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.458 HG23 HD11 ' A' ' 82' ' ' ILE . 35.2 mm -58.46 -32.84 46.47 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.532 0 O-C-N 121.26 -0.9 . . . . 0.0 110.001 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.5 mmtp -89.16 -8.79 52.98 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 120.895 -1.128 . . . . 0.0 112.278 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.435 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 75.7 mm-40 -112.17 21.55 15.71 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 120.556 -1.34 . . . . 0.0 112.04 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt 74.05 77.9 0.12 Allowed 'General case' 0 N--CA 1.51 2.543 0 O-C-N 120.97 -1.081 . . . . 0.0 111.456 179.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.462 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 33.6 m-85 -137.06 -63.0 0.62 Allowed 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.558 -0.714 . . . . 0.0 109.49 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -126.38 175.97 7.47 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.403 -0.811 . . . . 0.0 109.44 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.439 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 19.1 t0 -116.24 105.5 12.64 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.114 -0.991 . . . . 0.0 110.505 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 13.1 mmmt -61.34 -39.74 91.69 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.228 -0.92 . . . . 0.0 109.655 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 26.9 tp -60.49 -42.41 96.28 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.104 -0.997 . . . . 0.0 109.658 179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.443 HD21 ' NE2' ' A' ' 57' ' ' HIS . 43.4 tp -67.78 -49.36 62.82 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.291 -0.964 . . . . 0.0 109.119 179.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.432 HG21 ' CE1' ' A' ' 64' ' ' TYR . 34.3 mt -58.54 -29.88 39.97 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.48 0 C-N-CA 119.27 -0.972 . . . . 0.0 109.212 178.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.68 -46.2 66.62 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 120.911 -1.118 . . . . 0.0 109.328 178.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.418 ' CD ' ' CD2' ' A' ' 106' ' ' LEU . 6.4 mttp -58.16 -38.94 77.61 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.094 -1.004 . . . . 0.0 110.084 179.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.415 ' CH2' HD21 ' A' ' 91' ' ' LEU . 5.6 m0 -66.27 -39.98 89.81 Favored 'General case' 0 N--CA 1.508 2.467 0 C-N-CA 119.318 -0.953 . . . . 0.0 109.515 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.05 -33.65 70.49 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.282 -0.886 . . . . 0.0 110.358 179.468 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.6 mmtp -53.78 -177.17 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.699 0 O-C-N 121.037 -1.039 . . . . 0.0 110.651 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -106.34 133.22 51.37 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.183 -0.948 . . . . 0.0 109.797 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.95 3.1 56.0 Favored Glycine 0 N--CA 1.493 2.487 0 C-N-CA 120.06 -1.067 . . . . 0.0 111.31 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -108.62 48.48 0.86 Allowed 'General case' 0 N--CA 1.498 1.968 0 CA-C-N 119.645 1.723 . . . . 0.0 110.115 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -64.58 -39.51 93.87 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.213 -0.93 . . . . 0.0 109.911 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.78 104.26 11.78 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.153 -0.967 . . . . 0.0 109.979 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 8.9 tp -141.59 132.48 25.93 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.17 -0.956 . . . . 0.0 109.713 -179.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.444 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.4 p -108.4 -37.3 6.01 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.176 -0.953 . . . . 0.0 112.305 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.583 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.6 m -140.76 -168.93 2.69 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 120.265 -1.522 . . . . 0.0 109.924 178.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.418 ' CD2' ' CD ' ' A' ' 94' ' ' LYS . 32.7 mt -97.69 -36.74 10.15 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.035 -1.04 . . . . 0.0 110.462 179.272 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 12.1 ttm-85 -103.11 32.72 3.6 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 120.92 -1.112 . . . . 0.0 109.473 178.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.583 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.309 1.7 t -128.98 16.47 6.24 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.207 -0.933 . . . . 0.0 109.219 -179.066 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.1 pt -158.89 37.99 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 O-C-N 120.843 -1.161 . . . . 0.0 110.604 -178.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.414 ' O ' ' OG1' ' A' ' 119' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.099 0 O-C-N 120.708 -1.245 . . . . 0.0 111.79 -178.433 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.414 ' OG1' ' O ' ' A' ' 110' ' ' GLN . 2.5 m . . . . . 0 N--CA 1.493 1.711 0 N-CA-C 110.216 -0.291 . . . . 0.0 110.216 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 45.6 t -92.14 154.44 18.7 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.296 -0.878 . . . . 0.0 109.038 178.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.448 ' CG2' ' CE1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -71.31 -36.33 61.17 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.42 0 O-C-N 121.101 -1.0 . . . . 0.0 110.882 -179.159 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.472 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.4 p -55.37 -34.35 64.23 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 120.828 -1.17 . . . . 0.0 110.869 -179.004 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 3.0 ttp85 -59.36 -35.55 74.1 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.006 -1.059 . . . . 0.0 109.65 178.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 55.6 t -78.91 125.03 84.67 Favored Pre-proline 0 N--CA 1.503 2.202 0 O-C-N 121.171 -0.956 . . . . 0.0 109.823 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -65.03 174.92 4.26 Favored 'Trans proline' 0 N--CA 1.487 1.133 0 O-C-N 123.143 1.075 . . . . 0.0 110.734 179.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -75.05 -36.18 61.83 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.203 -0.936 . . . . 0.0 110.719 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.53 -40.9 79.79 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.005 -1.06 . . . . 0.0 109.985 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 7.7 tp60 -69.68 -41.32 75.63 Favored 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 119.341 -0.944 . . . . 0.0 109.274 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 3.1 mt -65.5 -38.77 90.67 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.204 -0.935 . . . . 0.0 109.554 179.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -61.25 -39.91 92.09 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.181 -0.949 . . . . 0.0 109.757 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -59.03 -37.13 76.25 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.179 -0.951 . . . . 0.0 110.326 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -61.4 -44.97 96.22 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.115 -0.991 . . . . 0.0 110.057 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.8 -41.68 96.13 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.172 -0.955 . . . . 0.0 109.914 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 11.0 mtt180 -59.46 -36.9 76.85 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.143 -0.973 . . . . 0.0 110.178 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 44.6 mttm -65.93 -33.77 76.59 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.075 -1.016 . . . . 0.0 110.81 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 35.6 mtmt -105.51 22.39 15.56 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 120.931 -1.106 . . . . 0.0 111.923 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.72 46.47 54.16 Favored Glycine 0 N--CA 1.499 2.89 0 O-C-N 120.608 -1.307 . . . . 0.0 110.799 179.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.4 t -138.84 -163.5 1.48 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.197 -1.178 . . . . 0.0 110.088 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -138.6 146.62 41.99 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.098 -1.001 . . . . 0.0 110.549 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.9 p -131.0 161.46 40.98 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.185 -0.947 . . . . 0.0 109.723 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 42.1 t -166.75 83.56 0.26 Allowed 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.128 -0.982 . . . . 0.0 111.305 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.472 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 38.9 t80 -95.0 161.75 14.01 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.295 -0.878 . . . . 0.0 110.049 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -140.67 -60.61 0.51 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.571 -0.705 . . . . 0.0 109.19 179.011 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.22 151.25 50.94 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.437 -0.789 . . . . 0.0 109.293 178.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 28.0 p -97.06 154.43 17.33 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.122 -0.986 . . . . 0.0 111.065 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 19.7 m -74.06 -23.35 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.433 0 O-C-N 121.395 -0.816 . . . . 0.0 111.676 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -51.68 -52.01 51.44 Favored 'General case' 0 N--CA 1.515 2.779 0 O-C-N 120.717 -1.239 . . . . 0.0 109.967 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.429 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 26.4 p -133.58 -164.88 1.55 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.329 -0.857 . . . . 0.0 110.518 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.59 56.51 0.78 Allowed Glycine 0 N--CA 1.492 2.386 0 N-CA-C 107.925 -2.07 . . . . 0.0 107.925 178.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 18.3 t -101.39 144.07 30.65 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.33 -1.1 . . . . 0.0 109.912 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 7.6 ttm-85 -98.49 50.27 0.99 Allowed 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.3 -0.875 . . . . 0.0 109.531 179.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 69.73 98.82 0.04 OUTLIER Glycine 0 N--CA 1.488 2.106 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.0 p -111.13 128.32 55.85 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.237 -1.155 . . . . 0.0 110.229 179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -144.95 137.31 26.07 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.075 -1.016 . . . . 0.0 110.2 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.502 2.156 0 O-C-N 121.208 -0.933 . . . . 0.0 110.559 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.431 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.499 1.987 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -69.94 162.7 41.19 Favored 'Trans proline' 0 C--N 1.317 -1.125 0 O-C-N 123.315 1.166 . . . . 0.0 110.812 -179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -48.7 -31.83 7.46 Favored 'General case' 0 N--CA 1.514 2.758 0 O-C-N 121.451 -0.78 . . . . 0.0 111.339 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.67 -34.29 43.47 Favored Glycine 0 N--CA 1.499 2.861 0 O-C-N 120.941 -1.1 . . . . 0.0 110.609 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -55.6 -33.19 63.73 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 120.965 -1.315 . . . . 0.0 110.688 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -54.03 -37.65 64.33 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 121.04 -1.037 . . . . 0.0 110.187 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -58.9 -37.45 76.64 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.288 -0.882 . . . . 0.0 110.072 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.428 HG21 ' OH ' ' A' ' 62' ' ' TYR . 2.5 pt -116.43 34.5 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 O-C-N 121.118 -0.989 . . . . 0.0 110.554 179.689 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -82.89 -44.29 0.89 Allowed Pre-proline 0 N--CA 1.51 2.544 0 O-C-N 121.011 -1.055 . . . . 0.0 112.871 -179.252 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.4 Cg_endo -76.68 -36.12 1.74 Allowed 'Trans proline' 0 N--CA 1.486 1.087 0 O-C-N 122.642 0.811 . . . . 0.0 111.407 -178.464 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.417 HG21 ' CE2' ' A' ' 62' ' ' TYR . 87.3 m -58.71 -41.77 87.1 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 120.986 -1.071 . . . . 0.0 109.964 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.412 HD21 ' CD2' ' A' ' 86' ' ' TYR . 2.3 mt -66.84 -40.97 88.14 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.263 -0.898 . . . . 0.0 109.397 179.481 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.6 m -59.42 -35.26 73.68 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.199 -0.938 . . . . 0.0 110.084 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -57.04 -36.94 71.07 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 121.036 -1.04 . . . . 0.0 110.266 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.408 ' CE2' ' HG3' ' A' ' 59' ' ' ARG . 12.5 m-85 -58.18 -37.95 75.74 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.136 -0.977 . . . . 0.0 110.497 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -60.74 -39.78 89.98 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.147 -0.971 . . . . 0.0 110.602 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.1 mp -65.83 -41.57 90.4 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 C-N-CA 119.23 -0.988 . . . . 0.0 109.039 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -67.78 -48.16 67.13 Favored 'General case' 0 N--CA 1.505 2.319 0 C-N-CA 119.224 -0.99 . . . . 0.0 108.643 178.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.93 -36.39 83.24 Favored 'General case' 0 N--CA 1.509 2.507 0 C-N-CA 119.35 -0.94 . . . . 0.0 108.936 178.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -57.31 -41.8 80.59 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.061 -1.025 . . . . 0.0 109.879 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -61.99 -45.28 94.33 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 119.393 -0.923 . . . . 0.0 109.862 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.413 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -68.72 -39.68 80.29 Favored 'General case' 0 N--CA 1.507 2.385 0 C-N-CA 119.343 -0.943 . . . . 0.0 109.652 179.479 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -68.93 -31.13 69.81 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.218 -0.926 . . . . 0.0 110.647 179.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.9 mtpt -98.02 -29.17 13.43 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.94 -1.1 . . . . 0.0 111.886 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 . . . . . 0 N--CA 1.511 2.59 0 O-C-N 120.757 -1.214 . . . . 0.0 110.344 -179.837 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.501 2.077 0 CA-C-O 120.608 0.242 . . . . 0.0 110.871 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -57.85 -40.31 79.84 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.098 -1.001 . . . . 0.0 110.151 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -59.94 -39.29 85.02 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.26 -0.9 . . . . 0.0 110.052 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -62.36 -45.94 90.93 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.174 -0.954 . . . . 0.0 109.736 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 23.9 mt -59.21 -36.74 75.94 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.177 -0.952 . . . . 0.0 110.32 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 47.7 m0 -58.63 -37.74 76.56 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 121.035 -1.04 . . . . 0.0 110.038 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -61.22 -32.86 72.64 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 119.148 -1.021 . . . . 0.0 109.701 178.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.413 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 74.1 mt -71.06 -59.65 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.283 0 O-C-N 121.092 -1.005 . . . . 0.0 108.883 179.101 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -61.1 -29.4 69.73 Favored 'General case' 0 N--CA 1.511 2.591 0 C-N-CA 118.544 -1.263 . . . . 0.0 109.754 178.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -69.48 -37.15 77.14 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.79 -1.194 . . . . 0.0 109.062 178.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 10.9 mt -53.31 -33.55 53.81 Favored 'General case' 0 N--CA 1.511 2.616 0 O-C-N 120.982 -1.074 . . . . 0.0 110.179 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.444 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 71.1 t60 -54.47 -38.28 66.22 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 120.965 -1.085 . . . . 0.0 110.059 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.429 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.6 m170 -61.09 -48.08 83.35 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.193 -0.942 . . . . 0.0 109.359 179.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -59.39 -36.57 76.06 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.279 -0.888 . . . . 0.0 109.676 179.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.408 ' HG3' ' CE2' ' A' ' 26' ' ' PHE . 8.0 mtp85 -63.59 -49.58 72.79 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.125 -0.984 . . . . 0.0 109.477 179.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 93.8 p -63.83 -40.74 97.34 Favored 'General case' 0 N--CA 1.504 2.269 0 C-N-CA 119.301 -0.96 . . . . 0.0 109.118 179.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.422 ' O ' ' OG1' ' A' ' 65' ' ' THR . 3.9 ttt85 -62.14 -38.85 90.55 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.192 -0.943 . . . . 0.0 109.405 179.018 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.428 ' OH ' HG21 ' A' ' 19' ' ' ILE . 39.1 t80 -62.94 -51.7 65.88 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.081 -1.012 . . . . 0.0 109.345 179.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 92.7 mt -69.81 -37.97 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.365 0 C-N-CA 119.321 -0.952 . . . . 0.0 109.332 179.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.422 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 7.1 t80 -66.1 -42.65 89.0 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.127 -0.983 . . . . 0.0 109.018 178.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.422 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 92.9 m -60.78 -40.88 94.21 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.19 -0.944 . . . . 0.0 110.384 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.7 pp -83.14 -35.34 25.64 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.818 -1.176 . . . . 0.0 112.422 -178.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 30.6 t80 -86.48 -33.02 20.49 Favored 'General case' 0 N--CA 1.513 2.712 0 O-C-N 120.589 -1.319 . . . . 0.0 112.054 -179.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.422 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 7.0 m-85 -98.41 -6.29 30.88 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 120.802 -1.186 . . . . 0.0 113.138 -178.444 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 15.0 mtpt -129.8 -58.09 1.1 Allowed 'General case' 0 N--CA 1.502 2.17 0 O-C-N 120.366 -1.459 . . . . 0.0 110.534 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.3 mtt85 -72.01 -28.95 63.72 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.145 -0.972 . . . . 0.0 110.83 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.7 tttp 58.58 43.62 18.89 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.771 -1.205 . . . . 0.0 110.034 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -109.85 34.23 3.96 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.363 -0.836 . . . . 0.0 109.915 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.448 HD11 HG21 ' A' ' 73' ' ' ILE . 13.4 tt -151.07 162.65 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 O-C-N 121.202 -0.936 . . . . 0.0 109.657 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.8 t -107.92 144.3 35.36 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.128 -0.983 . . . . 0.0 110.34 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 50.6 tttt -45.08 -32.48 1.76 Allowed 'General case' 0 N--CA 1.515 2.785 0 O-C-N 121.328 -0.857 . . . . 0.0 111.732 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.42 -49.65 76.02 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 120.915 -1.115 . . . . 0.0 109.321 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 33.6 tp -67.09 -46.93 72.75 Favored 'General case' 0 N--CA 1.505 2.276 0 C-N-CA 119.077 -1.049 . . . . 0.0 108.45 178.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -58.15 -38.64 76.98 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.294 -0.879 . . . . 0.0 109.395 178.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -71.7 -42.97 66.73 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.035 -1.041 . . . . 0.0 108.433 178.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.443 ' CE2' ' HG3' ' A' ' 84' ' ' GLU . 73.4 t90 -56.33 -37.76 70.4 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.265 -0.897 . . . . 0.0 109.561 178.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.45 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 8.0 mt -66.56 -50.39 63.28 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.206 -0.934 . . . . 0.0 109.153 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.449 HG21 HD13 ' A' ' 82' ' ' ILE . 36.9 mm -57.91 -33.18 45.24 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.545 0 O-C-N 121.178 -0.951 . . . . 0.0 110.181 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -89.18 -6.07 57.21 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.894 -1.129 . . . . 0.0 112.416 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.443 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 17.3 mm-40 -115.01 22.61 13.24 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.395 -1.441 . . . . 0.0 112.016 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt 75.08 72.82 0.1 Allowed 'General case' 0 N--CA 1.511 2.623 0 O-C-N 121.104 -0.997 . . . . 0.0 111.679 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.45 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 31.5 m-85 -133.37 -62.35 0.79 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.432 -0.793 . . . . 0.0 109.333 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -132.24 167.26 20.13 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.467 -0.771 . . . . 0.0 109.593 179.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.444 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.5 t0 -109.77 107.24 17.16 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.155 -0.965 . . . . 0.0 110.237 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 12.4 mmtt -58.17 -38.15 76.08 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.263 -0.898 . . . . 0.0 110.035 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.6 tp -58.82 -38.43 78.62 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.213 -0.929 . . . . 0.0 110.161 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.409 HD23 ' CD2' ' A' ' 57' ' ' HIS . 57.6 tp -71.23 -45.35 63.49 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.133 -0.979 . . . . 0.0 108.835 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.439 HD13 HG21 ' A' ' 92' ' ' ILE . 24.9 mt -59.63 -37.78 72.38 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 C-N-CA 119.396 -0.921 . . . . 0.0 108.531 178.208 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.73 -38.99 87.78 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.176 -0.953 . . . . 0.0 109.112 178.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.414 ' HE3' ' CZ ' ' A' ' 100' ' ' TYR . 9.8 mmtm -57.75 -41.25 81.5 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.001 -1.062 . . . . 0.0 109.755 179.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.3 m0 -68.1 -35.36 78.03 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.259 -0.901 . . . . 0.0 110.337 179.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 10.1 mtp85 -83.36 -31.41 26.77 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.072 -1.018 . . . . 0.0 110.888 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.3 mmtt -51.63 177.15 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.739 0 O-C-N 120.865 -1.147 . . . . 0.0 110.759 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.58 140.67 37.23 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.202 -0.936 . . . . 0.0 109.48 179.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 101.07 -23.52 35.23 Favored Glycine 0 N--CA 1.493 2.474 0 C-N-CA 119.814 -1.184 . . . . 0.0 110.407 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.414 ' CZ ' ' HE3' ' A' ' 94' ' ' LYS . 63.5 m-85 -92.04 58.11 3.27 Favored 'General case' 0 N--CA 1.504 2.246 0 CA-C-N 119.098 1.449 . . . . 0.0 110.056 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -66.92 -32.83 74.35 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.138 -0.976 . . . . 0.0 110.522 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt -132.9 102.07 5.49 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.002 -1.061 . . . . 0.0 110.506 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.9 pp -140.62 155.0 46.67 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.083 -1.011 . . . . 0.0 110.551 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.429 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.5 p -118.95 -35.61 3.61 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.29 -0.881 . . . . 0.0 113.222 -179.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.612 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.4 m -142.91 -170.72 3.3 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.253 -1.529 . . . . 0.0 110.384 179.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 24.3 mt -98.35 -35.91 10.15 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.28 -0.887 . . . . 0.0 110.333 178.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 1.1 ttt-85 -103.47 35.18 2.67 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.816 -1.177 . . . . 0.0 109.538 178.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.612 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.279 1.7 t -126.85 -59.75 1.25 Allowed 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 105.65 -1.982 . . . . 0.0 105.65 -179.631 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.401 HG13 ' N ' ' A' ' 110' ' ' GLN . 15.1 pt -68.95 -26.01 31.45 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.546 0 O-C-N 120.902 -1.124 . . . . 0.0 110.854 176.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.401 ' N ' HG13 ' A' ' 109' ' ' ILE . 44.3 tt0 . . . . . 0 N--CA 1.494 1.735 0 O-C-N 120.972 -1.08 . . . . 0.0 110.138 -179.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 1.7 m . . . . . 0 N--CA 1.495 1.788 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 34.0 t -53.41 153.94 3.73 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 120.928 -1.108 . . . . 0.0 109.801 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.461 HG21 HD11 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -73.77 -35.26 43.01 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.444 0 O-C-N 121.08 -1.012 . . . . 0.0 111.161 -178.948 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.506 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 12.1 p -54.52 -33.53 60.16 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 120.735 -1.228 . . . . 0.0 111.208 -178.827 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -34.16 70.1 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.907 -1.121 . . . . 0.0 109.635 178.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 53.0 t -81.65 124.66 79.62 Favored Pre-proline 0 N--CA 1.505 2.282 0 O-C-N 121.123 -0.985 . . . . 0.0 109.779 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -66.25 178.82 2.28 Favored 'Trans proline' 0 N--CA 1.489 1.234 0 O-C-N 123.194 1.102 . . . . 0.0 110.637 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 6.6 tpt180 -75.04 -38.41 61.44 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.197 -0.939 . . . . 0.0 110.427 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.26 -43.32 92.45 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.074 -1.016 . . . . 0.0 109.809 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.8 tm0? -67.31 -41.17 85.81 Favored 'General case' 0 N--CA 1.505 2.296 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.239 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 74.6 mt -63.96 -39.94 95.3 Favored 'General case' 0 N--CA 1.506 2.369 0 C-N-CA 119.493 -0.883 . . . . 0.0 109.491 179.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -59.2 -38.3 79.52 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.119 -0.988 . . . . 0.0 109.966 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -57.52 -36.48 71.63 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.107 -0.995 . . . . 0.0 110.397 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -63.07 -48.94 76.47 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.205 -0.934 . . . . 0.0 109.833 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -59.08 -38.43 79.44 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.09 -1.007 . . . . 0.0 109.834 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -59.74 -38.58 82.12 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.146 -0.971 . . . . 0.0 110.207 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 58.7 mttt -87.13 -42.14 13.25 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.071 -1.018 . . . . 0.0 109.96 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 21.6 mmtt -63.03 -25.82 68.56 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.27 -0.894 . . . . 0.0 111.178 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.75 33.51 9.07 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 7.8 t -145.99 -160.84 1.2 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.084 -1.245 . . . . 0.0 109.91 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -130.89 143.85 51.03 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.079 -1.013 . . . . 0.0 109.967 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 12.3 p -124.85 160.28 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.206 -0.934 . . . . 0.0 110.722 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 43.8 t -165.5 87.97 0.41 Allowed 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.365 -0.834 . . . . 0.0 110.6 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.506 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 60.5 t80 -100.41 161.1 13.82 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.23 -0.919 . . . . 0.0 110.999 -179.19 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -139.29 -60.96 0.56 Allowed 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -134.68 150.52 50.64 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.359 -0.838 . . . . 0.0 108.952 178.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . 0.421 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.5 p -90.79 152.71 20.68 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.056 -1.027 . . . . 0.0 111.237 -179.528 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.8 m -70.9 -26.5 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 C-N-CA 119.736 -0.786 . . . . 0.0 111.298 -179.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -50.38 -58.83 4.8 Favored 'General case' 0 N--CA 1.515 2.818 0 O-C-N 120.9 -1.125 . . . . 0.0 110.221 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 22.9 p -128.3 -166.73 1.67 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.248 -0.908 . . . . 0.0 110.451 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -99.95 60.92 0.71 Allowed Glycine 0 N--CA 1.493 2.44 0 N-CA-C 108.076 -2.01 . . . . 0.0 108.076 178.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 17.4 t -98.72 145.44 26.9 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.315 -1.109 . . . . 0.0 109.902 -179.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 32.4 mtt-85 -98.62 49.93 0.98 Allowed 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.236 -0.915 . . . . 0.0 109.444 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 68.18 97.39 0.04 OUTLIER Glycine 0 N--CA 1.488 2.141 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 22.4 p -109.94 129.08 55.71 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.163 -1.198 . . . . 0.0 110.508 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -151.0 140.17 21.2 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.187 -0.946 . . . . 0.0 110.179 -179.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.493 1.706 0 O-C-N 121.211 -0.931 . . . . 0.0 110.277 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.432 ' HB3' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.503 2.201 0 CA-C-O 120.432 0.158 . . . . 0.0 110.721 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -72.6 165.21 33.38 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 O-C-N 123.287 1.151 . . . . 0.0 110.612 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -48.47 -32.02 7.21 Favored 'General case' 0 N--CA 1.515 2.776 0 O-C-N 121.481 -0.762 . . . . 0.0 111.391 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.83 -34.84 51.82 Favored Glycine 0 N--CA 1.498 2.795 0 N-CA-C 110.449 -1.061 . . . . 0.0 110.449 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -54.77 -32.74 60.42 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 120.919 -1.341 . . . . 0.0 110.673 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -53.94 -37.66 64.12 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 121.015 -1.053 . . . . 0.0 110.276 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.0 mmpt? -58.31 -36.13 72.88 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.203 -0.935 . . . . 0.0 110.275 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pt -117.06 36.26 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.181 -0.95 . . . . 0.0 110.547 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.422 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.5 OUTLIER -83.22 -44.68 0.85 Allowed Pre-proline 0 N--CA 1.509 2.514 0 O-C-N 121.075 -1.016 . . . . 0.0 113.065 -179.178 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.422 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.1 Cg_endo -75.64 -35.87 2.48 Favored 'Trans proline' 0 N--CA 1.485 1.027 0 O-C-N 122.655 0.819 . . . . 0.0 111.757 -178.138 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 60.7 m -60.35 -43.64 96.31 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 120.933 -1.104 . . . . 0.0 110.014 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.416 HD21 ' CD2' ' A' ' 86' ' ' TYR . 4.2 mt -65.49 -41.03 93.73 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 119.45 -0.9 . . . . 0.0 109.419 179.488 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -57.56 -34.15 68.88 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.164 -0.96 . . . . 0.0 110.192 179.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -57.0 -37.21 71.34 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.106 -0.996 . . . . 0.0 110.316 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -58.76 -38.69 79.03 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.136 -0.977 . . . . 0.0 110.476 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -59.56 -39.7 84.92 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.164 -0.96 . . . . 0.0 110.437 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.0 mp -64.99 -40.22 88.35 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 C-N-CA 119.227 -0.989 . . . . 0.0 108.958 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -69.01 -50.41 49.1 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.122 -0.986 . . . . 0.0 108.887 178.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.94 -35.54 77.0 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.119 -0.988 . . . . 0.0 109.278 178.535 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.44 -39.36 70.2 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 121.087 -1.008 . . . . 0.0 109.911 179.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.41 -41.75 88.8 Favored 'General case' 0 N--CA 1.507 2.376 0 C-N-CA 119.206 -0.998 . . . . 0.0 109.395 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.419 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -70.84 -41.92 70.85 Favored 'General case' 0 N--CA 1.504 2.229 0 C-N-CA 119.228 -0.989 . . . . 0.0 109.073 179.068 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -60.4 -34.44 73.92 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.285 -0.885 . . . . 0.0 109.963 179.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.8 mmmt -80.08 -29.69 39.16 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.0 -1.062 . . . . 0.0 110.965 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.513 2.721 0 O-C-N 120.808 -1.183 . . . . 0.0 110.266 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.499 1.99 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.401 ' OD1' ' CZ2' ' A' ' 50' ' ' TRP . 1.5 t-20 -62.69 -39.65 94.65 Favored 'General case' 0 N--CA 1.506 2.345 0 C-N-CA 119.446 -0.902 . . . . 0.0 109.338 179.173 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -65.75 -40.15 91.79 Favored 'General case' 0 N--CA 1.507 2.39 0 C-N-CA 119.473 -0.891 . . . . 0.0 109.566 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -63.31 -40.86 98.51 Favored 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 119.413 -0.915 . . . . 0.0 109.664 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.4 mt -59.54 -39.28 83.46 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.13 -0.981 . . . . 0.0 109.72 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.444 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.1 m0 -58.01 -36.23 72.39 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.202 -0.936 . . . . 0.0 109.842 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -62.41 -29.89 70.82 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.054 -1.028 . . . . 0.0 109.672 178.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.419 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 46.4 mt -70.55 -59.07 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 120.953 -1.092 . . . . 0.0 109.089 179.425 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.3 ptm -60.37 -29.82 69.17 Favored 'General case' 0 N--CA 1.51 2.546 0 C-N-CA 118.46 -1.296 . . . . 0.0 109.754 178.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -68.01 -37.41 81.4 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 120.885 -1.134 . . . . 0.0 109.263 178.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 11.9 mt -53.05 -32.19 45.54 Favored 'General case' 0 N--CA 1.513 2.688 0 O-C-N 120.962 -1.086 . . . . 0.0 110.304 179.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.442 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 5.0 t60 -56.1 -36.77 68.55 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.057 -1.027 . . . . 0.0 110.113 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.429 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 5.5 m170 -60.48 -49.49 77.34 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.1 -1.0 . . . . 0.0 109.508 179.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -58.24 -37.42 74.87 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.3 -0.875 . . . . 0.0 109.679 179.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.3 mtt180 -63.07 -48.77 77.23 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.172 -0.955 . . . . 0.0 109.482 179.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.7 p -60.74 -40.37 92.14 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.172 -0.955 . . . . 0.0 109.564 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.409 ' O ' ' OG1' ' A' ' 65' ' ' THR . 4.1 tpt85 -62.6 -40.99 98.68 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 119.343 -0.943 . . . . 0.0 109.319 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -62.95 -50.23 71.63 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.276 -0.89 . . . . 0.0 109.512 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 79.7 mt -70.28 -36.78 68.78 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 C-N-CA 119.3 -0.96 . . . . 0.0 109.453 179.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.424 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 9.5 t80 -67.8 -42.12 82.09 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.068 -1.02 . . . . 0.0 108.891 178.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.409 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 90.1 m -60.92 -40.83 94.68 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.175 -0.953 . . . . 0.0 110.097 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.8 pp -83.2 -36.49 24.62 Favored 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 118.99 -1.084 . . . . 0.0 112.465 -179.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.432 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 50.0 t80 -86.65 -35.12 19.54 Favored 'General case' 0 N--CA 1.513 2.693 0 O-C-N 120.63 -1.294 . . . . 0.0 111.858 -179.54 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.424 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 6.6 m-85 -98.32 -3.42 37.21 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.903 -1.123 . . . . 0.0 113.25 -178.5 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.87 -58.93 0.61 Allowed 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.374 -1.454 . . . . 0.0 110.749 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.57 -29.44 70.59 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.063 -1.023 . . . . 0.0 110.654 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.1 tttt 59.87 44.41 13.75 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.768 -1.207 . . . . 0.0 109.985 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -117.38 37.61 3.83 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.342 -0.849 . . . . 0.0 109.888 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.468 HG21 HD12 ' A' ' 73' ' ' ILE . 14.9 tt -157.35 162.69 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.227 -0.921 . . . . 0.0 110.411 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.8 p -110.31 149.0 30.82 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.119 -0.988 . . . . 0.0 110.104 179.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.3 tttt -46.34 -31.92 2.87 Favored 'General case' 0 N--CA 1.515 2.791 0 O-C-N 121.269 -0.895 . . . . 0.0 111.722 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -62.86 -51.91 65.17 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 120.964 -1.085 . . . . 0.0 109.423 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 31.4 tp -65.04 -43.02 93.72 Favored 'General case' 0 N--CA 1.507 2.38 0 C-N-CA 119.145 -1.022 . . . . 0.0 108.816 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.432 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 16.9 t80 -62.53 -40.48 96.94 Favored 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 119.53 -0.868 . . . . 0.0 109.235 179.182 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -70.25 -42.05 72.7 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.168 -0.957 . . . . 0.0 108.849 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.432 ' CH2' ' HB3' ' A' ' 12' ' ' ALA . 81.1 t90 -57.06 -35.51 69.43 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.262 -0.899 . . . . 0.0 109.876 179.062 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.464 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 12.4 mt -69.9 -48.23 59.44 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.079 -1.013 . . . . 0.0 108.971 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.9 mm -57.47 -31.66 39.45 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.609 0 O-C-N 121.312 -0.868 . . . . 0.0 110.053 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 6.9 tttp -89.28 -15.87 32.52 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.938 -1.101 . . . . 0.0 112.136 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.428 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 18.9 mm-40 -106.33 22.26 16.06 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 120.529 -1.357 . . . . 0.0 112.098 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 19.4 tptt 74.24 75.77 0.12 Allowed 'General case' 0 N--CA 1.512 2.667 0 O-C-N 121.038 -1.039 . . . . 0.0 111.742 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.464 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 33.0 m-85 -135.42 -63.04 0.69 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.558 -0.714 . . . . 0.0 109.306 179.62 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -125.48 -172.99 2.72 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.485 -0.76 . . . . 0.0 109.198 179.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.442 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 8.4 t0 -131.24 102.91 6.19 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.057 -1.027 . . . . 0.0 110.524 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -59.41 -39.18 82.62 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.195 -0.941 . . . . 0.0 109.799 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 19.7 tp -59.5 -40.26 86.49 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.127 -0.983 . . . . 0.0 109.772 179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.421 HD22 ' NE2' ' A' ' 57' ' ' HIS . 59.5 tp -71.05 -46.77 61.38 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.173 -0.954 . . . . 0.0 108.552 179.001 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.441 HG21 HD13 ' A' ' 92' ' ' ILE . 62.8 mt -60.24 -33.52 53.93 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.344 0 C-N-CA 119.406 -0.918 . . . . 0.0 109.047 178.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.67 -46.36 72.56 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.043 -1.035 . . . . 0.0 109.292 178.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.421 ' CD ' ' CD2' ' A' ' 106' ' ' LEU . 12.2 mttp -57.48 -40.81 79.39 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.092 -1.005 . . . . 0.0 110.146 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.407 ' CH2' HD22 ' A' ' 91' ' ' LEU . 3.0 m0 -60.77 -26.85 67.55 Favored 'General case' 0 N--CA 1.508 2.468 0 C-N-CA 119.188 -1.005 . . . . 0.0 110.668 179.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.56 -35.8 22.55 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 120.796 -1.19 . . . . 0.0 110.448 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -52.23 178.86 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.76 0 O-C-N 121.022 -1.049 . . . . 0.0 110.764 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -103.4 138.2 40.47 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.259 -0.9 . . . . 0.0 109.22 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 102.85 -27.49 19.98 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 109.948 -1.261 . . . . 0.0 109.948 -178.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 73.3 m-85 -92.32 58.78 3.31 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.885 -1.362 . . . . 0.0 109.808 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -85.56 -35.0 21.34 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.068 -1.02 . . . . 0.0 110.475 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.417 ' HB2' ' OG ' ' A' ' 155' ' ' SER . 0.0 OUTLIER -117.49 62.34 0.74 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.987 -1.071 . . . . 0.0 110.586 -179.827 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -107.29 152.33 24.27 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.003 -1.06 . . . . 0.0 109.847 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.429 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.8 p -113.75 -29.33 7.13 Favored 'General case' 0 N--CA 1.501 2.121 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -179.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.574 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.8 m -143.87 -168.12 2.77 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 120.109 -1.619 . . . . 0.0 110.019 179.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.421 ' CD2' ' CD ' ' A' ' 94' ' ' LYS . 16.7 mt -96.35 -38.87 9.89 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.218 -0.926 . . . . 0.0 110.128 179.02 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -102.1 30.3 4.56 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 120.999 -1.063 . . . . 0.0 109.866 178.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.574 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.7 t -127.37 17.18 7.08 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.043 -1.035 . . . . 0.0 108.833 -179.545 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.1 pt -158.99 38.91 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 O-C-N 120.957 -1.09 . . . . 0.0 110.24 -178.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.425 ' O ' ' OG1' ' A' ' 119' ' ' THR . 7.3 tt0 . . . . . 0 N--CA 1.503 2.22 0 O-C-N 120.868 -1.145 . . . . 0.0 111.201 -178.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.425 ' OG1' ' O ' ' A' ' 110' ' ' GLN . 1.1 m . . . . . 0 N--CA 1.494 1.741 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 49.6 t -103.87 154.93 19.05 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.26 -0.9 . . . . 0.0 109.207 178.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.459 ' CG2' ' CE1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -75.34 -30.7 22.89 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 O-C-N 121.158 -0.964 . . . . 0.0 111.62 -179.033 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.495 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.3 p -58.58 -35.72 72.85 Favored 'General case' 0 N--CA 1.511 2.608 0 O-C-N 120.705 -1.247 . . . . 0.0 110.765 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.06 -33.24 64.81 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 120.937 -1.102 . . . . 0.0 109.964 178.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 58.3 t -81.29 124.28 80.78 Favored Pre-proline 0 N--CA 1.504 2.228 0 O-C-N 121.16 -0.963 . . . . 0.0 109.863 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -66.73 173.48 7.95 Favored 'Trans proline' 0 N--CA 1.488 1.163 0 O-C-N 123.187 1.098 . . . . 0.0 110.874 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.9 tpp85 -75.19 -37.66 61.1 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.292 -0.88 . . . . 0.0 110.421 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.89 -40.96 81.57 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.004 -1.06 . . . . 0.0 110.039 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -69.41 -41.8 75.91 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 119.312 -0.955 . . . . 0.0 109.249 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 21.1 mt -65.39 -38.6 90.49 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.215 -0.928 . . . . 0.0 109.558 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -60.99 -39.88 91.34 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.132 -0.98 . . . . 0.0 109.877 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -60.37 -39.62 87.86 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.147 -0.97 . . . . 0.0 110.082 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -60.85 -41.01 95.0 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.244 -0.91 . . . . 0.0 109.941 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.3 -41.88 94.35 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.15 -0.969 . . . . 0.0 110.06 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 20.8 ttt85 -58.97 -38.44 79.09 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.088 -1.007 . . . . 0.0 109.908 179.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -57.87 -35.99 71.73 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.12 -0.987 . . . . 0.0 110.549 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -106.55 18.5 21.84 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.022 -1.049 . . . . 0.0 111.987 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 56.2 44.61 88.94 Favored Glycine 0 N--CA 1.497 2.729 0 O-C-N 120.612 -1.305 . . . . 0.0 110.327 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.7 t -133.75 -163.31 1.34 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.188 -1.184 . . . . 0.0 109.948 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 10.2 mp0 -139.64 144.43 37.66 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.155 -0.965 . . . . 0.0 110.344 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.6 p -132.1 161.4 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.284 -0.885 . . . . 0.0 110.018 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 38.4 t -166.78 100.07 0.56 Allowed 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.231 -0.918 . . . . 0.0 111.104 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.495 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 77.1 t80 -102.58 160.08 14.88 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.336 -0.852 . . . . 0.0 110.639 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 58.7 m-70 -137.83 -61.63 0.62 Allowed 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 178.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.56 150.75 44.07 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.536 -0.727 . . . . 0.0 109.278 178.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . 0.413 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.4 p -93.56 154.82 17.66 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.016 -1.053 . . . . 0.0 110.986 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.7 p -73.62 -25.14 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.569 0 O-C-N 121.334 -0.854 . . . . 0.0 111.598 -179.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -49.44 -59.06 4.07 Favored 'General case' 0 N--CA 1.517 2.879 0 O-C-N 120.873 -1.142 . . . . 0.0 110.167 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.444 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.9 p -127.65 -164.39 1.36 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.192 -0.942 . . . . 0.0 110.369 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . 0.408 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.93 63.38 0.56 Allowed Glycine 0 N--CA 1.492 2.381 0 N-CA-C 107.936 -2.066 . . . . 0.0 107.936 178.422 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 32.8 t -101.83 142.18 33.54 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.332 -1.099 . . . . 0.0 109.797 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 9.3 ttt85 -100.0 46.32 0.96 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.262 -0.899 . . . . 0.0 109.638 179.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 76.38 96.16 0.17 Allowed Glycine 0 N--CA 1.486 2.011 0 N-CA-C 109.883 -1.287 . . . . 0.0 109.883 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.4 p -108.25 126.01 52.33 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.333 -1.098 . . . . 0.0 110.161 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -146.65 148.93 32.57 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.153 -0.967 . . . . 0.0 110.308 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' SER . . . . . 0.417 ' OG ' ' HB2' ' A' ' 102' ' ' LYS . 1.5 m . . . . . 0 N--CA 1.496 1.842 0 O-C-N 121.291 -0.88 . . . . 0.0 110.695 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.439 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.504 2.233 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.14 162.83 40.82 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.411 1.216 . . . . 0.0 110.919 -179.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -47.62 -32.34 5.45 Favored 'General case' 0 N--CA 1.515 2.796 0 O-C-N 121.431 -0.793 . . . . 0.0 111.596 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.99 -34.73 39.11 Favored Glycine 0 N--CA 1.5 2.918 0 O-C-N 121.039 -1.038 . . . . 0.0 110.514 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.7 t80 -55.84 -32.29 63.47 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.061 -1.258 . . . . 0.0 110.695 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -54.32 -38.65 66.24 Favored 'General case' 0 N--CA 1.513 2.71 0 O-C-N 120.913 -1.117 . . . . 0.0 110.147 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.22 -36.14 72.73 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.209 -0.932 . . . . 0.0 110.164 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.43 HG23 ' OH ' ' A' ' 62' ' ' TYR . 3.0 pt -115.34 36.12 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 O-C-N 121.204 -0.935 . . . . 0.0 110.373 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.434 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.3 OUTLIER -84.06 -43.41 0.77 Allowed Pre-proline 0 N--CA 1.509 2.519 0 O-C-N 121.073 -1.017 . . . . 0.0 113.217 -179.187 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.434 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.2 Cg_endo -75.58 -36.39 2.25 Favored 'Trans proline' 0 N--CA 1.486 1.083 0 O-C-N 122.62 0.8 . . . . 0.0 111.634 -178.243 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 85.5 m -61.54 -46.65 89.04 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 120.938 -1.101 . . . . 0.0 109.756 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.424 HD21 ' CD2' ' A' ' 86' ' ' TYR . 4.9 mt -61.81 -39.22 90.99 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.48 -0.888 . . . . 0.0 109.632 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.5 m -57.2 -35.7 69.95 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.137 -0.977 . . . . 0.0 110.295 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -57.63 -37.95 74.18 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.068 -1.02 . . . . 0.0 110.248 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.419 ' CD2' HD22 ' A' ' 55' ' ' LEU . 14.2 m-85 -59.0 -38.53 79.43 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.126 -0.984 . . . . 0.0 110.391 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -58.31 -39.36 79.17 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.175 -0.953 . . . . 0.0 110.309 -179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.4 mp -67.97 -41.19 84.41 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.279 0 C-N-CA 119.225 -0.99 . . . . 0.0 108.734 179.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -66.74 -49.03 67.3 Favored 'General case' 0 N--CA 1.506 2.329 0 C-N-CA 119.177 -1.009 . . . . 0.0 108.341 178.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.3 tp -63.1 -36.21 82.82 Favored 'General case' 0 N--CA 1.508 2.434 0 C-N-CA 119.39 -0.924 . . . . 0.0 108.921 178.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.7 -38.03 74.51 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.117 -0.989 . . . . 0.0 110.298 179.618 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -64.56 -50.55 66.85 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.094 -1.004 . . . . 0.0 109.728 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.413 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -70.78 -36.57 73.12 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 119.202 -0.999 . . . . 0.0 109.48 179.051 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -72.2 -30.83 65.33 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.127 -0.983 . . . . 0.0 110.281 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.8 mmtt -95.11 -32.72 12.96 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 120.952 -1.093 . . . . 0.0 111.12 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.6 t0 . . . . . 0 N--CA 1.508 2.439 0 O-C-N 121.02 -1.05 . . . . 0.0 109.994 -179.955 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.496 1.831 0 N-CA-C 110.07 -0.345 . . . . 0.0 110.07 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.406 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 15.4 m120 -58.4 -41.79 85.71 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.235 -0.916 . . . . 0.0 109.624 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -62.25 -37.4 85.29 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.297 -0.877 . . . . 0.0 109.988 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -66.04 -43.2 88.21 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.12 -0.988 . . . . 0.0 109.558 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 43.6 mt -64.47 -34.01 77.21 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.258 -0.901 . . . . 0.0 110.321 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.43 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 46.9 m0 -57.76 -40.73 80.45 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 120.929 -1.107 . . . . 0.0 109.724 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -59.73 -35.05 73.77 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.359 -0.937 . . . . 0.0 109.957 179.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.413 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 18.3 mt -72.04 -57.24 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.161 0 O-C-N 121.046 -1.034 . . . . 0.0 109.121 179.229 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 ptm -61.58 -26.9 68.26 Favored 'General case' 0 N--CA 1.507 2.421 0 C-N-CA 118.53 -1.268 . . . . 0.0 110.06 178.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -73.49 -39.78 64.6 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 120.723 -1.235 . . . . 0.0 108.708 177.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.419 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.0 mt -53.38 -30.5 40.16 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.087 -1.008 . . . . 0.0 110.303 178.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.458 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 15.9 t60 -57.73 -39.92 78.42 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.943 -1.098 . . . . 0.0 110.111 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.413 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 6.8 m170 -60.51 -46.95 88.25 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.172 -0.955 . . . . 0.0 109.442 179.23 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -61.17 -37.38 82.72 Favored 'General case' 0 N--CA 1.505 2.3 0 C-N-CA 119.463 -0.895 . . . . 0.0 109.57 179.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.416 ' HD3' ' CG ' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -67.16 -48.35 68.25 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.097 -1.002 . . . . 0.0 109.31 179.176 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.2 p -61.68 -38.46 87.87 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.185 -0.947 . . . . 0.0 109.383 179.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -37.71 88.5 Favored 'General case' 0 N--CA 1.507 2.401 0 C-N-CA 119.261 -0.975 . . . . 0.0 109.464 179.176 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.43 ' OH ' HG23 ' A' ' 19' ' ' ILE . 42.2 t80 -61.1 -48.69 80.49 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.118 -0.989 . . . . 0.0 109.454 179.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 84.0 mt -76.25 -43.25 37.21 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 O-C-N 121.189 -0.944 . . . . 0.0 108.854 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.412 ' CE1' HG21 ' A' ' 92' ' ' ILE . 40.7 t80 -59.75 -24.94 64.46 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.408 -0.808 . . . . 0.0 110.39 178.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 85.5 m -88.35 -34.99 17.42 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.692 -1.255 . . . . 0.0 110.441 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.6 pp -82.88 -32.95 27.11 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 120.806 -1.184 . . . . 0.0 112.025 -179.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.405 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 33.3 t80 -86.45 -37.16 18.59 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 120.714 -1.241 . . . . 0.0 111.835 -179.317 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -93.22 -19.58 21.29 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 120.897 -1.127 . . . . 0.0 113.086 -178.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 15.5 mtpt -116.54 -58.6 2.07 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.518 -1.364 . . . . 0.0 110.97 -179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -68.67 -29.21 67.63 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.082 -1.011 . . . . 0.0 110.873 -179.54 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.6 tttt 58.53 42.84 20.22 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.796 -1.19 . . . . 0.0 109.957 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.72 34.32 4.05 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.447 -0.783 . . . . 0.0 109.949 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.443 HD13 HG21 ' A' ' 73' ' ' ILE . 14.1 tt -153.41 162.41 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.156 -0.965 . . . . 0.0 109.728 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 49.7 m -107.93 148.35 29.76 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.056 -1.027 . . . . 0.0 110.406 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.0 ttmm -46.81 -32.34 3.63 Favored 'General case' 0 N--CA 1.514 2.763 0 O-C-N 121.262 -0.898 . . . . 0.0 111.417 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -62.27 -51.15 68.86 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 120.976 -1.078 . . . . 0.0 109.29 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 35.0 tp -65.94 -43.84 86.85 Favored 'General case' 0 N--CA 1.506 2.351 0 C-N-CA 119.202 -0.999 . . . . 0.0 108.528 178.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.405 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 19.3 t80 -60.73 -39.94 90.53 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.279 -0.888 . . . . 0.0 109.335 179.1 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -71.62 -42.22 67.91 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.11 -0.994 . . . . 0.0 108.823 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.439 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 81.7 t90 -56.76 -36.99 70.44 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 121.301 -0.874 . . . . 0.0 109.687 179.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.468 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 51.9 mt -68.85 -47.28 66.36 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.22 -0.925 . . . . 0.0 109.122 179.156 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.443 HG21 HD12 ' A' ' 82' ' ' ILE . 37.0 mm -57.77 -33.3 45.02 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.535 0 O-C-N 121.258 -0.901 . . . . 0.0 110.032 179.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.6 tmtt? -89.32 -11.77 42.47 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.965 -1.084 . . . . 0.0 112.48 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.431 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 71.5 mm-40 -108.52 22.68 15.6 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 120.475 -1.39 . . . . 0.0 112.206 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 15.8 tttt 74.96 73.99 0.1 Allowed 'General case' 0 N--CA 1.512 2.672 0 O-C-N 121.102 -0.998 . . . . 0.0 111.799 179.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.468 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 34.1 m-85 -134.54 -62.51 0.74 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.449 -0.782 . . . . 0.0 109.196 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -132.59 160.85 35.42 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.402 -0.811 . . . . 0.0 109.257 179.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.458 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.4 t70 -105.65 119.1 38.27 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.047 -1.033 . . . . 0.0 110.421 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.1 mmtt -60.87 -38.08 84.36 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 119.478 -0.889 . . . . 0.0 109.825 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 8.3 tp -60.29 -37.93 82.02 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.096 -1.003 . . . . 0.0 109.707 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.444 ' CD1' ' CZ3' ' A' ' 95' ' ' TRP . 0.2 OUTLIER -65.81 -55.82 15.15 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.096 -1.003 . . . . 0.0 108.895 179.21 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.412 HG21 ' CE1' ' A' ' 64' ' ' TYR . 39.6 mt -61.75 -36.02 71.11 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.475 0 C-N-CA 119.342 -0.943 . . . . 0.0 108.888 178.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.92 -39.95 91.02 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.09 -1.006 . . . . 0.0 109.354 178.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.42 ' HD2' ' CE1' ' A' ' 100' ' ' TYR . 10.8 mmtm -58.68 -44.25 90.2 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 121.154 -0.966 . . . . 0.0 109.501 179.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.444 ' CZ3' ' CD1' ' A' ' 91' ' ' LEU . 2.6 m0 -62.58 -34.97 78.04 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.192 -0.942 . . . . 0.0 110.153 179.378 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . 0.41 ' NH1' ' OH ' ' A' ' 64' ' ' TYR . 0.3 OUTLIER -81.25 -31.9 33.54 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.02 -1.05 . . . . 0.0 110.79 179.757 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 23.6 mmtt -53.91 -176.73 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.711 0 O-C-N 120.899 -1.126 . . . . 0.0 110.582 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -103.38 134.52 46.62 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.241 -0.912 . . . . 0.0 109.808 179.201 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.42 14.2 45.36 Favored Glycine 0 N--CA 1.493 2.494 0 C-N-CA 120.2 -1.0 . . . . 0.0 110.863 -179.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.42 ' CE1' ' HD2' ' A' ' 94' ' ' LYS . 51.3 m-85 -123.03 72.49 1.1 Allowed 'General case' 0 N--CA 1.493 1.676 0 CA-C-N 119.43 1.615 . . . . 0.0 109.983 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.12 -36.46 12.65 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.159 -0.963 . . . . 0.0 110.468 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.77 77.21 1.74 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.006 -1.059 . . . . 0.0 110.565 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -120.85 150.54 40.88 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.036 -1.04 . . . . 0.0 110.059 179.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.413 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.7 p -111.91 -32.59 6.55 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.173 -0.954 . . . . 0.0 112.98 -179.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.55 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.0 m -142.05 -168.5 2.71 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.204 -1.56 . . . . 0.0 110.156 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 62.1 mt -96.73 -38.46 9.9 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.252 -0.905 . . . . 0.0 110.122 178.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 22.9 ttt-85 -101.27 28.9 5.05 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 120.952 -1.093 . . . . 0.0 109.943 178.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.55 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.308 1.8 t -127.05 17.29 7.24 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.065 -1.022 . . . . 0.0 108.623 -179.801 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 2.0 pt -156.35 34.38 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.062 0 O-C-N 120.806 -1.184 . . . . 0.0 111.05 -178.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 . . . . . 0 N--CA 1.499 2.021 0 O-C-N 120.711 -1.243 . . . . 0.0 111.147 -178.962 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.501 2.113 0 CA-C-O 120.716 0.293 . . . . 0.0 110.373 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 42.7 t -86.9 153.58 21.5 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.12 -0.988 . . . . 0.0 108.661 178.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.457 ' CD1' ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -72.5 -30.89 35.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.378 0 O-C-N 121.079 -1.013 . . . . 0.0 111.627 -178.695 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.5 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.8 p -60.0 -35.73 75.67 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 120.593 -1.317 . . . . 0.0 110.396 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 7.0 ttt-85 -57.2 -32.85 66.91 Favored 'General case' 0 N--CA 1.512 2.626 0 O-C-N 121.077 -1.014 . . . . 0.0 109.925 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 61.9 t -79.99 124.4 83.07 Favored Pre-proline 0 N--CA 1.506 2.333 0 O-C-N 121.056 -1.028 . . . . 0.0 109.913 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -67.56 -179.73 2.12 Favored 'Trans proline' 0 N--CA 1.488 1.153 0 O-C-N 123.112 1.059 . . . . 0.0 110.87 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.19 -37.85 61.02 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.22 -0.925 . . . . 0.0 110.419 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.97 -40.83 81.57 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.025 -1.047 . . . . 0.0 110.092 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 22.7 tp60 -69.19 -41.54 77.01 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.339 -0.944 . . . . 0.0 109.238 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 9.4 mt -66.01 -38.73 89.19 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 121.21 -0.931 . . . . 0.0 109.517 179.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -60.61 -38.81 85.93 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.184 -0.947 . . . . 0.0 109.907 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -58.76 -37.9 77.27 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.141 -0.974 . . . . 0.0 110.382 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -64.35 -40.47 95.93 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.094 -1.004 . . . . 0.0 110.098 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -66.48 -41.33 89.13 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.067 -1.021 . . . . 0.0 109.675 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 11.3 mmp_? -63.89 -34.81 78.8 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.227 -0.921 . . . . 0.0 110.254 179.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 9.9 mmmt -74.41 -31.81 62.46 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 120.958 -1.089 . . . . 0.0 110.956 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 29.2 mttm -99.76 22.28 11.25 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 120.882 -1.136 . . . . 0.0 111.804 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.0 46.42 55.71 Favored Glycine 0 N--CA 1.499 2.884 0 O-C-N 120.607 -1.308 . . . . 0.0 110.743 179.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.7 t -145.68 -163.79 1.8 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.145 -1.209 . . . . 0.0 110.32 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 12.6 mt-30 -131.85 171.44 13.54 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.132 -0.98 . . . . 0.0 110.213 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.7 p -159.18 160.96 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.209 -0.932 . . . . 0.0 110.859 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 30.3 t -168.63 96.87 0.39 Allowed 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.319 -0.863 . . . . 0.0 110.924 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.5 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 73.4 t80 -97.16 159.6 14.82 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.202 -0.936 . . . . 0.0 110.518 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 17.7 m170 -138.3 -61.24 0.6 Allowed 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 178.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -139.48 151.13 45.94 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.526 -0.734 . . . . 0.0 109.264 178.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . 0.412 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.0 p -92.52 155.71 17.63 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.065 -1.022 . . . . 0.0 111.024 -179.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.4 p -74.78 -23.09 17.51 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.435 -0.79 . . . . 0.0 111.7 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -51.72 -57.24 9.8 Favored 'General case' 0 N--CA 1.514 2.751 0 O-C-N 120.81 -1.181 . . . . 0.0 110.002 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.43 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.2 p -128.91 -164.15 1.36 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.281 -0.887 . . . . 0.0 110.385 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -102.11 62.43 0.51 Allowed Glycine 0 N--CA 1.493 2.459 0 N-CA-C 107.81 -2.116 . . . . 0.0 107.81 178.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 21.6 t -99.54 146.01 26.88 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.32 -1.106 . . . . 0.0 109.792 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 11.1 mtt85 -100.92 44.14 1.03 Allowed 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.219 -0.926 . . . . 0.0 109.689 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 76.67 97.18 0.17 Allowed Glycine 0 N--CA 1.486 2.033 0 N-CA-C 109.846 -1.302 . . . . 0.0 109.846 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.4 p -110.39 125.78 53.58 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.344 -1.092 . . . . 0.0 110.202 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -142.16 137.34 30.8 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.13 -0.981 . . . . 0.0 109.949 -179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.497 1.889 0 O-C-N 121.137 -0.977 . . . . 0.0 109.689 179.612 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.431 ' HB3' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.503 2.222 0 CA-C-O 120.459 0.171 . . . . 0.0 110.636 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.12 163.95 37.15 Favored 'Trans proline' 0 C--N 1.318 -1.059 0 O-C-N 123.307 1.162 . . . . 0.0 110.652 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -48.46 -32.23 7.48 Favored 'General case' 0 N--CA 1.515 2.801 0 O-C-N 121.483 -0.761 . . . . 0.0 111.375 -179.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.86 -34.12 50.84 Favored Glycine 0 N--CA 1.498 2.779 0 O-C-N 121.018 -1.051 . . . . 0.0 110.502 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -54.63 -32.55 59.16 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 120.999 -1.295 . . . . 0.0 110.76 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 -54.18 -37.9 65.0 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 121.006 -1.059 . . . . 0.0 110.18 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.0 mptt -58.63 -36.52 74.21 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.179 -0.951 . . . . 0.0 110.25 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 3.3 pt -117.06 35.69 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.152 -0.968 . . . . 0.0 110.514 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.421 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 6.6 tmtt? -84.64 -43.21 0.71 Allowed Pre-proline 0 N--CA 1.508 2.451 0 O-C-N 121.093 -1.004 . . . . 0.0 113.265 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.421 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.8 Cg_endo -76.44 -38.01 1.17 Allowed 'Trans proline' 0 N--CA 1.487 1.134 0 O-C-N 122.603 0.791 . . . . 0.0 111.582 -178.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 86.0 m -59.73 -43.18 94.3 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 120.86 -1.15 . . . . 0.0 109.992 -179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.423 HD23 ' CD2' ' A' ' 86' ' ' TYR . 1.6 mt -63.12 -37.98 89.35 Favored 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 119.487 -0.885 . . . . 0.0 109.772 179.432 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.6 -36.63 72.01 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.091 -1.005 . . . . 0.0 110.394 179.652 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -57.26 -37.38 72.25 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.091 -1.005 . . . . 0.0 110.256 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.427 ' CE2' HD23 ' A' ' 55' ' ' LEU . 13.3 m-85 -58.42 -38.98 78.54 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.091 -1.006 . . . . 0.0 110.556 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -60.84 -38.91 87.11 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.233 -0.917 . . . . 0.0 110.864 -179.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.2 mp -65.71 -39.23 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.415 0 C-N-CA 119.119 -1.032 . . . . 0.0 109.591 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.8 tt0 -72.16 -46.0 58.19 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.034 -1.041 . . . . 0.0 108.831 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.29 -33.76 76.75 Favored 'General case' 0 N--CA 1.508 2.44 0 C-N-CA 119.27 -0.972 . . . . 0.0 108.902 178.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -57.17 -39.51 75.46 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 120.994 -1.066 . . . . 0.0 110.011 179.349 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.83 -49.86 73.25 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.25 -0.98 . . . . 0.0 109.605 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.412 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -69.33 -39.39 78.23 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.18 -0.95 . . . . 0.0 109.352 179.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 10.8 mm-40 -69.73 -30.8 68.5 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.231 -0.918 . . . . 0.0 110.446 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -94.79 -31.24 13.84 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.85 -1.156 . . . . 0.0 111.261 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 . . . . . 0 N--CA 1.511 2.602 0 O-C-N 120.873 -1.142 . . . . 0.0 110.282 179.936 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.495 1.777 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -55.47 -38.41 69.06 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.202 -0.936 . . . . 0.0 109.821 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -58.0 -34.67 70.25 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.229 -0.919 . . . . 0.0 110.166 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -57.46 -41.02 79.77 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 120.948 -1.095 . . . . 0.0 109.953 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 93.4 mt -64.71 -38.62 91.6 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.254 -0.904 . . . . 0.0 109.885 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.447 ' CE3' ' CA ' ' A' ' 149' ' ' GLY . 39.9 m0 -58.18 -32.13 67.95 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.151 -0.968 . . . . 0.0 109.865 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -69.37 -33.33 72.9 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.643 -1.286 . . . . 0.0 109.624 178.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.412 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 68.4 mt -72.54 -51.1 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.298 0 O-C-N 120.904 -1.122 . . . . 0.0 109.39 179.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.477 ' CE ' ' HB2' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -61.02 -33.31 73.07 Favored 'General case' 0 N--CA 1.508 2.464 0 C-N-CA 118.799 -1.16 . . . . 0.0 109.648 179.07 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -62.48 -38.16 88.78 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.93 -1.106 . . . . 0.0 109.608 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.427 HD23 ' CE2' ' A' ' 26' ' ' PHE . 19.6 mt -53.79 -35.16 61.06 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.113 -0.992 . . . . 0.0 110.017 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.439 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 38.5 t60 -56.19 -38.81 71.47 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 120.98 -1.075 . . . . 0.0 109.881 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.428 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 10.4 m170 -61.42 -50.39 73.0 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.224 -0.923 . . . . 0.0 109.051 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -60.93 -38.7 86.72 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 119.468 -0.893 . . . . 0.0 109.271 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.419 ' HG3' ' CE2' ' A' ' 26' ' ' PHE . 5.2 mtt180 -62.23 -48.06 81.65 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.164 -0.96 . . . . 0.0 109.33 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 94.6 p -65.44 -39.09 91.65 Favored 'General case' 0 N--CA 1.503 2.204 0 C-N-CA 119.306 -0.958 . . . . 0.0 109.159 179.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.43 ' O ' ' OG1' ' A' ' 65' ' ' THR . 34.9 ttt85 -65.52 -39.82 92.24 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.111 -0.993 . . . . 0.0 109.134 178.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -62.46 -50.41 71.59 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.119 -0.988 . . . . 0.0 109.344 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.438 HG23 HD13 ' A' ' 63' ' ' ILE . 91.6 mt -71.8 -39.49 68.15 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 O-C-N 121.221 -0.924 . . . . 0.0 109.255 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -65.15 -42.58 93.63 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.214 -0.929 . . . . 0.0 109.036 179.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.43 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 95.6 m -61.67 -41.45 97.57 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.134 -0.979 . . . . 0.0 110.389 -179.601 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.404 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -83.17 -32.28 26.69 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 120.874 -1.141 . . . . 0.0 112.391 -178.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.42 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 40.3 t80 -86.27 -32.24 21.22 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 120.755 -1.216 . . . . 0.0 111.714 -179.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -98.01 -19.42 18.02 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 120.806 -1.184 . . . . 0.0 112.487 -178.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.4 mttm -119.4 -58.5 1.91 Allowed 'General case' 0 N--CA 1.503 2.207 0 O-C-N 120.509 -1.369 . . . . 0.0 110.621 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 23.9 ttt-85 -65.14 -31.26 72.37 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.112 -0.992 . . . . 0.0 110.878 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.1 tptt 57.44 42.18 25.01 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.897 -1.127 . . . . 0.0 110.036 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.88 35.02 3.68 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.356 -0.84 . . . . 0.0 109.817 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.448 HG22 HD13 ' A' ' 73' ' ' ILE . 13.8 tt -154.14 162.53 2.0 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.235 -0.915 . . . . 0.0 109.84 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.1 t -108.85 147.44 32.11 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.13 -0.981 . . . . 0.0 110.299 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.7 ttmt -45.79 -31.96 2.31 Favored 'General case' 0 N--CA 1.516 2.837 0 O-C-N 121.289 -0.882 . . . . 0.0 111.604 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -62.35 -51.23 68.46 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 120.956 -1.09 . . . . 0.0 109.234 179.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 46.5 tp -66.25 -42.96 87.83 Favored 'General case' 0 N--CA 1.506 2.334 0 C-N-CA 119.274 -0.971 . . . . 0.0 108.52 178.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.42 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 17.0 t80 -61.41 -39.71 91.75 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 121.341 -0.849 . . . . 0.0 109.3 179.229 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -71.42 -42.45 68.27 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.059 -1.026 . . . . 0.0 108.724 178.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.439 ' CE2' ' HG3' ' A' ' 84' ' ' GLU . 80.9 t90 -56.34 -36.42 68.74 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.307 -0.871 . . . . 0.0 109.725 178.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.464 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 18.3 mt -69.04 -49.95 53.0 Favored 'General case' 0 N--CA 1.505 2.299 0 C-N-CA 119.393 -0.923 . . . . 0.0 108.916 179.029 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.1 mm -56.59 -32.86 38.28 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.584 0 O-C-N 121.202 -0.937 . . . . 0.0 109.954 179.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.9 mtpp -89.34 -14.89 34.64 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 120.877 -1.139 . . . . 0.0 112.208 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.439 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 5.6 mm-40 -105.73 22.36 15.68 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.593 -1.317 . . . . 0.0 112.069 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt 75.43 71.59 0.09 Allowed 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.041 -1.037 . . . . 0.0 111.916 179.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.464 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 32.6 m-85 -133.63 -62.77 0.77 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.488 -0.757 . . . . 0.0 108.977 179.272 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -134.03 163.02 30.48 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.451 -0.781 . . . . 0.0 109.202 179.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.439 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 16.4 t0 -112.19 111.53 22.49 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.088 -1.008 . . . . 0.0 110.482 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 28.0 mttt -57.94 -37.0 73.33 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.245 -0.909 . . . . 0.0 110.114 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 18.2 tp -57.88 -37.46 73.99 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.091 -1.006 . . . . 0.0 110.192 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 64.2 tp -72.79 -47.62 45.05 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.052 -1.03 . . . . 0.0 108.512 179.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.443 HG22 HD13 ' A' ' 92' ' ' ILE . 54.5 mt -60.55 -36.55 70.74 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.38 0 O-C-N 121.184 -0.947 . . . . 0.0 108.641 178.291 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.74 -39.27 84.23 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.086 -1.009 . . . . 0.0 109.275 178.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 8.7 mmtt -58.24 -42.65 86.82 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.062 -1.024 . . . . 0.0 109.434 179.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 6.9 m0 -68.29 -38.64 81.87 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.28 -0.888 . . . . 0.0 109.875 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.78 -31.94 67.13 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.225 -0.922 . . . . 0.0 110.476 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.0 mmtm -54.37 -176.56 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.671 0 O-C-N 120.927 -1.108 . . . . 0.0 110.498 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -104.76 134.24 48.24 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.184 -0.947 . . . . 0.0 109.823 179.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.69 10.19 55.64 Favored Glycine 0 N--CA 1.493 2.458 0 C-N-CA 120.19 -1.005 . . . . 0.0 111.129 -179.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -114.13 68.72 0.7 Allowed 'General case' 0 N--CA 1.495 1.808 0 CA-C-N 119.485 1.643 . . . . 0.0 110.044 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -90.22 -38.61 13.33 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.15 -0.969 . . . . 0.0 109.963 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.37 84.25 1.94 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.159 -0.963 . . . . 0.0 109.728 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 9.0 tp -125.86 137.13 53.73 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.373 -0.829 . . . . 0.0 109.881 -179.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.428 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.6 p -111.37 -38.97 4.82 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.211 -0.931 . . . . 0.0 112.434 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.595 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 5.9 m -138.75 -168.16 2.35 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 120.213 -1.554 . . . . 0.0 109.678 179.04 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 13.3 mt -97.99 -38.12 9.51 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 120.973 -1.079 . . . . 0.0 110.541 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 11.8 tpt85 -101.97 32.2 3.56 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 120.991 -1.068 . . . . 0.0 109.498 178.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.595 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.306 1.7 t -127.05 15.31 7.34 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.19 -0.944 . . . . 0.0 109.216 -179.289 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.1 pt -158.26 36.91 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.333 0 O-C-N 120.842 -1.161 . . . . 0.0 110.658 -178.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.407 ' O ' ' OG1' ' A' ' 119' ' ' THR . 5.6 mm-40 . . . . . 0 N--CA 1.499 2.009 0 O-C-N 120.748 -1.22 . . . . 0.0 111.68 -178.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.407 ' OG1' ' O ' ' A' ' 110' ' ' GLN . 5.4 m . . . . . 0 N--CA 1.495 1.788 0 N-CA-C 110.316 -0.253 . . . . 0.0 110.316 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 45.8 t -82.44 154.02 25.37 Favored 'General case' 0 N--CA 1.5 2.067 0 C-N-CA 119.374 -0.93 . . . . 0.0 109.084 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.452 HG22 HD11 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -72.75 -37.16 54.68 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 O-C-N 121.082 -1.011 . . . . 0.0 110.796 -179.389 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.47 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 4.5 p -54.18 -32.74 56.36 Favored 'General case' 0 N--CA 1.512 2.671 0 O-C-N 120.727 -1.233 . . . . 0.0 111.021 -179.08 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 7.3 ttp85 -57.93 -34.06 69.46 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 120.909 -1.12 . . . . 0.0 109.641 178.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 62.0 t -81.42 125.09 79.68 Favored Pre-proline 0 N--CA 1.504 2.229 0 O-C-N 121.137 -0.977 . . . . 0.0 109.725 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -65.77 172.87 7.61 Favored 'Trans proline' 0 N--CA 1.488 1.16 0 O-C-N 123.142 1.075 . . . . 0.0 110.772 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 2.0 tpt180 -75.07 -36.42 61.78 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.188 -0.945 . . . . 0.0 110.901 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.88 -44.01 91.06 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 120.943 -1.098 . . . . 0.0 109.985 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -65.27 -40.71 94.26 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.191 -0.943 . . . . 0.0 109.385 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.4 mt -61.82 -40.85 96.7 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.199 -0.938 . . . . 0.0 109.757 179.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -58.18 -39.93 80.16 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.158 -0.964 . . . . 0.0 109.988 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -60.36 -36.8 78.86 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.19 -0.943 . . . . 0.0 110.056 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -62.75 -47.15 84.79 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.158 -0.964 . . . . 0.0 109.946 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.29 -41.19 98.96 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.14 -0.975 . . . . 0.0 109.788 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 6.8 ttt85 -65.06 -32.59 74.38 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.226 -0.921 . . . . 0.0 110.378 179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 31.7 mttt -81.78 -29.79 32.59 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 120.86 -1.15 . . . . 0.0 111.077 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 36.3 mttt -98.71 24.35 7.66 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 120.82 -1.175 . . . . 0.0 111.712 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.15 46.94 42.56 Favored Glycine 0 N--CA 1.5 2.951 0 O-C-N 120.772 -1.205 . . . . 0.0 111.119 179.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.3 t -148.35 -164.76 2.09 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.114 -1.227 . . . . 0.0 110.422 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -132.65 159.57 39.22 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.185 -0.947 . . . . 0.0 110.283 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.8 p -147.34 161.01 8.3 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.227 -0.921 . . . . 0.0 110.24 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 25.5 t -170.57 83.51 0.1 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.188 -0.945 . . . . 0.0 111.167 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.47 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 52.0 t80 -95.02 159.07 15.19 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.139 -0.976 . . . . 0.0 110.263 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -135.81 -60.37 0.74 Allowed 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -138.71 151.9 47.54 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.401 -0.812 . . . . 0.0 109.518 179.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 26.5 p -93.6 156.1 16.92 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.157 -0.964 . . . . 0.0 110.891 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.8 p -74.55 -25.09 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 121.314 -0.866 . . . . 0.0 111.637 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 -50.88 -45.84 60.17 Favored 'General case' 0 N--CA 1.517 2.883 0 O-C-N 120.756 -1.215 . . . . 0.0 109.457 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.477 ' HB2' ' CE ' ' A' ' 53' ' ' MET . 29.1 p -143.43 177.52 8.39 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.348 -0.845 . . . . 0.0 110.537 179.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . 0.447 ' CA ' ' CE3' ' A' ' 50' ' ' TRP . . . -87.77 64.26 3.71 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 107.957 -2.057 . . . . 0.0 107.957 178.114 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 28.1 t -106.18 139.29 40.92 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.306 -1.114 . . . . 0.0 109.694 -179.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 31.1 mtt-85 -92.31 56.63 2.83 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.163 -0.961 . . . . 0.0 109.776 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 61.15 96.13 0.01 OUTLIER Glycine 0 N--CA 1.488 2.149 0 N-CA-C 109.764 -1.335 . . . . 0.0 109.764 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.8 p -105.13 129.21 53.58 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.288 -1.124 . . . . 0.0 110.4 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -143.7 138.34 28.82 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.15 -0.968 . . . . 0.0 109.926 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.5 2.062 0 O-C-N 121.158 -0.964 . . . . 0.0 110.484 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.443 ' HB1' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.505 2.294 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.78 162.8 41.34 Favored 'Trans proline' 0 C--N 1.315 -1.185 0 O-C-N 123.34 1.179 . . . . 0.0 110.759 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -48.61 -31.87 7.31 Favored 'General case' 0 N--CA 1.514 2.772 0 O-C-N 121.444 -0.785 . . . . 0.0 111.408 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.78 -34.19 36.44 Favored Glycine 0 N--CA 1.5 2.947 0 O-C-N 120.871 -1.143 . . . . 0.0 110.569 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -55.16 -33.4 62.92 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 120.978 -1.307 . . . . 0.0 110.568 179.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -54.12 -37.12 63.99 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.064 -1.022 . . . . 0.0 110.227 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.9 mmtt -57.81 -35.63 71.1 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.155 -0.966 . . . . 0.0 110.27 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 3.7 pt -116.23 36.68 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.138 -0.976 . . . . 0.0 110.454 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.431 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.2 OUTLIER -84.68 -43.49 0.7 Allowed Pre-proline 0 N--CA 1.508 2.442 0 O-C-N 121.038 -1.039 . . . . 0.0 113.392 -179.21 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.2 Cg_endo -76.13 -38.33 1.19 Allowed 'Trans proline' 0 N--CA 1.488 1.149 0 O-C-N 122.51 0.742 . . . . 0.0 111.922 -178.037 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 85.0 m -59.56 -42.95 93.61 Favored 'General case' 0 N--CA 1.512 2.654 0 O-C-N 120.925 -1.11 . . . . 0.0 109.952 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 45.2 mt -65.55 -38.75 90.52 Favored 'General case' 0 N--CA 1.506 2.347 0 C-N-CA 119.404 -0.919 . . . . 0.0 109.31 179.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.0 m -57.7 -34.93 69.97 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.143 -0.973 . . . . 0.0 110.227 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -56.16 -36.87 68.81 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 121.015 -1.053 . . . . 0.0 110.235 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.421 ' CE1' ' HG2' ' A' ' 59' ' ' ARG . 15.4 m-85 -55.89 -36.79 68.02 Favored 'General case' 0 N--CA 1.511 2.621 0 O-C-N 121.108 -0.995 . . . . 0.0 110.256 179.606 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -57.13 -27.74 62.09 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.184 -0.947 . . . . 0.0 111.001 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 2.7 mp -76.67 -37.37 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 O-C-N 121.001 -1.062 . . . . 0.0 109.403 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 34.9 tp60 -79.24 -39.55 32.82 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 120.945 -1.097 . . . . 0.0 108.746 178.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.414 ' CD1' ' CG2' ' A' ' 52' ' ' ILE . 7.2 tp -70.21 -34.0 72.38 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.491 -0.884 . . . . 0.0 110.399 179.084 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.7 ptm85 -71.85 -36.14 70.07 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 120.824 -1.173 . . . . 0.0 109.746 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.14 -39.49 94.84 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.06 -1.025 . . . . 0.0 109.662 179.434 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.407 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -74.81 -40.98 60.79 Favored 'General case' 0 N--CA 1.505 2.287 0 C-N-CA 119.162 -1.015 . . . . 0.0 109.15 179.026 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -67.75 -29.97 69.32 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 119.531 -0.868 . . . . 0.0 110.423 179.357 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -87.08 -32.82 19.73 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.777 -1.202 . . . . 0.0 110.89 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.4 t70 . . . . . 0 N--CA 1.512 2.635 0 O-C-N 120.923 -1.111 . . . . 0.0 110.386 -179.943 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 N--CA 1.502 2.134 0 CA-C-O 120.608 0.242 . . . . 0.0 110.579 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.405 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 9.9 m120 -58.82 -40.12 83.21 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.171 -0.956 . . . . 0.0 109.977 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.42 ' HA ' ' CE3' ' A' ' 50' ' ' TRP . 20.7 mt-10 -60.12 -43.53 95.55 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.132 -0.98 . . . . 0.0 109.813 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 41.4 tp60 -62.89 -45.02 94.49 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.233 -0.917 . . . . 0.0 109.538 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 43.8 mt -59.29 -33.81 71.54 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.279 -0.888 . . . . 0.0 110.372 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.437 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 48.3 m0 -57.78 -40.55 80.07 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 120.834 -1.166 . . . . 0.0 109.581 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -62.41 -32.8 73.68 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 119.183 -1.007 . . . . 0.0 109.423 178.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.414 ' CG2' ' CD1' ' A' ' 30' ' ' LEU . 21.4 mt -71.04 -58.31 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.198 0 O-C-N 121.001 -1.062 . . . . 0.0 109.007 179.161 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 ptm -62.36 -29.11 70.23 Favored 'General case' 0 N--CA 1.508 2.448 0 C-N-CA 118.555 -1.258 . . . . 0.0 109.752 178.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -70.59 -38.75 74.08 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 120.859 -1.15 . . . . 0.0 109.124 178.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.419 HD22 ' CD1' ' A' ' 26' ' ' PHE . 11.0 mt -54.15 -32.87 56.47 Favored 'General case' 0 N--CA 1.513 2.696 0 O-C-N 121.054 -1.029 . . . . 0.0 110.214 178.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.438 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 6.7 t60 -55.94 -36.73 68.08 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.065 -1.022 . . . . 0.0 110.173 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.426 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 6.8 m170 -59.04 -47.32 85.65 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 121.023 -1.048 . . . . 0.0 109.544 179.352 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -59.73 -37.18 78.21 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.529 -0.868 . . . . 0.0 109.801 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.421 ' HG2' ' CE1' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -62.66 -48.29 79.99 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.096 -1.003 . . . . 0.0 109.447 179.421 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 26.6 p -62.99 -41.66 99.63 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.103 -0.998 . . . . 0.0 109.301 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.412 ' O ' ' OG1' ' A' ' 65' ' ' THR . 6.9 ttt85 -62.22 -40.27 95.57 Favored 'General case' 0 N--CA 1.505 2.314 0 C-N-CA 119.381 -0.928 . . . . 0.0 109.291 179.121 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -63.3 -51.49 65.86 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.117 -0.989 . . . . 0.0 109.446 179.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 71.6 mt -68.99 -36.41 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.384 0 C-N-CA 119.303 -0.959 . . . . 0.0 109.422 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.426 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 10.3 t80 -67.54 -41.81 83.68 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.044 -1.035 . . . . 0.0 108.97 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.412 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 91.5 m -60.75 -40.97 94.45 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.071 -1.018 . . . . 0.0 110.143 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.403 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.8 pp -83.26 -36.36 24.61 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 120.966 -1.084 . . . . 0.0 112.411 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.432 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 55.3 t80 -86.63 -35.26 19.49 Favored 'General case' 0 N--CA 1.512 2.641 0 O-C-N 120.608 -1.308 . . . . 0.0 111.826 -179.419 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.426 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 6.9 m-85 -98.36 -3.4 37.11 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 120.904 -1.123 . . . . 0.0 113.219 -178.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.79 -58.73 0.61 Allowed 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.352 -1.468 . . . . 0.0 110.8 179.437 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.7 tpt85 -62.52 -29.55 70.64 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 121.03 -1.043 . . . . 0.0 110.696 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 ttmm 59.72 44.26 14.4 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.819 -1.175 . . . . 0.0 110.021 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -118.2 37.73 3.92 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.389 -0.819 . . . . 0.0 109.87 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.459 HG21 HD11 ' A' ' 73' ' ' ILE . 14.8 tt -156.46 162.74 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.198 -0.939 . . . . 0.0 110.154 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 63.3 m -110.18 147.39 33.83 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.204 -0.935 . . . . 0.0 110.153 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.4 tttt -46.02 -32.21 2.69 Favored 'General case' 0 N--CA 1.516 2.864 0 O-C-N 121.328 -0.858 . . . . 0.0 111.606 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -62.11 -49.82 74.38 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.037 -1.039 . . . . 0.0 109.511 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 27.8 tp -67.39 -43.73 80.61 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 119.161 -1.016 . . . . 0.0 108.712 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.432 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 18.2 t80 -61.9 -38.13 87.21 Favored 'General case' 0 N--CA 1.506 2.327 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.325 179.135 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -73.73 -42.51 61.05 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.123 -0.986 . . . . 0.0 108.802 178.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.443 ' CH2' ' HB1' ' A' ' 12' ' ' ALA . 85.8 t90 -57.52 -37.01 72.32 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.31 -0.869 . . . . 0.0 109.712 178.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.465 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 14.6 mt -69.23 -48.57 61.6 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.21 -0.932 . . . . 0.0 108.897 179.089 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 32.4 mm -56.72 -31.74 35.95 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.614 0 O-C-N 121.124 -0.985 . . . . 0.0 109.911 179.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.7 mttt -86.67 -22.62 25.99 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 120.918 -1.114 . . . . 0.0 111.611 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.429 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 76.3 mm-40 -99.18 20.49 13.4 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 120.756 -1.215 . . . . 0.0 112.015 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.401 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 0.3 OUTLIER 74.03 77.22 0.12 Allowed 'General case' 0 N--CA 1.511 2.599 0 O-C-N 121.01 -1.056 . . . . 0.0 111.484 179.257 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.465 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 30.3 m-85 -135.69 -65.04 0.61 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.539 -0.726 . . . . 0.0 109.642 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -118.03 174.53 6.15 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.276 -0.89 . . . . 0.0 109.653 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.438 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 12.6 t0 -114.42 102.77 10.4 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.261 -0.899 . . . . 0.0 109.962 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -66.8 -40.21 88.02 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.303 -0.873 . . . . 0.0 109.886 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 60.7 tp -61.85 -40.3 94.85 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.188 -0.945 . . . . 0.0 109.735 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.424 HD23 ' NE2' ' A' ' 57' ' ' HIS . 59.6 tp -71.93 -43.44 65.28 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.097 -1.002 . . . . 0.0 108.674 179.229 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.445 HG23 HD12 ' A' ' 92' ' ' ILE . 54.2 mt -58.36 -35.75 55.31 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.479 0 O-C-N 121.206 -0.934 . . . . 0.0 108.702 178.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.85 -39.52 83.8 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.17 -0.956 . . . . 0.0 109.091 178.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.432 ' CD ' ' CZ ' ' A' ' 100' ' ' TYR . 8.1 mmtm -57.17 -42.57 81.36 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.031 -1.043 . . . . 0.0 109.484 179.186 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.408 ' CZ3' ' HG ' ' A' ' 91' ' ' LEU . 2.7 m0 -65.36 -35.79 82.04 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.342 -0.849 . . . . 0.0 110.053 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.23 -31.78 38.49 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.125 -0.985 . . . . 0.0 110.655 179.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 20.4 mmtm -53.64 -176.86 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.706 0 O-C-N 120.996 -1.065 . . . . 0.0 110.745 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -104.62 135.46 45.99 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.211 -0.931 . . . . 0.0 109.765 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.04 11.94 53.52 Favored Glycine 0 N--CA 1.492 2.428 0 C-N-CA 120.262 -0.971 . . . . 0.0 110.993 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.432 ' CZ ' ' CD ' ' A' ' 94' ' ' LYS . 48.4 m-85 -119.95 72.15 0.92 Allowed 'General case' 0 N--CA 1.492 1.664 0 CA-C-N 119.435 1.617 . . . . 0.0 109.973 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -93.69 -35.82 12.63 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.094 -1.004 . . . . 0.0 110.491 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -123.86 80.14 1.78 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.979 -1.075 . . . . 0.0 110.662 -179.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.8 pp -124.55 146.38 49.04 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.107 -0.996 . . . . 0.0 110.033 179.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.426 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.6 p -109.94 -30.87 7.61 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.154 -0.966 . . . . 0.0 112.967 -179.349 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.617 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.4 m -145.15 -169.79 3.28 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 120.194 -1.566 . . . . 0.0 110.098 179.39 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 16.7 mt -99.76 -35.99 9.61 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.295 -0.878 . . . . 0.0 110.227 178.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 3.3 ttt85 -103.06 33.69 3.17 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.869 -1.145 . . . . 0.0 109.653 178.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.617 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.276 1.6 t -124.82 -60.75 1.35 Allowed 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 105.18 -2.155 . . . . 0.0 105.18 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 4.2 pt -69.01 -21.95 25.9 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.671 0 O-C-N 120.879 -1.138 . . . . 0.0 110.784 176.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 . . . . . 0 N--CA 1.492 1.655 0 O-C-N 120.837 -1.164 . . . . 0.0 109.756 -179.628 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.5 2.036 0 CA-C-O 120.495 0.188 . . . . 0.0 110.548 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 34.2 t -59.35 154.97 15.59 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.137 -0.977 . . . . 0.0 109.485 179.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.455 HG21 ' CE1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -76.84 -30.11 18.2 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.384 0 O-C-N 121.066 -1.021 . . . . 0.0 111.63 -179.013 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.489 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.7 p -58.67 -35.81 73.17 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 120.684 -1.26 . . . . 0.0 110.861 -178.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.18 -30.3 64.4 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 120.914 -1.116 . . . . 0.0 110.196 178.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.6 t -83.55 122.66 76.9 Favored Pre-proline 0 N--CA 1.505 2.303 0 O-C-N 120.976 -1.078 . . . . 0.0 110.217 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . 0.402 ' HB3' ' CB ' ' A' ' 154' ' ' ALA . 39.0 Cg_endo -66.08 179.2 2.0 Favored 'Trans proline' 0 N--CA 1.49 1.277 0 O-C-N 123.175 1.092 . . . . 0.0 110.94 179.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.26 -37.68 60.84 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.256 -0.902 . . . . 0.0 110.511 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.29 -40.62 78.19 Favored 'General case' 0 N--CA 1.511 2.622 0 O-C-N 121.047 -1.033 . . . . 0.0 110.057 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -70.41 -41.7 72.62 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 119.346 -0.941 . . . . 0.0 109.113 179.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.3 mt -66.02 -38.77 89.27 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 121.288 -0.882 . . . . 0.0 109.402 178.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -59.95 -38.11 81.51 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.113 -0.992 . . . . 0.0 109.958 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -58.58 -37.75 76.46 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.064 -1.022 . . . . 0.0 110.379 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -63.84 -45.72 88.3 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.139 -0.976 . . . . 0.0 109.807 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.68 -40.97 96.84 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.169 -0.957 . . . . 0.0 109.776 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 34.7 mtt-85 -59.88 -36.12 76.25 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.245 -0.909 . . . . 0.0 110.121 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 20.7 mttm -70.54 -32.91 70.54 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.042 -1.036 . . . . 0.0 110.879 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 2.1 ttmm -100.59 22.01 12.48 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 120.97 -1.081 . . . . 0.0 111.713 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.18 45.98 57.04 Favored Glycine 0 N--CA 1.499 2.87 0 O-C-N 120.592 -1.318 . . . . 0.0 110.688 179.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.3 t -143.04 -165.46 2.07 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.186 -1.185 . . . . 0.0 110.164 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -134.35 149.48 50.85 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.147 -0.971 . . . . 0.0 110.302 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.7 p -130.98 161.34 41.17 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 121.241 -0.912 . . . . 0.0 109.954 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 30.3 t -166.17 100.2 0.63 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.187 -0.946 . . . . 0.0 111.19 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.489 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 74.3 t80 -101.31 160.54 14.32 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.311 -0.868 . . . . 0.0 110.371 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -138.44 -60.88 0.6 Allowed 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.05 149.25 41.43 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.392 -0.817 . . . . 0.0 109.419 179.122 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . 0.439 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.7 p -91.65 157.96 16.67 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 120.992 -1.067 . . . . 0.0 110.765 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 12.5 p -78.42 -23.06 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 O-C-N 121.29 -0.881 . . . . 0.0 111.906 -179.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -51.77 -57.92 7.88 Favored 'General case' 0 N--CA 1.515 2.825 0 O-C-N 120.725 -1.234 . . . . 0.0 109.956 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.437 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 24.2 p -126.78 -165.49 1.46 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.296 -0.878 . . . . 0.0 110.387 179.634 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.42 65.07 0.58 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 107.891 -2.084 . . . . 0.0 107.891 178.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 33.6 t -101.72 141.76 34.09 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.344 -1.092 . . . . 0.0 109.813 -179.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 66.0 mtm-85 -100.38 43.56 1.05 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.18 -0.95 . . . . 0.0 109.772 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 80.61 95.55 0.39 Allowed Glycine 0 N--CA 1.486 2.002 0 N-CA-C 109.99 -1.244 . . . . 0.0 109.99 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.6 p -109.31 126.97 53.93 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.202 -1.176 . . . . 0.0 110.136 179.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . 0.402 ' CB ' ' HB3' ' A' ' 125' ' ' PRO . . . -154.32 147.6 24.88 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.118 -0.989 . . . . 0.0 110.415 -179.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.501 2.101 0 O-C-N 121.228 -0.92 . . . . 0.0 110.542 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.433 ' HB1' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.499 1.988 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -69.72 162.76 40.82 Favored 'Trans proline' 0 C--N 1.314 -1.238 0 O-C-N 123.435 1.229 . . . . 0.0 110.84 -179.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -48.61 -31.43 6.63 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.417 -0.802 . . . . 0.0 111.532 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.41 -35.73 36.54 Favored Glycine 0 N--CA 1.499 2.881 0 O-C-N 120.958 -1.089 . . . . 0.0 110.6 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.405 ' CE2' ' HG2' ' A' ' 20' ' ' LYS . 22.7 t80 -56.98 -33.48 67.14 Favored 'General case' 0 N--CA 1.511 2.617 0 O-C-N 121.034 -1.274 . . . . 0.0 110.579 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -53.78 -38.71 64.76 Favored 'General case' 0 N--CA 1.512 2.647 0 O-C-N 120.991 -1.068 . . . . 0.0 110.166 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 79.6 mttt -60.73 -36.59 79.25 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.366 -0.833 . . . . 0.0 110.081 179.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 1.8 pt -114.32 33.49 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 O-C-N 121.247 -0.908 . . . . 0.0 110.757 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.412 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -83.99 -45.54 0.76 Allowed Pre-proline 0 N--CA 1.51 2.525 0 O-C-N 121.056 -1.027 . . . . 0.0 112.872 -179.279 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.412 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.3 Cg_endo -76.78 -36.45 1.55 Allowed 'Trans proline' 0 N--CA 1.485 1.017 0 O-C-N 122.688 0.836 . . . . 0.0 111.46 -178.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 87.1 m -59.08 -42.64 90.89 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 120.935 -1.103 . . . . 0.0 109.893 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 93.6 mt -66.11 -39.95 90.33 Favored 'General case' 0 N--CA 1.505 2.302 0 C-N-CA 119.442 -0.903 . . . . 0.0 109.468 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.9 m -57.95 -34.5 69.97 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.167 -0.958 . . . . 0.0 110.072 179.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -55.84 -35.14 66.07 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 121.018 -1.051 . . . . 0.0 110.332 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.419 ' CE2' HD21 ' A' ' 55' ' ' LEU . 15.0 m-85 -57.67 -39.45 77.12 Favored 'General case' 0 N--CA 1.51 2.526 0 O-C-N 121.006 -1.059 . . . . 0.0 110.486 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -59.99 -34.36 73.21 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.238 -0.914 . . . . 0.0 111.022 -179.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.4 mp -71.43 -39.62 71.53 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.369 0 O-C-N 121.017 -1.052 . . . . 0.0 109.265 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 -70.52 -43.77 68.94 Favored 'General case' 0 N--CA 1.507 2.378 0 C-N-CA 119.199 -1.0 . . . . 0.0 108.725 178.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.35 -34.92 79.06 Favored 'General case' 0 N--CA 1.506 2.357 0 C-N-CA 119.366 -0.933 . . . . 0.0 108.974 178.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -57.62 -40.61 79.53 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.102 -0.999 . . . . 0.0 109.962 179.392 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.95 -46.37 88.06 Favored 'General case' 0 N--CA 1.506 2.371 0 C-N-CA 119.301 -0.96 . . . . 0.0 109.829 -179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.43 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -67.89 -40.43 83.51 Favored 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 119.237 -0.985 . . . . 0.0 109.215 179.081 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -59.62 -35.06 73.62 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.249 -0.907 . . . . 0.0 110.346 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 46.4 mmtt -95.29 -38.49 10.51 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 120.992 -1.067 . . . . 0.0 110.641 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.6 t70 . . . . . 0 N--CA 1.509 2.524 0 O-C-N 121.059 -1.025 . . . . 0.0 110.099 179.892 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.423 ' OG ' ' N ' ' A' ' 46' ' ' ASN . 5.7 p . . . . . 0 N--CA 1.498 1.925 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.423 ' N ' ' OG ' ' A' ' 45' ' ' SER . 3.1 m120 -57.09 -38.55 73.51 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.256 -0.902 . . . . 0.0 109.967 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.414 ' HA ' ' CE3' ' A' ' 50' ' ' TRP . 20.0 mt-10 -63.24 -41.09 99.04 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.155 -0.966 . . . . 0.0 109.797 179.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.0 tp60 -61.87 -39.99 93.83 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.141 -0.974 . . . . 0.0 109.782 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -62.66 -36.87 84.24 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.188 -0.945 . . . . 0.0 110.283 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.442 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.9 m0 -54.41 -39.57 67.43 Favored 'General case' 0 N--CA 1.512 2.639 0 O-C-N 120.909 -1.119 . . . . 0.0 109.724 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -63.45 -38.08 89.77 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.258 -0.901 . . . . 0.0 109.635 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.43 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 78.8 mt -64.86 -44.96 96.23 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.394 0 O-C-N 121.135 -0.978 . . . . 0.0 109.173 179.632 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.435 ' CE ' ' HB3' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -68.17 -30.55 69.69 Favored 'General case' 0 N--CA 1.501 2.101 0 C-N-CA 118.889 -1.124 . . . . 0.0 109.743 178.999 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.426 ' N ' ' HG3' ' A' ' 53' ' ' MET . 48.1 mt-30 -67.39 -37.4 83.08 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.898 -1.126 . . . . 0.0 109.111 178.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.419 HD21 ' CE2' ' A' ' 26' ' ' PHE . 13.6 mt -52.35 -32.33 37.76 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.115 -0.99 . . . . 0.0 109.917 178.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.444 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 13.3 t60 -56.92 -40.27 76.01 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.023 -1.048 . . . . 0.0 109.389 179.024 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.423 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 8.0 m170 -60.44 -49.16 78.67 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.154 -0.966 . . . . 0.0 109.137 178.583 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -59.59 -39.45 84.19 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.343 -0.848 . . . . 0.0 109.365 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.408 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -62.42 -48.13 81.06 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.138 -0.976 . . . . 0.0 108.928 178.955 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 12.6 p -66.81 -40.57 88.09 Favored 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 119.384 -0.926 . . . . 0.0 108.699 178.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.8 ttt85 -63.01 -37.52 87.53 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.13 -0.981 . . . . 0.0 109.413 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -61.1 -50.83 71.67 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.124 -0.985 . . . . 0.0 109.293 179.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 88.6 mt -73.33 -42.01 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.344 0 C-N-CA 119.37 -0.932 . . . . 0.0 108.855 179.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.424 ' CE1' HG21 ' A' ' 92' ' ' ILE . 47.7 t80 -57.85 -32.56 67.76 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.331 -0.855 . . . . 0.0 110.235 178.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 61.9 m -80.78 -36.97 31.08 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 120.881 -1.137 . . . . 0.0 110.59 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.416 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -82.93 -32.05 27.4 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 120.954 -1.092 . . . . 0.0 112.25 -179.173 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.446 ' CE2' ' CD2' ' A' ' 78' ' ' TYR . 90.3 t80 -86.47 -36.16 19.21 Favored 'General case' 0 N--CA 1.512 2.655 0 O-C-N 120.658 -1.277 . . . . 0.0 111.731 -179.37 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -98.56 -20.6 16.95 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 120.896 -1.128 . . . . 0.0 112.951 -178.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -119.27 -56.45 2.07 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 120.48 -1.387 . . . . 0.0 111.637 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.402 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 8.4 ttt-85 -66.76 -29.72 69.76 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.056 -1.027 . . . . 0.0 110.805 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 59.5 44.6 14.6 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.822 -1.174 . . . . 0.0 110.042 -179.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.52 37.17 3.3 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.336 -0.853 . . . . 0.0 109.523 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.424 HD13 HG21 ' A' ' 73' ' ' ILE . 13.6 tt -160.43 162.69 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 121.243 -0.911 . . . . 0.0 110.139 -179.583 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.8 p -108.26 148.83 29.43 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.135 -0.978 . . . . 0.0 110.024 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.8 tttt -46.71 -32.2 3.43 Favored 'General case' 0 N--CA 1.515 2.799 0 O-C-N 121.271 -0.893 . . . . 0.0 111.556 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -61.69 -50.32 72.94 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.917 -1.114 . . . . 0.0 109.337 179.542 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 34.8 tp -67.33 -42.16 84.04 Favored 'General case' 0 N--CA 1.504 2.235 0 C-N-CA 119.118 -1.033 . . . . 0.0 108.657 178.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.446 ' CD2' ' CE2' ' A' ' 67' ' ' TYR . 19.1 t80 -61.6 -39.71 92.19 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.227 -0.921 . . . . 0.0 109.194 178.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -70.36 -42.44 71.8 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.142 -0.974 . . . . 0.0 108.728 178.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.433 ' CH2' ' HB1' ' A' ' 12' ' ' ALA . 68.3 t90 -56.95 -35.16 68.79 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.215 -0.928 . . . . 0.0 109.859 178.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.466 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 13.2 mt -70.37 -49.82 45.24 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.077 -1.015 . . . . 0.0 108.902 179.116 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 36.1 mm -58.37 -32.52 45.36 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.567 0 O-C-N 121.26 -0.9 . . . . 0.0 110.032 179.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.9 mttm -89.27 -15.74 32.81 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 120.894 -1.128 . . . . 0.0 112.108 -179.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.42 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 26.3 mm-40 -105.36 20.64 18.54 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 120.581 -1.324 . . . . 0.0 112.063 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt 73.85 77.36 0.13 Allowed 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.05 -1.031 . . . . 0.0 111.578 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.466 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 28.6 m-85 -135.01 -63.45 0.69 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.531 -0.73 . . . . 0.0 109.711 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -120.23 -174.48 2.79 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.377 -0.827 . . . . 0.0 109.894 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.444 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.7 t0 -124.04 112.78 17.56 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.134 -0.979 . . . . 0.0 110.435 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -63.74 -40.74 97.46 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.117 -0.989 . . . . 0.0 109.395 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.0 tp -59.59 -40.64 88.11 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.126 -0.984 . . . . 0.0 109.596 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.443 ' CD1' ' CZ3' ' A' ' 95' ' ' TRP . 0.2 OUTLIER -65.22 -53.24 47.57 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.188 -0.945 . . . . 0.0 109.012 179.368 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.45 HD11 HG23 ' A' ' 92' ' ' ILE . 55.8 mt -62.32 -34.71 65.64 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.313 0 O-C-N 121.228 -0.92 . . . . 0.0 109.127 178.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.93 -40.07 91.08 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.052 -1.03 . . . . 0.0 109.9 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.432 ' CD ' ' CD2' ' A' ' 106' ' ' LEU . 9.4 mttp -64.98 -42.53 94.47 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.026 -1.047 . . . . 0.0 110.267 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.443 ' CZ3' ' CD1' ' A' ' 91' ' ' LEU . 3.1 m0 -62.15 -33.5 74.62 Favored 'General case' 0 N--CA 1.51 2.553 0 C-N-CA 118.983 -1.087 . . . . 0.0 110.107 178.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.12 -35.3 36.97 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 120.963 -1.086 . . . . 0.0 110.452 179.596 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.6 mmtp -53.13 -179.31 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.652 0 O-C-N 121.009 -1.057 . . . . 0.0 110.718 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.1 m -106.6 140.46 39.44 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.289 -0.882 . . . . 0.0 109.544 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 101.23 -24.53 31.5 Favored Glycine 0 N--CA 1.492 2.408 0 C-N-CA 119.834 -1.174 . . . . 0.0 110.45 -179.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -91.95 58.56 3.41 Favored 'General case' 0 N--CA 1.503 2.224 0 CA-C-N 119.083 1.441 . . . . 0.0 110.047 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -71.18 -37.46 72.16 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.018 -1.051 . . . . 0.0 110.208 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.62 84.86 2.33 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.046 -1.034 . . . . 0.0 110.617 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.3 pp -120.54 140.83 50.9 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.086 -1.009 . . . . 0.0 110.303 179.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.423 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.5 p -108.03 -28.82 9.33 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.235 -0.916 . . . . 0.0 112.598 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.627 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 10.6 m -146.68 -169.83 3.37 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 120.366 -1.459 . . . . 0.0 110.005 179.314 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.432 ' CD2' ' CD ' ' A' ' 94' ' ' LYS . 93.9 mt -100.09 -35.1 9.8 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.211 -0.931 . . . . 0.0 110.583 178.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.92 36.67 2.37 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.757 -1.215 . . . . 0.0 109.187 178.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.627 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.284 1.6 t -127.72 -59.01 1.22 Allowed 'General case' 0 N--CA 1.498 1.946 0 N-CA-C 105.788 -1.931 . . . . 0.0 105.788 -179.411 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 18.8 pt -69.15 -26.22 31.49 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.617 0 O-C-N 121.001 -1.062 . . . . 0.0 110.741 177.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 . . . . . 0 N--CA 1.493 1.683 0 O-C-N 120.865 -1.147 . . . . 0.0 110.175 -179.406 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.495 1.789 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 35.1 t -55.48 153.68 7.28 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.047 -1.033 . . . . 0.0 110.047 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.443 HD12 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -74.22 -36.17 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.469 0 O-C-N 121.144 -0.973 . . . . 0.0 111.279 -179.07 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.509 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 10.7 p -52.72 -30.72 33.93 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.75 -1.219 . . . . 0.0 111.723 -178.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 1.5 ttt85 -61.61 -37.01 82.35 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 120.873 -1.142 . . . . 0.0 109.531 178.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 50.5 t -76.12 124.16 88.24 Favored Pre-proline 0 N--CA 1.505 2.286 0 O-C-N 121.109 -0.994 . . . . 0.0 110.031 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -66.09 172.83 8.07 Favored 'Trans proline' 0 N--CA 1.488 1.201 0 O-C-N 123.241 1.127 . . . . 0.0 110.707 179.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 27.1 mmm-85 -75.04 -36.2 61.88 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 121.19 -0.944 . . . . 0.0 110.675 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.05 -40.8 77.53 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 120.974 -1.079 . . . . 0.0 110.123 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -68.69 -41.6 78.93 Favored 'General case' 0 N--CA 1.506 2.348 0 C-N-CA 119.349 -0.94 . . . . 0.0 109.276 179.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.6 mt -64.53 -39.39 93.69 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.263 -0.898 . . . . 0.0 109.501 179.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -59.0 -37.82 77.75 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.181 -0.949 . . . . 0.0 110.13 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -58.15 -37.15 74.09 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.046 -1.034 . . . . 0.0 110.454 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.16 -47.67 81.69 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.237 -0.915 . . . . 0.0 109.892 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.2 -39.86 91.78 Favored 'General case' 0 N--CA 1.508 2.456 0 C-N-CA 119.33 -0.948 . . . . 0.0 109.787 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -37.33 79.63 Favored 'General case' 0 N--CA 1.512 2.631 0 O-C-N 121.174 -0.954 . . . . 0.0 110.149 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 13.5 mmtm -87.06 -38.86 16.14 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.084 -1.01 . . . . 0.0 110.261 179.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.28 -26.71 63.93 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.14 -0.975 . . . . 0.0 111.158 179.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 91.69 32.28 8.73 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 110.006 -1.238 . . . . 0.0 110.006 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.6 t -139.96 -159.67 0.98 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.981 -1.305 . . . . 0.0 109.725 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -134.41 134.73 41.98 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.045 -1.034 . . . . 0.0 110.228 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 13.2 p -120.42 160.55 20.92 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.258 -0.902 . . . . 0.0 110.116 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 35.6 t -168.92 80.51 0.13 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.165 -0.959 . . . . 0.0 111.327 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.509 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 40.1 t80 -87.72 160.34 18.13 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.163 -0.961 . . . . 0.0 109.679 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -136.77 -61.26 0.68 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.515 -0.741 . . . . 0.0 109.092 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -135.57 153.25 51.75 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.435 -0.79 . . . . 0.0 109.504 179.184 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . 0.4 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.0 p -95.3 155.76 16.6 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.137 -0.977 . . . . 0.0 110.92 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.6 m -73.96 -25.85 20.66 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.522 0 O-C-N 121.271 -0.893 . . . . 0.0 111.814 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -51.64 -48.0 63.52 Favored 'General case' 0 N--CA 1.515 2.815 0 O-C-N 120.835 -1.166 . . . . 0.0 110.04 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.442 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 30.9 p -137.85 -168.87 2.43 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.161 -0.962 . . . . 0.0 111.01 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -98.85 57.41 0.93 Allowed Glycine 0 N--CA 1.492 2.429 0 N-CA-C 107.633 -2.187 . . . . 0.0 107.633 178.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 19.8 t -97.51 141.2 30.85 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.421 -1.046 . . . . 0.0 109.744 -179.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.21 51.74 1.11 Allowed 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.312 -0.868 . . . . 0.0 109.506 179.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 68.77 98.16 0.04 OUTLIER Glycine 0 N--CA 1.488 2.1 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.8 p -109.6 129.42 55.59 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.213 -1.169 . . . . 0.0 110.332 179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -145.51 147.65 32.36 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.18 -0.95 . . . . 0.0 110.212 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.498 1.968 0 O-C-N 121.206 -0.933 . . . . 0.0 110.735 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.443 ' HB3' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.501 2.124 0 CA-C-O 120.461 0.172 . . . . 0.0 110.573 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -71.15 163.46 39.12 Favored 'Trans proline' 0 C--N 1.317 -1.113 0 O-C-N 123.309 1.162 . . . . 0.0 110.734 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -48.18 -32.51 7.14 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 121.479 -0.763 . . . . 0.0 111.358 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -54.37 -34.16 54.02 Favored Glycine 0 N--CA 1.497 2.744 0 O-C-N 120.984 -1.072 . . . . 0.0 110.431 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -54.46 -31.88 56.51 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.985 -1.303 . . . . 0.0 110.843 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.17 -37.73 64.78 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.02 -1.05 . . . . 0.0 110.272 179.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.7 mmmm -58.02 -35.78 71.76 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.232 -0.917 . . . . 0.0 110.342 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pt -117.97 36.37 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.047 0 O-C-N 121.208 -0.933 . . . . 0.0 110.473 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.436 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -83.84 -43.64 0.79 Allowed Pre-proline 0 N--CA 1.508 2.448 0 O-C-N 120.998 -1.064 . . . . 0.0 113.132 -179.165 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.436 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.7 Cg_endo -76.66 -35.97 1.81 Allowed 'Trans proline' 0 N--CA 1.486 1.043 0 O-C-N 122.584 0.781 . . . . 0.0 111.869 -178.263 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 61.8 m -61.48 -47.16 86.92 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 120.893 -1.129 . . . . 0.0 110.015 -179.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.9 mt -61.19 -38.07 85.21 Favored 'General case' 0 N--CA 1.509 2.487 0 C-N-CA 119.476 -0.89 . . . . 0.0 109.701 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.7 m -56.88 -35.43 68.93 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.07 -1.018 . . . . 0.0 110.278 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -56.82 -37.64 71.51 Favored 'General case' 0 N--CA 1.512 2.653 0 O-C-N 121.125 -0.985 . . . . 0.0 110.192 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.424 ' CE2' ' HD3' ' A' ' 59' ' ' ARG . 21.7 m-85 -58.92 -40.28 84.11 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.134 -0.979 . . . . 0.0 110.17 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -60.86 -23.16 64.94 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.269 -0.895 . . . . 0.0 111.471 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 2.7 mp -81.14 -34.59 13.65 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.313 0 O-C-N 120.829 -1.169 . . . . 0.0 109.719 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 57.5 tp60 -81.24 -37.03 29.23 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.898 -1.127 . . . . 0.0 109.211 178.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.43 -32.43 64.38 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.115 -0.991 . . . . 0.0 110.12 178.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.7 ptm180 -69.92 -36.7 75.57 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 120.842 -1.161 . . . . 0.0 109.742 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -64.82 -39.78 94.14 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.081 -1.012 . . . . 0.0 109.504 179.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.409 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -68.97 -41.7 77.56 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.15 -0.969 . . . . 0.0 109.369 179.18 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 9.2 mm-40 -61.64 -34.34 75.52 Favored 'General case' 0 N--CA 1.506 2.343 0 C-N-CA 119.568 -0.853 . . . . 0.0 110.449 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.2 mttt -94.02 -36.16 12.27 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 120.991 -1.068 . . . . 0.0 110.921 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.0 t70 . . . . . 0 N--CA 1.51 2.56 0 O-C-N 121.031 -1.043 . . . . 0.0 110.238 179.988 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.499 2.023 0 CA-C-O 120.601 0.239 . . . . 0.0 110.576 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.5 m-80 -57.55 -39.0 75.69 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.12 -0.988 . . . . 0.0 110.186 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -64.63 -44.24 91.14 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.141 -0.974 . . . . 0.0 109.61 179.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.8 tp60 -64.17 -41.41 97.15 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.224 -0.923 . . . . 0.0 109.481 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.9 mt -61.08 -36.94 81.0 Favored 'General case' 0 N--CA 1.507 2.412 0 C-N-CA 119.487 -0.885 . . . . 0.0 110.044 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.441 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 53.6 m0 -58.51 -38.43 77.67 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 120.993 -1.067 . . . . 0.0 110.105 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -62.17 -30.13 70.84 Favored 'General case' 0 N--CA 1.505 2.315 0 C-N-CA 119.147 -1.021 . . . . 0.0 109.802 178.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.409 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 77.6 mt -71.21 -57.58 7.24 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.288 0 O-C-N 120.886 -1.134 . . . . 0.0 109.284 179.41 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 ptm -62.44 -30.0 70.91 Favored 'General case' 0 N--CA 1.508 2.466 0 C-N-CA 118.621 -1.232 . . . . 0.0 109.77 179.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -67.34 -38.34 84.7 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 120.808 -1.182 . . . . 0.0 109.116 178.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.419 HD23 ' CD2' ' A' ' 26' ' ' PHE . 10.9 mt -53.13 -31.02 40.14 Favored 'General case' 0 N--CA 1.511 2.608 0 O-C-N 121.028 -1.045 . . . . 0.0 110.248 179.002 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.454 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 5.3 t60 -56.48 -38.35 71.61 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.007 -1.058 . . . . 0.0 109.965 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.427 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 5.4 m170 -60.38 -50.59 73.0 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.122 -0.986 . . . . 0.0 109.284 179.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.6 tp60 -59.38 -34.83 72.9 Favored 'General case' 0 N--CA 1.507 2.394 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.402 178.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.424 ' HD3' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -66.52 -52.04 50.2 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.145 -0.972 . . . . 0.0 109.175 178.912 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.0 p -63.01 -38.37 90.91 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.208 -0.932 . . . . 0.0 109.2 179.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.428 ' O ' ' OG1' ' A' ' 65' ' ' THR . 1.5 ttt85 -64.59 -40.46 95.56 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.134 -0.979 . . . . 0.0 109.046 178.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -62.19 -51.28 68.44 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.194 -0.941 . . . . 0.0 109.284 179.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 78.8 mt -69.41 -39.27 78.56 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.439 0 C-N-CA 119.453 -0.899 . . . . 0.0 109.247 179.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 12.6 t80 -65.12 -43.12 93.03 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.249 -0.907 . . . . 0.0 109.162 179.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.428 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 88.4 m -60.88 -41.8 96.69 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.083 -1.01 . . . . 0.0 110.468 -179.53 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.407 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -83.35 -32.59 26.17 Favored 'General case' 0 N--CA 1.503 2.207 0 C-N-CA 118.887 -1.125 . . . . 0.0 112.541 -178.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.421 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 46.7 t80 -86.38 -32.24 21.06 Favored 'General case' 0 N--CA 1.512 2.666 0 O-C-N 120.605 -1.31 . . . . 0.0 111.851 -179.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -98.27 -19.09 18.02 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 120.814 -1.179 . . . . 0.0 112.622 -178.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 7.8 mtpt -121.18 -58.41 1.79 Allowed 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.501 -1.375 . . . . 0.0 110.916 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.9 ttm180 -64.71 -31.13 72.21 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.19 -0.944 . . . . 0.0 110.774 -179.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 57.93 43.16 21.82 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.814 -1.179 . . . . 0.0 110.019 -179.607 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.64 35.78 3.71 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.443 -0.785 . . . . 0.0 109.824 179.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.429 HG21 HD11 ' A' ' 73' ' ' ILE . 13.9 tt -154.52 162.67 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.26 -0.9 . . . . 0.0 109.98 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 4.6 t -109.31 146.46 34.29 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.128 -0.982 . . . . 0.0 110.192 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -45.03 -32.69 1.78 Allowed 'General case' 0 N--CA 1.516 2.851 0 O-C-N 121.316 -0.865 . . . . 0.0 111.728 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -61.53 -50.92 70.72 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 120.841 -1.162 . . . . 0.0 109.227 179.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 40.4 tp -66.8 -43.64 83.35 Favored 'General case' 0 N--CA 1.505 2.309 0 C-N-CA 119.252 -0.979 . . . . 0.0 108.46 178.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.421 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 16.9 t80 -60.38 -38.0 82.54 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.349 -0.844 . . . . 0.0 109.465 179.038 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -74.8 -41.91 59.08 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.028 -1.045 . . . . 0.0 108.891 178.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.443 ' CH2' ' HB3' ' A' ' 12' ' ' ALA . 88.6 t90 -58.99 -38.92 80.29 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.168 -0.958 . . . . 0.0 109.245 178.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.451 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 13.9 mt -65.58 -54.88 21.74 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.226 -0.921 . . . . 0.0 109.244 179.056 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -55.81 -27.43 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.512 0 O-C-N 121.077 -1.014 . . . . 0.0 110.751 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.6 ttpm? -87.77 -21.99 24.81 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 120.943 -1.098 . . . . 0.0 111.582 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.427 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 27.4 mm-40 -99.87 23.44 9.73 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.684 -1.26 . . . . 0.0 111.866 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.412 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 7.8 ttpt 75.99 72.49 0.08 Allowed 'General case' 0 N--CA 1.512 2.64 0 O-C-N 121.177 -0.952 . . . . 0.0 111.743 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.451 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 32.0 m-85 -134.54 -62.55 0.74 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.516 -0.74 . . . . 0.0 109.218 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -129.67 -179.7 5.33 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.424 -0.798 . . . . 0.0 109.6 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.454 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 7.3 t0 -131.09 127.82 38.95 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.075 -1.016 . . . . 0.0 110.627 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 8.9 mttp -75.09 -37.44 61.54 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.242 -0.911 . . . . 0.0 109.835 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.8 tp -60.27 -42.33 95.18 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.079 -1.013 . . . . 0.0 109.932 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.405 HD21 ' CD2' ' A' ' 57' ' ' HIS . 53.6 tp -69.02 -50.05 52.2 Favored 'General case' 0 N--CA 1.505 2.277 0 C-N-CA 119.151 -1.02 . . . . 0.0 108.849 179.24 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.46 HG22 HD13 ' A' ' 92' ' ' ILE . 60.7 mt -59.37 -36.56 64.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.426 0 C-N-CA 119.142 -1.023 . . . . 0.0 108.693 178.282 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.88 -39.32 90.58 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.145 -0.972 . . . . 0.0 109.068 178.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.411 ' HD2' ' CE1' ' A' ' 100' ' ' TYR . 9.8 mmtm -57.1 -45.3 83.49 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.105 -0.997 . . . . 0.0 109.268 179.142 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.7 m0 -62.62 -36.68 83.57 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.402 -0.811 . . . . 0.0 110.003 179.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.59 -33.4 60.58 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.063 -1.023 . . . . 0.0 110.649 179.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.6 mmtt -53.65 -176.99 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.743 0 O-C-N 121.032 -1.042 . . . . 0.0 110.613 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 31.2 m -103.14 133.52 48.11 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.26 -0.9 . . . . 0.0 109.748 179.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.84 11.29 53.71 Favored Glycine 0 N--CA 1.494 2.52 0 C-N-CA 120.233 -0.984 . . . . 0.0 111.043 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.411 ' CE1' ' HD2' ' A' ' 94' ' ' LYS . 53.6 m-85 -118.71 71.02 0.83 Allowed 'General case' 0 N--CA 1.494 1.731 0 CA-C-N 119.463 1.631 . . . . 0.0 109.68 179.6 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -98.23 -33.87 10.94 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.065 -1.022 . . . . 0.0 111.336 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.58 60.59 1.08 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.99 -1.069 . . . . 0.0 111.088 -179.321 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.4 pp -108.91 151.76 25.84 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.906 -1.121 . . . . 0.0 109.618 179.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.427 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.5 p -112.72 -28.1 7.91 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.173 -0.954 . . . . 0.0 113.521 -178.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.555 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.7 m -144.05 -168.5 2.88 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 120.094 -1.629 . . . . 0.0 109.955 179.217 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 12.5 mt -95.62 -38.76 10.24 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.219 -0.926 . . . . 0.0 109.884 178.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 32.6 ttm-85 -102.22 29.63 5.01 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.032 -1.042 . . . . 0.0 110.129 178.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.555 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.8 t -127.67 17.23 6.91 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.053 -1.03 . . . . 0.0 108.935 -179.533 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.1 pt -158.07 38.68 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.264 0 O-C-N 120.863 -1.148 . . . . 0.0 110.179 -178.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.427 ' O ' ' OG1' ' A' ' 119' ' ' THR . 7.8 mt-30 . . . . . 0 N--CA 1.506 2.347 0 O-C-N 120.884 -1.135 . . . . 0.0 110.829 -178.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.427 ' OG1' ' O ' ' A' ' 110' ' ' GLN . 1.5 m . . . . . 0 N--CA 1.494 1.754 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 48.8 t -94.48 154.17 17.55 Favored 'General case' 0 N--CA 1.495 1.807 0 C-N-CA 119.505 -0.878 . . . . 0.0 108.853 178.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.456 ' CD1' ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -74.9 -31.2 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.445 0 O-C-N 121.051 -1.03 . . . . 0.0 111.606 -178.803 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.49 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.2 p -59.12 -35.73 73.97 Favored 'General case' 0 N--CA 1.512 2.625 0 O-C-N 120.663 -1.273 . . . . 0.0 110.594 -179.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 13.4 ttt-85 -57.31 -33.34 67.58 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.997 -1.065 . . . . 0.0 109.979 178.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.3 t -79.58 123.97 83.95 Favored Pre-proline 0 N--CA 1.506 2.372 0 O-C-N 121.092 -1.005 . . . . 0.0 110.117 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -67.01 178.72 2.72 Favored 'Trans proline' 0 N--CA 1.489 1.212 0 O-C-N 123.164 1.086 . . . . 0.0 110.801 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 25.1 mmm-85 -75.14 -37.39 61.4 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.238 -0.914 . . . . 0.0 110.422 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.36 -40.91 79.07 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.048 -1.033 . . . . 0.0 110.062 -179.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -69.64 -41.95 74.9 Favored 'General case' 0 N--CA 1.504 2.267 0 C-N-CA 119.31 -0.956 . . . . 0.0 109.193 179.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 5.5 mt -66.56 -39.1 88.36 Favored 'General case' 0 N--CA 1.504 2.269 0 C-N-CA 119.41 -0.916 . . . . 0.0 109.422 178.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -60.86 -38.54 85.94 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.168 -0.957 . . . . 0.0 109.936 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -59.64 -38.98 82.85 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.163 -0.96 . . . . 0.0 110.203 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -61.54 -46.46 89.85 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.126 -0.984 . . . . 0.0 109.722 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.12 -43.88 97.86 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.209 -0.932 . . . . 0.0 109.651 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.29 -32.65 70.24 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.171 -0.955 . . . . 0.0 110.358 179.533 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 40.4 mttt -80.72 -30.03 36.3 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.988 -1.07 . . . . 0.0 111.136 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 46.5 mttt -99.05 25.04 7.09 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 120.817 -1.177 . . . . 0.0 111.593 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.16 46.97 50.78 Favored Glycine 0 N--CA 1.5 2.951 0 O-C-N 120.702 -1.249 . . . . 0.0 110.82 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.6 t -149.54 -165.65 2.34 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.114 -1.227 . . . . 0.0 110.604 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -133.64 153.38 51.72 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.179 -0.951 . . . . 0.0 110.396 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.8 p -133.21 161.57 41.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 121.215 -0.928 . . . . 0.0 110.161 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 34.3 t -167.43 99.1 0.5 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.195 -0.94 . . . . 0.0 111.149 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.49 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 81.5 t80 -103.49 160.06 15.05 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.184 -0.947 . . . . 0.0 110.67 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 6.5 m80 -138.23 -60.3 0.62 Allowed 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -143.97 148.69 35.67 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.446 -0.784 . . . . 0.0 109.184 178.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . 0.403 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.8 p -90.21 154.35 19.81 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.997 -1.064 . . . . 0.0 111.131 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.7 p -73.01 -24.71 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.457 0 C-N-CA 119.788 -0.765 . . . . 0.0 111.474 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -49.9 -60.54 2.82 Favored 'General case' 0 N--CA 1.516 2.871 0 O-C-N 120.933 -1.104 . . . . 0.0 110.047 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.441 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.7 p -126.41 -164.7 1.36 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.313 -0.867 . . . . 0.0 110.291 179.262 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . 0.412 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -101.34 65.72 0.49 Allowed Glycine 0 N--CA 1.493 2.481 0 N-CA-C 107.831 -2.108 . . . . 0.0 107.831 178.296 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 31.8 t -103.64 142.78 33.72 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.397 -1.06 . . . . 0.0 109.965 -178.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 26.4 mtt-85 -98.55 49.04 0.98 Allowed 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.247 -0.908 . . . . 0.0 109.42 179.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 71.56 99.01 0.06 OUTLIER Glycine 0 N--CA 1.486 2.007 0 N-CA-C 109.749 -1.34 . . . . 0.0 109.749 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 p -110.63 126.02 54.04 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.31 -1.112 . . . . 0.0 110.335 179.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -146.3 146.42 30.7 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.087 -1.008 . . . . 0.0 110.141 -179.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.5 2.04 0 O-C-N 121.171 -0.955 . . . . 0.0 110.506 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.425 ' HB3' ' CE3' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.502 2.158 0 CA-C-O 120.343 0.116 . . . . 0.0 110.704 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -73.97 162.5 38.98 Favored 'Trans proline' 0 C--N 1.318 -1.038 0 O-C-N 123.152 1.08 . . . . 0.0 110.599 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -49.26 -31.68 9.34 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 121.351 -0.843 . . . . 0.0 111.329 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.04 -33.95 45.55 Favored Glycine 0 N--CA 1.498 2.808 0 O-C-N 120.961 -1.087 . . . . 0.0 110.695 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -54.65 -32.92 59.92 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 120.862 -1.375 . . . . 0.0 110.734 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -54.33 -38.16 65.69 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 121.083 -1.011 . . . . 0.0 110.256 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -58.15 -35.07 70.99 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.294 -0.879 . . . . 0.0 110.341 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pt -117.62 35.71 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.157 -0.965 . . . . 0.0 110.604 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.427 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -83.36 -43.73 0.84 Allowed Pre-proline 0 N--CA 1.509 2.492 0 O-C-N 121.037 -1.039 . . . . 0.0 113.186 -179.286 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.9 Cg_endo -75.48 -36.9 2.03 Favored 'Trans proline' 0 N--CA 1.486 1.087 0 O-C-N 122.656 0.819 . . . . 0.0 111.666 -178.151 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 69.9 m -61.04 -44.91 96.69 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 121.036 -1.04 . . . . 0.0 109.879 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.412 HD23 ' CD2' ' A' ' 86' ' ' TYR . 2.5 mt -62.77 -38.31 90.12 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.428 -0.909 . . . . 0.0 109.676 179.461 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.8 m -56.85 -35.04 68.4 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.096 -1.002 . . . . 0.0 110.371 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -56.9 -38.68 73.17 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.054 -1.029 . . . . 0.0 110.001 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.427 ' CD2' ' HD2' ' A' ' 59' ' ' ARG . 22.3 m-85 -59.05 -40.08 84.02 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.228 -0.92 . . . . 0.0 110.028 179.678 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -61.05 -22.59 64.72 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.266 -0.896 . . . . 0.0 111.501 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 2.9 mp -80.84 -36.1 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.465 0 O-C-N 120.836 -1.165 . . . . 0.0 109.571 179.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -80.77 -37.11 30.92 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.028 -1.045 . . . . 0.0 108.9 178.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.21 -33.51 67.67 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.18 -0.95 . . . . 0.0 110.135 178.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.0 ptm180 -70.71 -37.3 73.52 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.884 -1.135 . . . . 0.0 109.791 179.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.1 -39.14 92.74 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.04 -1.038 . . . . 0.0 109.54 179.199 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.402 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -66.65 -40.77 88.82 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.218 -0.927 . . . . 0.0 109.516 179.344 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -59.14 -35.77 74.07 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.213 -0.93 . . . . 0.0 110.475 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.9 mttt -94.96 -36.17 11.69 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 121.068 -1.02 . . . . 0.0 110.925 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 . . . . . 0 N--CA 1.51 2.532 0 O-C-N 121.007 -1.058 . . . . 0.0 110.379 179.982 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.502 2.174 0 CA-C-O 120.625 0.25 . . . . 0.0 110.655 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -57.35 -36.54 71.32 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.112 -0.993 . . . . 0.0 110.34 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.419 ' HA ' ' CE3' ' A' ' 50' ' ' TRP . 16.9 mt-10 -58.11 -39.77 79.51 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.137 -0.977 . . . . 0.0 110.201 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 43.4 tp60 -63.22 -43.05 99.21 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.385 -0.926 . . . . 0.0 109.643 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -58.76 -37.78 77.02 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.109 -0.995 . . . . 0.0 110.166 179.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.437 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.8 m0 -59.81 -37.54 79.44 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.17 -0.956 . . . . 0.0 109.955 179.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -60.65 -29.77 69.48 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.012 -1.055 . . . . 0.0 109.705 178.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.402 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 77.2 mt -70.63 -60.42 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.289 0 O-C-N 121.024 -1.048 . . . . 0.0 108.918 179.157 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.6 ptm -61.24 -29.94 70.14 Favored 'General case' 0 N--CA 1.509 2.478 0 C-N-CA 118.691 -1.204 . . . . 0.0 109.778 178.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -68.06 -37.6 81.49 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.909 -1.12 . . . . 0.0 109.208 178.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.41 HD22 ' CE2' ' A' ' 26' ' ' PHE . 11.4 mt -53.22 -33.26 52.1 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.959 -1.088 . . . . 0.0 110.211 179.069 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.444 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 8.2 t60 -55.12 -36.79 66.1 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.057 -1.027 . . . . 0.0 110.178 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.427 ' NE2' HD22 ' A' ' 91' ' ' LEU . 5.8 m170 -59.86 -49.62 77.0 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.086 -1.008 . . . . 0.0 109.365 179.167 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 -61.06 -37.7 83.57 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.324 -0.95 . . . . 0.0 109.17 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.427 ' HD2' ' CD2' ' A' ' 26' ' ' PHE . 6.9 mtp85 -62.23 -49.16 76.83 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.213 -0.929 . . . . 0.0 109.167 178.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 87.5 p -63.34 -39.02 93.39 Favored 'General case' 0 N--CA 1.504 2.233 0 C-N-CA 119.415 -0.914 . . . . 0.0 109.257 179.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.414 ' O ' ' OG1' ' A' ' 65' ' ' THR . 33.6 ttp85 -64.67 -40.49 95.51 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.145 -0.972 . . . . 0.0 109.117 178.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -63.05 -50.88 68.88 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.192 -0.942 . . . . 0.0 109.319 179.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.407 HG21 HD12 ' A' ' 63' ' ' ILE . 84.0 mt -69.65 -38.16 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.436 0 C-N-CA 119.386 -0.926 . . . . 0.0 109.341 179.27 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 12.4 t80 -66.42 -42.83 87.18 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.103 -0.998 . . . . 0.0 108.989 179.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.414 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 91.2 m -60.83 -40.64 93.55 Favored 'General case' 0 N--CA 1.502 2.173 0 C-N-CA 119.335 -0.946 . . . . 0.0 110.482 -179.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.404 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -83.22 -34.55 25.85 Favored 'General case' 0 N--CA 1.504 2.245 0 C-N-CA 118.796 -1.162 . . . . 0.0 112.54 -178.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.417 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 33.5 t80 -86.52 -32.2 20.87 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 120.622 -1.299 . . . . 0.0 112.184 -179.212 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -98.35 -18.06 18.52 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.774 -1.203 . . . . 0.0 113.152 -178.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.6 mtpp -115.85 -57.24 2.25 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 120.46 -1.4 . . . . 0.0 110.993 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.5 mtt85 -76.02 -30.11 58.35 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.173 -0.954 . . . . 0.0 110.761 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.3 tptt 59.96 45.08 12.65 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 120.827 -1.17 . . . . 0.0 109.969 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -107.68 34.97 3.27 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.372 -0.83 . . . . 0.0 109.48 178.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.406 HD13 HG22 ' A' ' 73' ' ' ILE . 13.0 tt -151.82 162.68 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.239 -0.913 . . . . 0.0 109.742 -179.683 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 78.3 p -107.23 145.52 32.57 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.088 -1.008 . . . . 0.0 110.02 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -45.36 -32.84 2.23 Favored 'General case' 0 N--CA 1.518 2.932 0 O-C-N 121.328 -0.858 . . . . 0.0 111.455 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -60.94 -48.69 80.66 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 120.93 -1.106 . . . . 0.0 109.32 179.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 47.3 tp -68.26 -44.41 75.68 Favored 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 119.171 -1.011 . . . . 0.0 108.337 178.532 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.417 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 15.3 t80 -59.51 -37.29 77.92 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.389 -0.819 . . . . 0.0 109.557 179.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -76.08 -41.67 49.81 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.125 -0.985 . . . . 0.0 108.842 178.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.429 ' CE2' ' HG3' ' A' ' 84' ' ' GLU . 82.9 t90 -58.82 -37.96 77.56 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.135 -0.978 . . . . 0.0 109.198 178.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.442 HD22 ' CD2' ' A' ' 86' ' ' TYR . 11.9 mt -66.95 -58.04 5.75 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.223 -0.923 . . . . 0.0 108.984 178.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -56.19 -27.19 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 121.223 -0.923 . . . . 0.0 110.767 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.6 ttpm? -89.13 -16.69 30.85 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 120.915 -1.115 . . . . 0.0 111.905 179.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.429 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 43.4 mm-40 -105.46 25.63 10.47 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 120.622 -1.299 . . . . 0.0 111.982 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.403 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 0.8 OUTLIER 76.47 68.37 0.06 Allowed 'General case' 0 N--CA 1.512 2.67 0 O-C-N 121.265 -0.897 . . . . 0.0 111.959 179.413 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.442 ' CD2' HD22 ' A' ' 81' ' ' LEU . 27.3 m-85 -131.12 -62.71 0.88 Allowed 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -134.84 168.4 19.12 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.476 -0.765 . . . . 0.0 109.303 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.444 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 15.3 t0 -116.09 109.92 18.16 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.093 -1.004 . . . . 0.0 110.555 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.8 mttt -58.95 -38.04 78.12 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.208 -0.933 . . . . 0.0 109.927 179.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 18.0 tp -58.51 -38.22 77.22 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.131 -0.981 . . . . 0.0 110.033 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.427 HD22 ' NE2' ' A' ' 57' ' ' HIS . 58.4 tp -69.46 -47.23 64.64 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 120.996 -1.065 . . . . 0.0 108.856 179.299 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.426 HG23 HD12 ' A' ' 92' ' ' ILE . 72.8 mt -59.65 -39.16 78.85 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.42 0 O-C-N 121.155 -0.966 . . . . 0.0 108.527 178.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.17 -39.68 93.24 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.139 -0.976 . . . . 0.0 109.196 178.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 6.1 mmtm -56.74 -41.82 78.19 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.069 -1.019 . . . . 0.0 109.578 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.4 m0 -64.48 -33.65 76.37 Favored 'General case' 0 N--CA 1.507 2.41 0 C-N-CA 119.514 -0.875 . . . . 0.0 110.355 179.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -81.81 -34.51 30.23 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.089 -1.007 . . . . 0.0 110.586 179.523 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 25.3 mmtt -50.72 175.11 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.787 0 O-C-N 120.973 -1.079 . . . . 0.0 110.833 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 13.1 t -100.65 141.39 33.59 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.181 -0.949 . . . . 0.0 109.695 179.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.72 -24.96 30.09 Favored Glycine 0 N--CA 1.494 2.556 0 C-N-CA 119.888 -1.149 . . . . 0.0 110.523 -179.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -91.82 58.11 3.36 Favored 'General case' 0 N--CA 1.503 2.206 0 CA-C-N 119.171 1.486 . . . . 0.0 110.225 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -71.96 -37.19 69.98 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.029 -1.044 . . . . 0.0 110.141 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -124.81 85.38 2.4 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.127 -0.983 . . . . 0.0 110.361 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -126.05 150.1 48.38 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.149 -0.97 . . . . 0.0 110.35 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.426 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 27.0 p -114.37 -31.35 6.29 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.227 -0.92 . . . . 0.0 113.144 -179.651 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.558 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.0 m -142.59 -167.94 2.63 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.171 -1.581 . . . . 0.0 109.928 179.215 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 15.3 mt -96.09 -39.56 9.66 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.266 -0.896 . . . . 0.0 109.943 179.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 46.7 ttt-85 -101.98 29.68 4.89 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 120.961 -1.087 . . . . 0.0 110.134 178.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.558 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.296 1.8 t -126.07 16.63 7.88 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.025 -1.047 . . . . 0.0 108.925 -179.784 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.5 pt -156.29 34.56 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.17 0 O-C-N 120.791 -1.193 . . . . 0.0 110.776 -178.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 . . . . . 0 N--CA 1.497 1.924 0 O-C-N 120.795 -1.191 . . . . 0.0 111.122 -179.222 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.497 1.902 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 41.6 t -62.56 152.93 33.49 Favored 'General case' 0 N--CA 1.505 2.275 0 C-N-CA 118.962 -1.095 . . . . 0.0 108.985 179.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.448 ' CG2' ' CE1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -75.57 -36.1 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 121.022 -1.049 . . . . 0.0 111.39 -178.803 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.484 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 10.8 p -53.46 -32.34 49.6 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 120.785 -1.197 . . . . 0.0 111.362 -178.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.91 -34.28 73.0 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 120.842 -1.161 . . . . 0.0 109.526 178.316 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 56.1 t -82.34 125.42 76.62 Favored Pre-proline 0 N--CA 1.503 2.22 0 O-C-N 121.053 -1.03 . . . . 0.0 109.647 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -65.56 179.85 1.51 Allowed 'Trans proline' 0 N--CA 1.489 1.226 0 O-C-N 123.159 1.084 . . . . 0.0 110.721 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 2.6 tpp85 -75.18 -35.93 61.52 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.201 -0.937 . . . . 0.0 110.953 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.42 -47.38 86.35 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.023 -1.048 . . . . 0.0 109.797 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -64.62 -41.53 96.13 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.219 -0.926 . . . . 0.0 109.263 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 52.3 mt -62.59 -39.26 93.18 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.285 -0.884 . . . . 0.0 109.672 179.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -59.26 -39.62 83.44 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.102 -0.999 . . . . 0.0 110.059 179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -57.98 -36.53 72.74 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.145 -0.972 . . . . 0.0 110.467 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -59.74 -39.55 85.13 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.169 -0.957 . . . . 0.0 110.27 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.89 -44.91 96.47 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.082 -1.011 . . . . 0.0 109.93 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 10.4 mmt85 -59.72 -38.78 82.62 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.142 -0.974 . . . . 0.0 109.886 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 76.1 mttt -58.9 -36.35 74.55 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.147 -0.971 . . . . 0.0 110.554 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 22.6 mtmt -107.37 21.53 17.36 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.002 -1.061 . . . . 0.0 111.797 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.76 46.04 60.18 Favored Glycine 0 N--CA 1.5 2.918 0 O-C-N 120.648 -1.282 . . . . 0.0 110.545 179.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.9 t -140.6 -165.18 1.88 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.105 -1.232 . . . . 0.0 110.154 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -127.41 173.59 9.69 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.154 -0.966 . . . . 0.0 110.354 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.2 p -159.1 160.71 1.8 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.975 0 O-C-N 121.225 -0.922 . . . . 0.0 110.774 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 28.3 t -168.95 85.18 0.15 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.215 -0.928 . . . . 0.0 110.995 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.484 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 50.9 t80 -95.61 160.92 14.27 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.243 -0.911 . . . . 0.0 110.538 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 38.0 m80 -140.49 -60.54 0.51 Allowed 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.007 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -131.78 151.83 51.39 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.404 -0.81 . . . . 0.0 109.095 178.84 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 28.8 p -95.57 153.65 17.6 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.027 -1.045 . . . . 0.0 110.96 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 27.3 m -71.98 -25.49 23.97 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.461 0 O-C-N 121.432 -0.793 . . . . 0.0 111.595 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -50.34 -61.67 2.04 Favored 'General case' 0 N--CA 1.514 2.748 0 O-C-N 120.888 -1.133 . . . . 0.0 110.336 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.437 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.3 p -124.56 -164.46 1.27 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.183 -0.948 . . . . 0.0 110.544 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.0 60.45 0.72 Allowed Glycine 0 N--CA 1.492 2.431 0 N-CA-C 108.13 -1.988 . . . . 0.0 108.13 178.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 28.4 t -102.26 142.44 33.48 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.333 -1.098 . . . . 0.0 109.818 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 6.2 mtt85 -99.04 49.04 0.96 Allowed 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.272 -0.892 . . . . 0.0 109.613 179.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 73.15 96.55 0.08 OUTLIER Glycine 0 N--CA 1.488 2.163 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.0 p -108.68 126.22 52.74 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.205 -1.174 . . . . 0.0 110.32 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -152.77 148.93 27.81 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.098 -1.001 . . . . 0.0 110.467 -179.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 3.5 m . . . . . 0 N--CA 1.503 2.217 0 O-C-N 121.328 -0.857 . . . . 0.0 110.572 -179.976 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.447 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.512 2.631 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -84.36 82.68 1.8 Allowed 'Trans proline' 0 C--N 1.32 -0.922 0 O-C-N 123.129 1.068 . . . . 0.0 112.422 -178.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 48.73 92.67 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.258 -0.901 . . . . 0.0 111.737 178.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.73 -39.05 0.51 Allowed Glycine 0 N--CA 1.499 2.886 0 C-N-CA 119.792 -1.194 . . . . 0.0 110.538 179.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -57.03 -29.74 63.63 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.063 -1.257 . . . . 0.0 110.462 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -52.86 -34.53 54.84 Favored 'General case' 0 N--CA 1.511 2.608 0 O-C-N 120.889 -1.132 . . . . 0.0 110.156 179.259 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.1 mtpp -58.73 -38.61 78.75 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.181 -0.949 . . . . 0.0 110.144 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pt -116.74 36.58 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.17 -0.956 . . . . 0.0 110.43 179.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.423 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -84.08 -43.24 0.76 Allowed Pre-proline 0 N--CA 1.511 2.579 0 O-C-N 121.056 -1.028 . . . . 0.0 113.531 -178.804 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.2 Cg_endo -74.27 -34.55 4.66 Favored 'Trans proline' 0 N--CA 1.487 1.09 0 O-C-N 122.587 0.783 . . . . 0.0 112.043 -177.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.42 HG21 ' CE2' ' A' ' 62' ' ' TYR . 84.1 m -60.91 -43.56 98.4 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 120.973 -1.08 . . . . 0.0 110.071 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.46 -39.11 93.59 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.224 -0.923 . . . . 0.0 109.792 179.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -57.42 -35.04 69.55 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.102 -0.999 . . . . 0.0 110.29 179.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -57.31 -35.94 70.47 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.038 -1.039 . . . . 0.0 110.311 179.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.434 ' CD1' ' HD3' ' A' ' 59' ' ' ARG . 16.1 m-85 -57.67 -39.35 76.89 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.094 -1.003 . . . . 0.0 110.48 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -58.66 -39.69 81.36 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.223 -0.923 . . . . 0.0 110.487 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.1 mp -65.72 -41.1 89.68 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 C-N-CA 119.221 -0.992 . . . . 0.0 108.83 179.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -70.49 -49.59 46.81 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.198 -1.001 . . . . 0.0 108.619 178.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.84 -34.46 73.13 Favored 'General case' 0 N--CA 1.507 2.42 0 C-N-CA 119.376 -0.929 . . . . 0.0 109.558 178.508 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 3.7 mtt85 -56.91 -39.63 74.78 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.041 -1.037 . . . . 0.0 110.071 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.48 -47.86 77.37 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.206 -0.997 . . . . 0.0 109.754 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.406 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -69.6 -37.93 77.08 Favored 'General case' 0 N--CA 1.504 2.265 0 C-N-CA 119.225 -0.99 . . . . 0.0 109.512 179.121 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 13.5 mt-30 -66.63 -32.73 74.25 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.222 -0.924 . . . . 0.0 110.277 179.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.1 mttp -95.05 -35.03 12.09 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 120.962 -1.086 . . . . 0.0 110.921 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 11.7 t70 . . . . . 0 N--CA 1.511 2.587 0 O-C-N 120.988 -1.07 . . . . 0.0 110.261 -179.934 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.502 2.151 0 CA-C-O 120.598 0.237 . . . . 0.0 110.488 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -58.63 -39.67 81.16 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.109 -0.994 . . . . 0.0 110.048 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -62.73 -42.5 99.69 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.266 -0.896 . . . . 0.0 109.829 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 58.1 tp60 -60.42 -39.26 86.78 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.168 -0.957 . . . . 0.0 109.872 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -57.85 -38.43 75.65 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.122 -0.986 . . . . 0.0 110.062 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.431 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.1 m0 -58.01 -36.12 72.24 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.157 -0.964 . . . . 0.0 109.989 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -61.95 -29.28 70.13 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.064 -1.022 . . . . 0.0 109.79 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.406 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 22.1 mt -72.26 -59.28 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.201 0 O-C-N 120.942 -1.099 . . . . 0.0 109.181 179.429 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.6 ptm -58.85 -27.89 65.56 Favored 'General case' 0 N--CA 1.511 2.6 0 C-N-CA 118.45 -1.3 . . . . 0.0 109.827 178.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.5 mm100 -69.86 -37.66 76.18 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 120.823 -1.173 . . . . 0.0 109.05 177.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.41 HD23 ' CD2' ' A' ' 26' ' ' PHE . 11.2 mt -53.36 -32.61 50.09 Favored 'General case' 0 N--CA 1.512 2.65 0 O-C-N 120.951 -1.093 . . . . 0.0 110.128 179.007 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.436 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 23.0 t60 -55.83 -36.82 67.9 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.145 -0.972 . . . . 0.0 110.198 179.73 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.426 ' NE2' HD21 ' A' ' 91' ' ' LEU . 7.4 m170 -59.64 -48.9 79.86 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.095 -1.003 . . . . 0.0 109.387 179.237 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.2 tp60 -58.37 -34.19 70.42 Favored 'General case' 0 N--CA 1.508 2.435 0 C-N-CA 119.461 -0.896 . . . . 0.0 109.573 178.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.434 ' HD3' ' CD1' ' A' ' 26' ' ' PHE . 38.8 mmm-85 -64.77 -52.87 54.64 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.031 -1.043 . . . . 0.0 109.28 179.066 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 84.5 p -64.02 -40.04 95.44 Favored 'General case' 0 N--CA 1.503 2.187 0 C-N-CA 119.3 -0.96 . . . . 0.0 108.997 179.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.431 ' O ' ' OG1' ' A' ' 65' ' ' THR . 0.1 OUTLIER -63.11 -40.17 96.84 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.197 -0.939 . . . . 0.0 109.051 178.856 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.42 ' CE2' HG21 ' A' ' 22' ' ' THR . 30.5 t80 -63.58 -53.33 53.33 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.098 -1.001 . . . . 0.0 109.009 179.212 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 75.8 mt -65.64 -37.18 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.333 0 C-N-CA 119.223 -0.991 . . . . 0.0 109.19 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.421 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 8.1 t80 -66.03 -41.55 90.77 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.059 -1.026 . . . . 0.0 108.778 178.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.431 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 91.7 m -59.28 -41.44 88.92 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.211 -0.931 . . . . 0.0 110.806 -179.453 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.7 pp -83.06 -34.9 26.1 Favored 'General case' 0 N--CA 1.505 2.282 0 C-N-CA 118.764 -1.174 . . . . 0.0 112.823 -178.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.435 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 52.0 t80 -86.27 -32.02 21.32 Favored 'General case' 0 N--CA 1.514 2.751 0 O-C-N 120.564 -1.335 . . . . 0.0 111.961 -179.345 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.421 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 11.8 m-85 -97.05 -16.82 20.36 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 120.729 -1.232 . . . . 0.0 112.584 -178.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 5.8 mttt -124.74 -59.6 1.43 Allowed 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.495 -1.378 . . . . 0.0 110.996 179.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.2 ttt85 -59.94 -30.38 69.03 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.03 -1.044 . . . . 0.0 110.906 -179.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 27.2 tptt 57.1 41.2 27.69 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.803 -1.185 . . . . 0.0 110.131 -179.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.06 37.47 3.66 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.399 -0.813 . . . . 0.0 109.725 179.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.443 HG22 HD13 ' A' ' 73' ' ' ILE . 13.7 tt -154.23 162.77 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 121.249 -0.907 . . . . 0.0 109.904 -179.73 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 4.9 p -110.08 149.7 29.65 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.092 -1.005 . . . . 0.0 110.354 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 71.5 tttt -45.79 -32.35 2.5 Favored 'General case' 0 N--CA 1.515 2.799 0 O-C-N 121.338 -0.851 . . . . 0.0 111.596 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -65.49 -47.02 77.48 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 120.846 -1.159 . . . . 0.0 109.51 179.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.48 -41.61 84.27 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.183 -0.948 . . . . 0.0 108.727 179.02 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.435 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 14.6 t80 -67.85 -41.07 83.51 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.265 -0.897 . . . . 0.0 109.188 179.135 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -72.11 -40.7 67.98 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.19 -0.944 . . . . 0.0 108.795 178.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.447 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 80.5 t90 -55.11 -37.92 67.49 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.265 -0.897 . . . . 0.0 109.532 178.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.464 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 17.1 mt -69.69 -48.84 58.27 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 119.344 -0.942 . . . . 0.0 108.561 178.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.405 HG23 HD11 ' A' ' 82' ' ' ILE . 35.4 mm -57.4 -32.72 42.1 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.573 0 O-C-N 121.281 -0.887 . . . . 0.0 109.904 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.8 tttt -86.87 -23.9 25.09 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.952 -1.092 . . . . 0.0 111.589 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.413 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 16.7 mm-40 -97.39 19.4 13.31 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 120.707 -1.246 . . . . 0.0 111.948 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 28.2 tttt 73.38 80.53 0.13 Allowed 'General case' 0 N--CA 1.51 2.565 0 O-C-N 120.914 -1.116 . . . . 0.0 111.327 179.268 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.464 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 29.3 m-85 -137.24 -64.03 0.58 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.546 -0.722 . . . . 0.0 109.932 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -118.31 -172.55 2.29 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.419 -0.8 . . . . 0.0 109.593 179.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.436 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 7.1 t0 -122.56 102.77 8.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.058 -1.026 . . . . 0.0 110.373 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 12.0 mtpt -64.35 -40.19 95.38 Favored 'General case' 0 N--CA 1.508 2.429 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.63 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 32.4 tp -59.78 -37.21 78.44 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.23 -0.918 . . . . 0.0 110.056 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.426 HD21 ' NE2' ' A' ' 57' ' ' HIS . 34.3 tp -71.73 -48.16 48.86 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.005 -1.059 . . . . 0.0 108.756 179.142 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.412 HD13 HG21 ' A' ' 92' ' ' ILE . 50.7 mt -58.86 -36.19 60.01 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 C-N-CA 119.378 -0.929 . . . . 0.0 108.7 178.293 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.94 -39.48 83.44 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.128 -0.983 . . . . 0.0 109.062 178.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.402 ' HB3' ' CD2' ' A' ' 103' ' ' LEU . 7.1 mmtt -58.49 -44.35 89.34 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.139 -0.975 . . . . 0.0 109.364 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.412 ' CH2' HD21 ' A' ' 91' ' ' LEU . 7.8 m0 -65.72 -41.19 92.58 Favored 'General case' 0 N--CA 1.507 2.406 0 C-N-CA 119.557 -0.857 . . . . 0.0 109.506 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.71 -33.29 75.53 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.283 -0.885 . . . . 0.0 110.425 179.479 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.1 mmtp -54.31 -176.78 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.646 0 O-C-N 121.056 -1.028 . . . . 0.0 110.535 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 32.1 m -105.87 132.75 51.61 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.172 -0.955 . . . . 0.0 109.85 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 98.57 10.92 49.23 Favored Glycine 0 N--CA 1.492 2.427 0 C-N-CA 120.213 -0.994 . . . . 0.0 111.087 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -115.97 69.51 0.74 Allowed 'General case' 0 N--CA 1.495 1.778 0 CA-C-N 119.487 1.644 . . . . 0.0 110.117 179.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -92.08 -38.95 11.89 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.221 -0.924 . . . . 0.0 109.96 179.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -110.15 78.5 1.13 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.151 -0.968 . . . . 0.0 109.61 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.402 ' CD2' ' HB3' ' A' ' 94' ' ' LYS . 8.9 tp -122.23 137.87 54.69 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.242 -0.911 . . . . 0.0 109.823 -179.24 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.424 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 28.1 p -111.61 -38.6 4.86 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.234 -0.916 . . . . 0.0 112.483 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.598 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 6.9 m -138.76 -168.49 2.42 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.17 -1.581 . . . . 0.0 109.85 179.077 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 13.9 mt -97.48 -38.15 9.7 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.177 -0.952 . . . . 0.0 110.295 179.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -102.2 31.34 4.02 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 120.953 -1.092 . . . . 0.0 109.804 178.221 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.598 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.7 t -125.86 16.28 8.01 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.131 -0.981 . . . . 0.0 108.929 -179.592 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.402 ' CG2' ' O ' ' A' ' 108' ' ' CYS . 1.1 pt -159.01 38.01 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.38 0 O-C-N 120.922 -1.111 . . . . 0.0 110.4 -178.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.415 ' O ' ' OG1' ' A' ' 119' ' ' THR . 2.0 tt0 . . . . . 0 N--CA 1.499 2.006 0 O-C-N 120.739 -1.226 . . . . 0.0 111.698 -178.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.415 ' OG1' ' O ' ' A' ' 110' ' ' GLN . 4.4 m . . . . . 0 N--CA 1.495 1.779 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 48.6 t -87.17 154.15 20.95 Favored 'General case' 0 N--CA 1.499 2.017 0 C-N-CA 119.499 -0.88 . . . . 0.0 109.202 179.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.447 ' CG2' ' CE1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -72.64 -36.11 52.46 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.433 0 O-C-N 121.16 -0.962 . . . . 0.0 111.012 -179.225 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.47 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 7.9 p -55.46 -34.32 64.42 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 120.846 -1.158 . . . . 0.0 110.911 -178.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 16.8 ttt-85 -59.32 -36.43 75.62 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 120.995 -1.066 . . . . 0.0 109.681 178.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 61.0 t -76.19 125.42 87.87 Favored Pre-proline 0 N--CA 1.504 2.24 0 O-C-N 121.171 -0.956 . . . . 0.0 109.795 179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -64.02 178.2 1.59 Allowed 'Trans proline' 0 N--CA 1.49 1.283 0 O-C-N 123.228 1.12 . . . . 0.0 110.791 179.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.09 -37.27 61.61 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.22 -0.925 . . . . 0.0 110.635 -179.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.41 -41.64 85.4 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.013 -1.054 . . . . 0.0 109.929 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 37.3 tp60 -68.8 -41.44 78.69 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 119.395 -0.922 . . . . 0.0 109.103 179.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 3.9 mt -62.54 -38.69 90.99 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.288 -0.883 . . . . 0.0 109.757 179.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -60.2 -39.83 87.97 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.193 -0.942 . . . . 0.0 109.971 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -58.08 -35.88 72.03 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.151 -0.968 . . . . 0.0 110.475 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -59.98 -40.99 91.03 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.152 -0.968 . . . . 0.0 110.164 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.72 -45.02 95.76 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.144 -0.972 . . . . 0.0 109.798 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 15.2 mtp85 -58.69 -38.7 78.82 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.208 -0.932 . . . . 0.0 109.929 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -58.01 -36.38 72.59 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.17 -0.956 . . . . 0.0 110.486 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 2.6 mtpm? -107.82 21.08 17.94 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.008 -1.057 . . . . 0.0 111.806 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 53.88 45.87 69.62 Favored Glycine 0 N--CA 1.499 2.85 0 O-C-N 120.572 -1.33 . . . . 0.0 110.467 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.7 t -141.68 -164.36 1.76 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.217 -1.167 . . . . 0.0 110.145 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -130.46 155.1 47.01 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.12 -0.988 . . . . 0.0 110.237 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 8.4 p -131.51 161.52 41.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.213 -0.929 . . . . 0.0 110.148 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 31.2 t -165.53 86.01 0.37 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.24 -0.913 . . . . 0.0 111.087 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.47 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 52.0 t80 -97.26 159.57 14.84 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.216 -0.927 . . . . 0.0 110.382 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 22.5 m80 -138.08 -61.13 0.62 Allowed 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 179.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -133.73 151.01 51.5 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.418 -0.801 . . . . 0.0 108.93 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 31.6 p -91.98 152.53 19.97 Favored 'General case' 0 N--CA 1.505 2.285 0 C-N-CA 119.063 -1.055 . . . . 0.0 111.142 -179.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 23.2 m -69.71 -26.46 30.69 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.449 0 C-N-CA 119.748 -0.781 . . . . 0.0 111.347 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.1 m-70 -50.91 -60.18 3.35 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 120.84 -1.163 . . . . 0.0 110.142 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.431 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 25.7 p -126.82 -167.41 1.72 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.3 -0.875 . . . . 0.0 110.797 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -98.98 58.17 0.89 Allowed Glycine 0 N--CA 1.491 2.346 0 N-CA-C 108.04 -2.024 . . . . 0.0 108.04 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 16.8 t -99.67 145.97 27.01 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.442 -1.034 . . . . 0.0 109.755 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 4.9 ttm-85 -97.83 50.79 1.04 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.226 -0.922 . . . . 0.0 109.318 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.31 97.33 0.03 OUTLIER Glycine 0 N--CA 1.486 2.019 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.1 p -109.09 128.23 54.81 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.293 -1.122 . . . . 0.0 110.327 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -143.02 130.23 20.87 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.069 -1.02 . . . . 0.0 110.099 -179.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.502 2.151 0 O-C-N 121.17 -0.957 . . . . 0.0 110.606 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.444 ' HB3' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.504 2.269 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -71.95 166.41 29.65 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 O-C-N 123.308 1.162 . . . . 0.0 110.835 -179.667 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -47.97 -31.93 5.87 Favored 'General case' 0 N--CA 1.515 2.825 0 O-C-N 121.507 -0.745 . . . . 0.0 111.529 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.49 -34.46 34.74 Favored Glycine 0 N--CA 1.5 2.931 0 O-C-N 120.96 -1.087 . . . . 0.0 110.585 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -55.56 -33.27 63.72 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 120.938 -1.33 . . . . 0.0 110.555 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -54.32 -37.8 65.26 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.046 -1.034 . . . . 0.0 110.167 179.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.5 mtpt -57.4 -36.56 71.44 Favored 'General case' 0 N--CA 1.511 2.585 0 O-C-N 121.298 -0.877 . . . . 0.0 110.117 179.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.418 HG23 ' OH ' ' A' ' 62' ' ' TYR . 2.8 pt -118.69 35.28 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.2 -0.937 . . . . 0.0 110.388 179.453 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -83.73 -43.37 0.8 Allowed Pre-proline 0 N--CA 1.508 2.457 0 O-C-N 120.976 -1.077 . . . . 0.0 113.105 -179.087 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.8 Cg_endo -76.27 -36.4 1.85 Allowed 'Trans proline' 0 N--CA 1.487 1.113 0 O-C-N 122.583 0.78 . . . . 0.0 111.506 -178.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 78.5 m -59.8 -42.92 94.5 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.02 -1.05 . . . . 0.0 110.092 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.416 HD21 ' CD2' ' A' ' 86' ' ' TYR . 2.7 mt -64.37 -39.84 94.66 Favored 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.672 179.601 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -57.97 -35.27 70.93 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.107 -0.996 . . . . 0.0 110.228 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -56.22 -34.52 66.4 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.127 -0.983 . . . . 0.0 110.528 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.436 ' CD2' ' HD3' ' A' ' 59' ' ' ARG . 13.9 m-85 -58.52 -40.35 82.65 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.037 -1.04 . . . . 0.0 110.642 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -60.41 -39.93 89.16 Favored 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.653 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.2 mp -66.08 -39.96 85.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.381 0 C-N-CA 119.195 -1.002 . . . . 0.0 109.126 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -70.34 -49.15 52.32 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.081 -1.012 . . . . 0.0 108.689 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.91 -32.94 74.33 Favored 'General case' 0 N--CA 1.508 2.433 0 C-N-CA 119.229 -0.988 . . . . 0.0 108.926 178.186 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 23.1 mtt180 -56.9 -40.31 76.04 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.009 -1.057 . . . . 0.0 110.018 179.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -62.9 -51.09 68.32 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.252 -0.979 . . . . 0.0 109.417 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.419 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -65.75 -40.35 92.0 Favored 'General case' 0 N--CA 1.504 2.263 0 C-N-CA 119.227 -0.989 . . . . 0.0 109.11 179.038 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -62.74 -38.59 91.13 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.178 -0.951 . . . . 0.0 109.641 179.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.0 mmtm -60.5 -39.26 87.1 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.134 -0.979 . . . . 0.0 110.02 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 . . . . . 0 N--CA 1.51 2.534 0 O-C-N 121.142 -0.973 . . . . 0.0 110.114 179.867 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.9 p . . . . . 0 N--CA 1.498 1.961 0 CA-C-O 120.629 0.252 . . . . 0.0 110.553 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -55.91 -37.97 69.62 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.163 -0.96 . . . . 0.0 110.142 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -61.01 -40.96 95.55 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.17 -0.957 . . . . 0.0 109.823 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -62.64 -40.23 96.37 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.195 -0.941 . . . . 0.0 109.82 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -59.46 -38.03 79.69 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.203 -0.935 . . . . 0.0 110.26 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.429 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.5 m0 -58.36 -36.67 73.81 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.038 -1.039 . . . . 0.0 110.127 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -62.33 -30.34 71.09 Favored 'General case' 0 N--CA 1.506 2.327 0 C-N-CA 119.204 -0.998 . . . . 0.0 109.983 178.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.419 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 69.6 mt -71.91 -57.09 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.269 0 O-C-N 120.913 -1.117 . . . . 0.0 109.466 179.526 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.5 ptm -61.13 -29.48 69.8 Favored 'General case' 0 N--CA 1.509 2.49 0 C-N-CA 118.414 -1.314 . . . . 0.0 109.704 178.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -67.82 -37.42 81.93 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.841 -1.162 . . . . 0.0 109.09 178.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.406 HD21 ' CD1' ' A' ' 26' ' ' PHE . 11.0 mt -53.15 -31.87 44.72 Favored 'General case' 0 N--CA 1.512 2.636 0 O-C-N 120.965 -1.084 . . . . 0.0 110.169 178.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.439 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 70.6 t60 -54.79 -39.3 68.29 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.038 -1.038 . . . . 0.0 109.828 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.428 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 5.7 m170 -59.49 -46.61 88.31 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.158 -0.964 . . . . 0.0 109.404 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.9 tp-100 -59.44 -34.93 73.11 Favored 'General case' 0 N--CA 1.506 2.349 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.489 178.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.436 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 8.2 mmm-85 -65.39 -53.33 44.86 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.041 -1.037 . . . . 0.0 109.194 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 12.3 p -61.65 -38.58 88.23 Favored 'General case' 0 N--CA 1.505 2.277 0 C-N-CA 119.3 -0.96 . . . . 0.0 109.357 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.436 ' O ' ' OG1' ' A' ' 65' ' ' THR . 6.3 ttt85 -65.1 -41.37 95.02 Favored 'General case' 0 N--CA 1.504 2.259 0 C-N-CA 119.216 -0.993 . . . . 0.0 109.221 179.064 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.418 ' OH ' HG23 ' A' ' 19' ' ' ILE . 40.1 t80 -62.62 -49.54 74.8 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.17 -0.956 . . . . 0.0 109.547 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.45 ' CG2' ' CD1' ' A' ' 78' ' ' TYR . 85.4 mt -71.85 -38.85 66.62 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.327 0 O-C-N 121.204 -0.935 . . . . 0.0 109.448 179.564 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 9.4 t80 -66.03 -42.25 89.86 Favored 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.107 -0.996 . . . . 0.0 108.832 178.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.436 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 91.6 m -60.97 -42.17 97.78 Favored 'General case' 0 N--CA 1.504 2.239 0 C-N-CA 119.253 -0.979 . . . . 0.0 110.171 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.4 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -83.1 -33.11 26.42 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.962 -1.086 . . . . 0.0 112.474 -178.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -86.33 -32.86 20.78 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 120.554 -1.341 . . . . 0.0 111.896 -179.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -97.54 -21.1 17.29 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 120.878 -1.138 . . . . 0.0 112.527 -178.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -118.3 -59.65 1.87 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 120.56 -1.337 . . . . 0.0 110.808 179.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.3 ttt85 -62.16 -29.7 70.54 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.129 -0.982 . . . . 0.0 110.865 -179.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.2 mtpt 56.27 42.32 28.06 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.938 -1.102 . . . . 0.0 110.171 -179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.51 35.6 3.95 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.444 -0.785 . . . . 0.0 110.0 179.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.461 HD11 HG22 ' A' ' 73' ' ' ILE . 14.1 tt -153.87 162.27 2.14 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.202 -0.936 . . . . 0.0 109.974 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 50.4 m -110.0 148.29 31.94 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.181 -0.95 . . . . 0.0 110.136 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.2 tttm -46.77 -31.72 3.18 Favored 'General case' 0 N--CA 1.515 2.781 0 O-C-N 121.302 -0.874 . . . . 0.0 111.55 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -62.88 -52.01 64.74 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 120.836 -1.165 . . . . 0.0 109.261 179.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 22.4 tp -64.76 -45.68 85.36 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 119.232 -0.987 . . . . 0.0 108.469 178.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.45 ' CD1' ' CG2' ' A' ' 63' ' ' ILE . 11.8 t80 -59.3 -40.84 87.47 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.337 -0.852 . . . . 0.0 109.424 179.177 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -71.65 -43.14 66.61 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.178 -0.951 . . . . 0.0 108.506 178.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.444 ' CH2' ' HB3' ' A' ' 12' ' ' ALA . 88.7 t90 -57.0 -34.68 68.38 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.229 -0.92 . . . . 0.0 109.353 178.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.442 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 11.3 mt -67.11 -59.89 3.08 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.115 -0.991 . . . . 0.0 108.889 179.012 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.419 HD11 ' CE1' ' A' ' 78' ' ' TYR . 5.4 mt -57.97 -26.51 28.86 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.555 0 O-C-N 120.941 -1.1 . . . . 0.0 110.035 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.9 tttp -80.03 -19.07 48.53 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 120.869 -1.144 . . . . 0.0 110.853 178.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.422 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 8.3 mm-40 -108.47 23.11 14.99 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 120.752 -1.217 . . . . 0.0 111.984 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.415 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 1.5 tmtt? 76.83 69.82 0.06 Allowed 'General case' 0 N--CA 1.515 2.794 0 O-C-N 121.148 -0.97 . . . . 0.0 111.882 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.442 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 21.8 m-85 -130.95 -62.34 0.9 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.488 -0.758 . . . . 0.0 109.215 179.354 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -127.75 166.99 17.11 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.458 -0.776 . . . . 0.0 109.812 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.439 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 19.1 t0 -115.41 109.45 17.89 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.231 -0.918 . . . . 0.0 110.156 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.44 -38.09 73.87 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.216 -0.927 . . . . 0.0 110.171 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.2 tp -59.52 -38.77 81.85 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.178 -0.951 . . . . 0.0 110.179 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.42 HD21 ' CD2' ' A' ' 57' ' ' HIS . 55.6 tp -68.32 -50.02 56.3 Favored 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 119.17 -1.012 . . . . 0.0 109.164 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.45 HD13 HG23 ' A' ' 92' ' ' ILE . 68.9 mt -60.94 -37.57 77.32 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 C-N-CA 119.117 -1.033 . . . . 0.0 108.817 178.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.81 -38.67 86.92 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.082 -1.011 . . . . 0.0 109.086 178.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 9.7 mmtm -58.3 -44.85 88.74 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.105 -0.997 . . . . 0.0 109.565 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 3.2 m0 -60.68 -35.86 77.31 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.317 -0.865 . . . . 0.0 110.053 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.83 -32.79 40.64 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.105 -0.997 . . . . 0.0 110.491 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 10.3 mmtp -51.66 177.93 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.728 0 O-C-N 120.952 -1.092 . . . . 0.0 110.841 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 3.5 m -105.4 141.77 36.33 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.22 -0.925 . . . . 0.0 109.39 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 103.68 -29.15 12.78 Favored Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.896 -1.282 . . . . 0.0 109.896 -179.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -92.98 57.76 2.84 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 120.906 -1.349 . . . . 0.0 109.986 179.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . 0.408 ' HB2' ' OG ' ' A' ' 155' ' ' SER . 5.4 mt-10 -63.02 -37.73 88.34 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 120.972 -1.08 . . . . 0.0 110.287 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -131.91 83.25 2.07 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.071 -1.018 . . . . 0.0 110.636 -179.781 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.2 pp -114.49 147.51 39.23 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.243 -0.911 . . . . 0.0 109.951 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.428 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.4 p -109.22 -27.63 9.45 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.215 -0.928 . . . . 0.0 113.003 -179.383 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.571 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 11.5 m -143.73 -167.72 2.66 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.202 -1.562 . . . . 0.0 109.789 179.107 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 13.2 mt -95.97 -38.54 10.19 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.149 -0.97 . . . . 0.0 110.098 178.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 22.6 ttt180 -103.37 31.73 4.18 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 120.972 -1.08 . . . . 0.0 109.876 178.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.571 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.7 t -128.38 19.44 6.32 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.266 -0.897 . . . . 0.0 108.733 -179.632 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.4 pt -158.34 39.01 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.345 0 O-C-N 120.974 -1.079 . . . . 0.0 110.064 -178.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.411 ' O ' ' OG1' ' A' ' 119' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.506 2.335 0 O-C-N 120.95 -1.094 . . . . 0.0 111.004 -178.633 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.411 ' OG1' ' O ' ' A' ' 110' ' ' GLN . 0.9 OUTLIER . . . . . 0 N--CA 1.497 1.877 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 49.9 t -82.19 153.9 25.73 Favored 'General case' 0 N--CA 1.499 2.005 0 C-N-CA 119.213 -0.995 . . . . 0.0 108.705 178.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.456 ' CG2' ' CE1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -75.52 -30.62 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.52 0 O-C-N 121.053 -1.03 . . . . 0.0 111.759 -178.702 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.506 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 14.2 p -58.94 -35.41 73.07 Favored 'General case' 0 N--CA 1.511 2.61 0 O-C-N 120.692 -1.255 . . . . 0.0 110.869 -179.037 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.12 -30.41 64.37 Favored 'General case' 0 N--CA 1.51 2.557 0 O-C-N 120.917 -1.114 . . . . 0.0 110.261 179.034 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.4 t -83.06 124.35 76.59 Favored Pre-proline 0 N--CA 1.505 2.298 0 O-C-N 121.061 -1.024 . . . . 0.0 110.147 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . 0.404 ' HB3' ' CB ' ' A' ' 154' ' ' ALA . 38.4 Cg_endo -66.17 174.8 5.51 Favored 'Trans proline' 0 N--CA 1.49 1.27 0 O-C-N 123.138 1.072 . . . . 0.0 110.774 179.462 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 31.1 mmm-85 -75.08 -37.0 61.7 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.216 -0.927 . . . . 0.0 110.57 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.36 -40.65 78.56 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 120.996 -1.065 . . . . 0.0 110.044 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 38.6 tp60 -69.35 -41.98 75.87 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.338 -0.945 . . . . 0.0 109.128 179.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 8.0 mt -65.23 -39.47 92.77 Favored 'General case' 0 N--CA 1.505 2.304 0 C-N-CA 119.461 -0.895 . . . . 0.0 109.407 179.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -59.84 -39.0 83.67 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.17 -0.956 . . . . 0.0 109.994 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -59.78 -40.07 87.01 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.127 -0.983 . . . . 0.0 110.054 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -61.62 -44.29 97.27 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.189 -0.944 . . . . 0.0 109.819 179.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.94 -41.41 96.21 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.209 -0.932 . . . . 0.0 109.953 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 18.3 ttt-85 -63.44 -33.13 74.88 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.111 -0.993 . . . . 0.0 110.492 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 24.5 mtmt -79.95 -30.85 39.95 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.014 -1.054 . . . . 0.0 111.197 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.37 23.51 8.35 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 120.836 -1.165 . . . . 0.0 111.739 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.89 46.6 49.17 Favored Glycine 0 N--CA 1.5 2.923 0 O-C-N 120.645 -1.284 . . . . 0.0 110.882 179.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.3 t -147.8 -164.01 1.91 Allowed 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.136 -1.214 . . . . 0.0 110.383 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -136.25 151.42 49.64 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.135 -0.978 . . . . 0.0 110.224 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.8 p -132.12 161.07 41.99 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.123 -0.985 . . . . 0.0 110.222 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 34.7 t -168.33 92.99 0.34 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.249 -0.907 . . . . 0.0 111.001 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.506 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 78.3 t80 -100.53 159.97 14.73 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.161 -0.962 . . . . 0.0 110.57 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -138.27 -60.92 0.61 Allowed 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -142.46 149.57 39.4 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.48 -0.762 . . . . 0.0 109.079 178.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . 0.403 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.6 p -90.32 153.82 20.16 Favored 'General case' 0 N--CA 1.506 2.368 0 C-N-CA 119.102 -1.039 . . . . 0.0 111.195 -179.439 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 27.0 m -72.11 -24.96 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.439 0 O-C-N 121.445 -0.785 . . . . 0.0 111.396 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -50.06 -61.31 2.23 Favored 'General case' 0 N--CA 1.515 2.802 0 O-C-N 120.837 -1.164 . . . . 0.0 110.036 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.429 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.3 p -125.93 -166.13 1.52 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.273 -0.892 . . . . 0.0 110.459 179.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -99.43 64.52 0.67 Allowed Glycine 0 N--CA 1.492 2.376 0 N-CA-C 107.987 -2.045 . . . . 0.0 107.987 178.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 29.9 t -104.73 137.32 42.71 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.359 -1.083 . . . . 0.0 110.007 -179.074 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 18.7 ttt85 -95.3 53.79 1.55 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.306 -0.871 . . . . 0.0 109.419 178.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 68.95 98.09 0.04 OUTLIER Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.986 -1.245 . . . . 0.0 109.986 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 29.8 p -105.56 119.01 38.04 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.279 -1.13 . . . . 0.0 110.248 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . 0.404 ' CB ' ' HB3' ' A' ' 125' ' ' PRO . . . -145.86 154.64 42.2 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.141 -0.975 . . . . 0.0 110.063 -179.215 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 155' ' ' SER . . . . . 0.408 ' OG ' ' HB2' ' A' ' 101' ' ' GLU . 0.7 OUTLIER . . . . . 0 N--CA 1.505 2.304 0 O-C-N 121.29 -0.881 . . . . 0.0 110.693 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.422 ' HB3' ' CE3' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.504 2.236 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -71.13 160.69 48.35 Favored 'Trans proline' 0 C--N 1.317 -1.097 0 O-C-N 123.358 1.188 . . . . 0.0 110.852 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -49.05 -31.72 8.25 Favored 'General case' 0 N--CA 1.515 2.791 0 O-C-N 121.411 -0.805 . . . . 0.0 111.361 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.8 -33.93 43.76 Favored Glycine 0 N--CA 1.498 2.826 0 O-C-N 120.957 -1.089 . . . . 0.0 110.503 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -55.66 -33.28 63.96 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.029 -1.277 . . . . 0.0 110.673 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -53.62 -38.29 63.89 Favored 'General case' 0 N--CA 1.513 2.687 0 O-C-N 121.047 -1.033 . . . . 0.0 110.2 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.7 mtmt -60.29 -37.42 80.47 Favored 'General case' 0 N--CA 1.509 2.482 0 C-N-CA 119.559 -0.856 . . . . 0.0 109.999 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.45 ' CG2' ' OH ' ' A' ' 62' ' ' TYR . 1.3 pt -115.41 33.64 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.193 -0.942 . . . . 0.0 110.61 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 2.5 tttt -84.64 -43.08 0.71 Allowed Pre-proline 0 N--CA 1.51 2.557 0 O-C-N 120.936 -1.102 . . . . 0.0 113.393 -179.03 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.6 Cg_endo -75.57 -35.09 2.94 Favored 'Trans proline' 0 N--CA 1.487 1.094 0 O-C-N 122.604 0.792 . . . . 0.0 111.797 -178.093 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 82.9 m -60.43 -43.76 96.46 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 120.955 -1.091 . . . . 0.0 110.019 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.2 mt -65.33 -39.49 92.49 Favored 'General case' 0 N--CA 1.507 2.377 0 C-N-CA 119.337 -0.945 . . . . 0.0 109.466 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.1 m -57.62 -35.54 70.6 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.085 -1.009 . . . . 0.0 110.185 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -56.81 -36.14 69.57 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.067 -1.021 . . . . 0.0 110.438 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.424 ' CE2' ' HD3' ' A' ' 59' ' ' ARG . 14.7 m-85 -58.46 -38.98 78.67 Favored 'General case' 0 N--CA 1.51 2.526 0 O-C-N 121.114 -0.991 . . . . 0.0 110.51 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -60.47 -38.48 84.35 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.185 -0.947 . . . . 0.0 110.711 -179.253 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.2 mp -66.9 -40.97 86.94 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.397 0 C-N-CA 119.238 -0.985 . . . . 0.0 109.089 179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 29.2 tp60 -67.76 -47.17 69.99 Favored 'General case' 0 N--CA 1.506 2.354 0 C-N-CA 119.178 -1.009 . . . . 0.0 108.785 179.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.58 -36.23 83.13 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 121.225 -0.922 . . . . 0.0 109.001 178.474 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.2 mtt85 -57.88 -41.41 82.46 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.026 -1.046 . . . . 0.0 109.874 179.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.86 -46.3 88.54 Favored 'General case' 0 N--CA 1.506 2.334 0 C-N-CA 119.27 -0.972 . . . . 0.0 109.602 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.42 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -66.91 -41.66 86.72 Favored 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 119.262 -0.975 . . . . 0.0 109.202 179.194 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -60.29 -34.24 73.49 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.566 -0.854 . . . . 0.0 110.191 179.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -92.72 -32.79 14.58 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.05 -1.031 . . . . 0.0 110.824 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 . . . . . 0 N--CA 1.512 2.638 0 O-C-N 120.933 -1.105 . . . . 0.0 110.357 -179.968 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.415 ' OG ' ' N ' ' A' ' 46' ' ' ASN . 24.0 p . . . . . 0 N--CA 1.496 1.832 0 CA-C-O 120.657 0.265 . . . . 0.0 110.368 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.415 ' N ' ' OG ' ' A' ' 45' ' ' SER . 1.3 m-80 -57.0 -38.79 73.58 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.281 -0.887 . . . . 0.0 109.966 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -64.58 -40.09 94.91 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.213 -0.93 . . . . 0.0 109.687 179.548 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.8 tp60 -62.33 -41.05 98.24 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.207 -0.933 . . . . 0.0 109.765 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -60.5 -39.87 89.31 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.212 -0.93 . . . . 0.0 109.993 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.434 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 52.9 m0 -60.83 -37.63 82.68 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.132 -0.98 . . . . 0.0 110.041 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -61.15 -31.07 70.8 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.038 -1.039 . . . . 0.0 109.916 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.42 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 70.6 mt -71.57 -58.41 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.244 0 O-C-N 120.864 -1.148 . . . . 0.0 109.286 179.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.2 ptm -60.62 -28.28 68.41 Favored 'General case' 0 N--CA 1.509 2.52 0 C-N-CA 118.503 -1.279 . . . . 0.0 109.847 178.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -68.45 -37.26 80.05 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.756 -1.215 . . . . 0.0 109.24 178.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.404 HD21 ' CE2' ' A' ' 26' ' ' PHE . 11.3 mt -52.78 -32.5 44.02 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 120.967 -1.083 . . . . 0.0 110.175 179.044 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.451 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 10.4 t60 -54.61 -37.82 66.04 Favored 'General case' 0 N--CA 1.511 2.579 0 O-C-N 121.049 -1.032 . . . . 0.0 110.178 179.562 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.437 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 5.2 m170 -62.06 -51.84 66.33 Favored 'General case' 0 N--CA 1.508 2.443 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.472 179.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 19.6 tp60 -57.74 -34.67 69.76 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.273 -0.892 . . . . 0.0 109.831 179.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.424 ' HD3' ' CE2' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -68.81 -49.94 54.36 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.005 -1.06 . . . . 0.0 109.142 178.938 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 65.5 p -61.78 -37.45 84.38 Favored 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.162 -0.961 . . . . 0.0 109.432 179.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.41 ' O ' ' OG1' ' A' ' 65' ' ' THR . 0.1 OUTLIER -63.84 -39.0 93.17 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.068 -1.02 . . . . 0.0 109.546 179.34 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.45 ' OH ' ' CG2' ' A' ' 19' ' ' ILE . 36.8 t80 -61.7 -49.82 74.92 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.182 -0.949 . . . . 0.0 109.379 179.578 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 85.1 mt -73.61 -41.47 55.47 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 C-N-CA 119.398 -0.921 . . . . 0.0 109.137 179.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.431 ' CE1' HG21 ' A' ' 92' ' ' ILE . 45.9 t80 -60.81 -33.07 72.44 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.289 -0.882 . . . . 0.0 110.135 179.125 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.41 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 40.7 m -79.25 -35.82 40.9 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.886 -1.133 . . . . 0.0 110.748 -179.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.409 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -82.93 -33.69 26.74 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.836 -1.165 . . . . 0.0 112.412 -179.035 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.431 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 64.2 t80 -86.6 -34.94 19.71 Favored 'General case' 0 N--CA 1.511 2.617 0 O-C-N 120.674 -1.266 . . . . 0.0 112.047 -179.35 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -98.55 -20.73 16.88 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.778 -1.201 . . . . 0.0 112.862 -178.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.418 ' HE2' ' CD2' ' A' ' 64' ' ' TYR . 0.6 OUTLIER -118.75 -56.65 2.1 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.552 -1.343 . . . . 0.0 111.198 -179.523 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.9 ttt85 -66.2 -30.84 71.38 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 121.085 -1.01 . . . . 0.0 110.706 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.2 ttpt 58.64 44.0 18.13 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.785 -1.197 . . . . 0.0 110.133 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.65 38.12 3.56 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.367 -0.833 . . . . 0.0 109.701 179.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.439 HG22 HD12 ' A' ' 73' ' ' ILE . 14.2 tt -155.32 162.97 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.92 0 O-C-N 121.25 -0.906 . . . . 0.0 110.206 -179.604 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.8 m -108.11 146.05 33.2 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.118 -0.989 . . . . 0.0 109.978 179.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -45.99 -32.9 3.02 Favored 'General case' 0 N--CA 1.516 2.835 0 O-C-N 121.269 -0.894 . . . . 0.0 111.598 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -61.42 -49.63 76.08 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 120.947 -1.095 . . . . 0.0 109.324 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 34.5 tp -67.31 -43.01 82.73 Favored 'General case' 0 N--CA 1.504 2.26 0 C-N-CA 119.25 -0.98 . . . . 0.0 108.593 178.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.431 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 17.6 t80 -61.3 -38.69 87.72 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 121.352 -0.842 . . . . 0.0 109.35 178.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -74.73 -41.2 60.57 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.171 -0.956 . . . . 0.0 108.954 178.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.422 ' CE3' ' HB3' ' A' ' 12' ' ' ALA . 81.6 t90 -59.73 -38.33 81.38 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.175 -0.953 . . . . 0.0 109.291 178.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.447 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 16.6 mt -66.01 -55.69 15.4 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.179 -0.951 . . . . 0.0 109.278 179.144 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -56.48 -27.43 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 O-C-N 121.104 -0.997 . . . . 0.0 110.831 -179.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 10.2 tppt? -89.26 -15.37 33.71 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 120.918 -1.114 . . . . 0.0 111.868 179.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.422 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 75.0 mm-40 -107.48 25.04 11.95 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.564 -1.335 . . . . 0.0 111.927 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.408 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 7.0 ttmt 76.69 67.89 0.06 Allowed 'General case' 0 N--CA 1.514 2.741 0 O-C-N 121.252 -0.905 . . . . 0.0 112.022 179.278 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.447 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 27.2 m-85 -131.28 -62.58 0.88 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.406 -0.809 . . . . 0.0 108.977 178.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -132.89 168.53 18.26 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.388 -0.82 . . . . 0.0 109.391 179.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.451 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.7 t70 -121.29 111.88 17.91 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.132 -0.98 . . . . 0.0 110.546 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 7.8 mttt -58.61 -35.26 72.16 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.229 -0.919 . . . . 0.0 110.259 179.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.3 tp -57.61 -40.55 79.36 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 120.992 -1.067 . . . . 0.0 110.069 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 63.1 tp -71.03 -49.85 40.43 Favored 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 119.195 -1.002 . . . . 0.0 108.723 179.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.431 HG21 ' CE1' ' A' ' 64' ' ' TYR . 63.8 mt -60.76 -30.3 46.84 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.289 0 C-N-CA 119.32 -0.952 . . . . 0.0 109.377 178.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.9 -45.39 78.13 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 120.964 -1.085 . . . . 0.0 109.423 178.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.413 ' CD ' ' CD2' ' A' ' 106' ' ' LEU . 11.9 mttp -59.47 -44.27 93.05 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.003 -1.061 . . . . 0.0 109.859 179.282 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 3.3 m0 -57.49 -33.52 68.11 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.077 -1.014 . . . . 0.0 110.367 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.29 -35.58 35.6 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.129 -0.982 . . . . 0.0 110.282 179.418 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.8 mmtm -53.57 -178.62 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.641 0 O-C-N 120.953 -1.092 . . . . 0.0 110.62 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.87 140.18 39.3 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.257 -0.902 . . . . 0.0 109.472 179.143 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 102.52 -27.55 19.81 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 -178.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -92.62 59.05 3.24 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 120.859 -1.377 . . . . 0.0 109.734 179.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -81.37 -35.98 30.16 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.064 -1.022 . . . . 0.0 110.456 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.17 66.71 0.83 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.049 -1.032 . . . . 0.0 110.694 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -109.59 149.46 29.64 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 120.967 -1.083 . . . . 0.0 109.82 179.43 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.437 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 27.0 p -111.62 -27.88 8.37 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.193 -0.942 . . . . 0.0 113.264 -179.186 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.597 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 12.4 m -144.86 -168.77 3.01 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 120.168 -1.582 . . . . 0.0 109.865 179.207 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.413 ' CD2' ' CD ' ' A' ' 94' ' ' LYS . 17.3 mt -97.01 -37.34 10.2 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.165 -0.959 . . . . 0.0 110.234 179.002 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 7.9 ttp180 -104.07 33.32 3.51 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.93 -1.106 . . . . 0.0 109.675 178.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.597 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.304 1.7 t -128.37 20.84 6.19 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 108.388 -0.968 . . . . 0.0 108.388 -179.629 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.6 pt -157.29 38.34 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.298 0 O-C-N 121.017 -1.052 . . . . 0.0 110.211 -178.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.431 ' O ' ' OG1' ' A' ' 119' ' ' THR . 83.4 mt-30 . . . . . 0 N--CA 1.509 2.512 0 O-C-N 120.953 -1.092 . . . . 0.0 110.675 -178.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.431 ' OG1' ' O ' ' A' ' 110' ' ' GLN . 1.7 m . . . . . 0 N--CA 1.503 2.193 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 39.6 t -92.62 154.2 18.54 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 119.386 -0.926 . . . . 0.0 108.962 178.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.455 ' CD1' ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -77.29 -30.15 17.28 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.443 0 O-C-N 121.025 -1.047 . . . . 0.0 111.775 -178.711 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.493 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.7 p -59.02 -35.55 73.47 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 120.676 -1.265 . . . . 0.0 110.75 -179.156 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.08 -32.57 64.25 Favored 'General case' 0 N--CA 1.512 2.629 0 O-C-N 120.94 -1.1 . . . . 0.0 110.001 178.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 62.5 t -81.3 124.76 80.36 Favored Pre-proline 0 N--CA 1.503 2.212 0 O-C-N 121.051 -1.031 . . . . 0.0 109.681 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.97 178.81 2.15 Favored 'Trans proline' 0 N--CA 1.488 1.174 0 O-C-N 123.114 1.06 . . . . 0.0 110.762 179.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -75.12 -38.44 61.07 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.308 -0.87 . . . . 0.0 110.355 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.2 -40.88 82.73 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.089 -1.007 . . . . 0.0 110.029 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -67.41 -42.2 83.64 Favored 'General case' 0 N--CA 1.506 2.368 0 C-N-CA 119.432 -0.907 . . . . 0.0 109.217 179.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 9.5 mt -63.59 -39.78 95.26 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.155 -0.966 . . . . 0.0 109.547 179.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -58.82 -37.79 77.21 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.096 -1.002 . . . . 0.0 110.059 179.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -57.42 -37.18 72.35 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.098 -1.001 . . . . 0.0 110.381 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 62.7 mt-10 -61.43 -47.59 85.05 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.144 -0.972 . . . . 0.0 109.695 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -59.81 -37.97 80.67 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.171 -0.956 . . . . 0.0 109.877 179.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 23.6 ttm-85 -61.69 -38.72 88.89 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.155 -0.966 . . . . 0.0 110.318 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 49.5 mttm -87.08 -39.66 15.38 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.105 -0.997 . . . . 0.0 110.212 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 67.7 mttt -69.13 -26.0 64.67 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.21 -0.931 . . . . 0.0 111.17 179.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 90.0 33.54 8.88 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.7 t -144.31 -161.41 1.28 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.049 -1.266 . . . . 0.0 109.946 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -125.74 150.86 47.37 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.089 -1.007 . . . . 0.0 109.979 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 8.0 p -132.14 160.72 42.29 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.17 -0.956 . . . . 0.0 110.434 -179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 46.9 t -170.26 98.04 0.27 Allowed 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.237 -0.915 . . . . 0.0 110.892 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.493 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 81.6 t80 -103.93 159.97 15.2 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.124 -0.985 . . . . 0.0 110.85 -179.608 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -138.75 -61.06 0.58 Allowed 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -141.69 148.51 39.21 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.536 -0.728 . . . . 0.0 109.155 178.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . 0.416 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 29.8 p -89.81 154.13 20.14 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.073 -1.051 . . . . 0.0 111.069 -179.467 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.2 p -72.34 -25.77 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.386 0 O-C-N 121.385 -0.822 . . . . 0.0 111.463 -179.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -49.78 -59.34 3.92 Favored 'General case' 0 N--CA 1.516 2.844 0 O-C-N 120.853 -1.154 . . . . 0.0 110.208 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.434 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.6 p -126.96 -165.23 1.44 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.278 -0.889 . . . . 0.0 110.333 179.289 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . 0.419 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -101.55 63.18 0.52 Allowed Glycine 0 N--CA 1.492 2.387 0 N-CA-C 107.879 -2.088 . . . . 0.0 107.879 178.377 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 20.6 t -101.49 141.26 34.62 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.347 -1.09 . . . . 0.0 109.819 -179.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 23.9 mtt85 -97.55 50.19 1.05 Allowed 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.246 -0.909 . . . . 0.0 109.546 179.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 71.42 98.37 0.06 OUTLIER Glycine 0 N--CA 1.486 2.017 0 N-CA-C 109.975 -1.25 . . . . 0.0 109.975 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.4 p -109.43 126.04 53.05 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.244 -1.15 . . . . 0.0 110.173 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -150.17 151.75 33.58 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.077 -1.015 . . . . 0.0 110.434 -179.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.5 2.058 0 O-C-N 121.217 -0.927 . . . . 0.0 110.583 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.438 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.504 2.24 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.45 165.05 33.82 Favored 'Trans proline' 0 C--N 1.317 -1.115 0 O-C-N 123.296 1.156 . . . . 0.0 110.514 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -48.18 -32.25 6.8 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 121.5 -0.75 . . . . 0.0 111.368 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.99 -33.99 51.47 Favored Glycine 0 N--CA 1.499 2.833 0 O-C-N 120.984 -1.072 . . . . 0.0 110.514 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.413 ' CE2' ' HG3' ' A' ' 20' ' ' LYS . 28.5 t80 -54.98 -31.63 60.94 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.039 -1.271 . . . . 0.0 110.689 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -53.27 -37.03 61.79 Favored 'General case' 0 N--CA 1.512 2.662 0 O-C-N 120.982 -1.074 . . . . 0.0 110.236 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp -59.0 -37.7 77.46 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.24 -0.913 . . . . 0.0 110.116 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.428 HG21 ' OH ' ' A' ' 62' ' ' TYR . 1.9 pt -119.51 35.07 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.223 -0.923 . . . . 0.0 110.537 179.77 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.42 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 3.0 tttt -84.9 -43.3 0.68 Allowed Pre-proline 0 N--CA 1.509 2.481 0 O-C-N 120.992 -1.067 . . . . 0.0 113.42 -178.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.42 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.7 Cg_endo -75.74 -35.45 2.64 Favored 'Trans proline' 0 N--CA 1.486 1.085 0 O-C-N 122.559 0.768 . . . . 0.0 111.867 -177.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.418 HG22 ' CE2' ' A' ' 62' ' ' TYR . 59.8 m -61.5 -45.62 93.45 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.985 -1.072 . . . . 0.0 110.061 -179.585 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.0 mt -63.53 -40.36 96.83 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.509 -0.877 . . . . 0.0 109.694 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.09 -35.34 73.23 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.157 -0.964 . . . . 0.0 110.087 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -57.92 -36.05 71.93 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.009 -1.057 . . . . 0.0 110.272 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.452 ' CE2' HD23 ' A' ' 55' ' ' LEU . 10.4 m-85 -55.46 -40.95 72.25 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 120.879 -1.138 . . . . 0.0 109.978 179.598 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -58.58 -25.1 62.2 Favored 'General case' 0 N--CA 1.505 2.323 0 C-N-CA 119.484 -0.887 . . . . 0.0 110.711 179.284 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 11.3 mm -70.53 -49.01 55.76 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.31 0 O-C-N 120.894 -1.129 . . . . 0.0 109.136 179.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.77 -43.35 72.39 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.154 -0.967 . . . . 0.0 108.867 179.155 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.43 -34.68 78.75 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.249 -0.98 . . . . 0.0 109.215 178.544 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.58 -40.86 84.37 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.014 -1.054 . . . . 0.0 109.957 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -62.43 -48.19 80.77 Favored 'General case' 0 N--CA 1.508 2.45 0 C-N-CA 119.28 -0.968 . . . . 0.0 109.541 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.414 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -67.68 -41.05 84.28 Favored 'General case' 0 N--CA 1.505 2.292 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.245 179.124 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -66.28 -34.21 77.49 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.309 -0.869 . . . . 0.0 110.159 179.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt -85.87 -34.32 21.04 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.033 -1.042 . . . . 0.0 110.631 179.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 36.1 t70 . . . . . 0 N--CA 1.511 2.619 0 O-C-N 121.002 -1.062 . . . . 0.0 110.209 179.907 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 27.9 t . . . . . 0 N--CA 1.494 1.758 0 CA-C-O 120.685 0.279 . . . . 0.0 110.363 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -56.96 -39.45 74.62 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 121.169 -0.957 . . . . 0.0 109.911 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -63.07 -39.35 94.45 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.153 -0.967 . . . . 0.0 109.763 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 46.4 tp60 -62.15 -41.02 97.88 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.167 -0.958 . . . . 0.0 109.855 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -60.05 -39.99 87.87 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.225 -0.922 . . . . 0.0 110.169 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.432 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.3 m0 -59.13 -36.38 75.11 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.214 -0.929 . . . . 0.0 110.276 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -60.99 -29.86 69.93 Favored 'General case' 0 N--CA 1.507 2.378 0 C-N-CA 119.164 -1.014 . . . . 0.0 110.173 179.136 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.414 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 71.7 mt -72.58 -58.16 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.269 0 O-C-N 120.936 -1.103 . . . . 0.0 109.196 179.461 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.4 ptm -60.53 -29.96 69.45 Favored 'General case' 0 N--CA 1.51 2.548 0 C-N-CA 118.609 -1.237 . . . . 0.0 109.861 178.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.9 mt-30 -69.81 -37.66 76.35 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.894 -1.129 . . . . 0.0 109.075 178.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.452 HD23 ' CE2' ' A' ' 26' ' ' PHE . 12.5 mt -54.26 -32.65 56.69 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.003 -1.06 . . . . 0.0 110.211 178.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.439 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 6.2 t60 -55.0 -37.13 66.2 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.008 -1.057 . . . . 0.0 110.111 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.436 ' NE2' HD22 ' A' ' 91' ' ' LEU . 5.1 m170 -59.61 -48.3 82.19 Favored 'General case' 0 N--CA 1.509 2.508 0 C-N-CA 119.313 -0.955 . . . . 0.0 109.538 179.05 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -60.58 -36.15 77.81 Favored 'General case' 0 N--CA 1.506 2.327 0 C-N-CA 119.396 -0.921 . . . . 0.0 109.505 179.036 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.437 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -67.59 -49.58 62.46 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.182 -0.949 . . . . 0.0 109.304 179.073 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.6 p -61.26 -38.11 85.54 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.146 -0.971 . . . . 0.0 109.586 179.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.0 ttt85 -65.7 -39.0 90.77 Favored 'General case' 0 N--CA 1.507 2.392 0 C-N-CA 119.164 -1.014 . . . . 0.0 109.406 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.428 ' OH ' HG21 ' A' ' 19' ' ' ILE . 40.5 t80 -59.88 -47.13 86.98 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.21 -0.931 . . . . 0.0 109.561 179.496 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.442 HG22 HD11 ' A' ' 63' ' ' ILE . 86.2 mt -78.01 -44.06 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 O-C-N 121.186 -0.946 . . . . 0.0 108.947 179.212 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.439 ' CE1' HG23 ' A' ' 92' ' ' ILE . 37.7 t80 -59.17 -25.62 64.08 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.326 -0.859 . . . . 0.0 110.289 178.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 71.2 m -87.47 -37.12 17.25 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.774 -1.204 . . . . 0.0 110.283 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.6 pp -83.14 -31.82 26.99 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.005 -1.059 . . . . 0.0 112.485 -179.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.43 ' CD1' ' HB2' ' A' ' 78' ' ' TYR . 73.5 t80 -86.27 -36.2 19.5 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 120.697 -1.252 . . . . 0.0 111.482 -179.192 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -94.36 -17.11 22.87 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 120.889 -1.132 . . . . 0.0 112.726 -178.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -125.0 -60.48 1.35 Allowed 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.53 -1.356 . . . . 0.0 111.264 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -59.82 -29.89 68.56 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 120.986 -1.071 . . . . 0.0 110.825 -179.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.2 tttt 58.55 43.86 18.64 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.885 -1.134 . . . . 0.0 110.058 -179.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -114.07 36.63 3.62 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.366 -0.834 . . . . 0.0 109.798 179.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.429 HD12 HG22 ' A' ' 73' ' ' ILE . 13.8 tt -159.43 162.36 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.202 -0.936 . . . . 0.0 110.119 -179.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.05 149.44 29.26 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.048 -1.032 . . . . 0.0 110.199 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.9 tttp -46.09 -32.7 3.03 Favored 'General case' 0 N--CA 1.515 2.804 0 O-C-N 121.375 -0.828 . . . . 0.0 111.588 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -62.46 -51.37 67.74 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 120.961 -1.087 . . . . 0.0 109.224 179.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 29.6 tp -65.92 -42.35 90.26 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.192 -1.003 . . . . 0.0 108.659 178.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.43 ' HB2' ' CD1' ' A' ' 67' ' ' TYR . 17.6 t80 -61.86 -40.13 94.29 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.302 -0.874 . . . . 0.0 109.244 179.022 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -70.84 -42.21 70.45 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.14 -0.975 . . . . 0.0 108.868 178.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.438 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 81.5 t90 -57.57 -36.84 72.21 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.248 -0.907 . . . . 0.0 109.65 179.049 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.462 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 15.8 mt -67.99 -51.37 47.99 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.059 -1.025 . . . . 0.0 109.082 179.176 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.8 mm -56.77 -29.27 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.53 0 O-C-N 121.208 -0.932 . . . . 0.0 110.209 179.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 25.2 tttt -89.1 -20.33 24.44 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 120.873 -1.142 . . . . 0.0 111.93 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.42 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 29.0 mm-40 -102.91 22.9 13.04 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 120.635 -1.291 . . . . 0.0 112.077 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? 73.81 77.65 0.13 Allowed 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.02 -1.05 . . . . 0.0 111.685 179.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.462 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 31.8 m-85 -135.9 -62.39 0.68 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.51 -0.743 . . . . 0.0 109.342 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -127.96 171.67 11.61 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.478 -0.763 . . . . 0.0 109.41 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.439 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 25.8 t0 -114.35 104.94 12.56 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.144 -0.973 . . . . 0.0 110.246 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 20.5 mttm -58.83 -39.91 82.6 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.219 -0.926 . . . . 0.0 109.934 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 27.5 tp -61.52 -38.59 87.95 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.135 -0.978 . . . . 0.0 109.924 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.436 HD22 ' NE2' ' A' ' 57' ' ' HIS . 57.0 tp -71.47 -47.25 56.86 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.056 -1.028 . . . . 0.0 108.702 179.241 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.439 HG23 ' CE1' ' A' ' 64' ' ' TYR . 23.1 mt -58.02 -36.44 56.49 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 O-C-N 121.16 -0.962 . . . . 0.0 108.627 178.305 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.99 -38.91 86.88 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 121.154 -0.966 . . . . 0.0 109.137 178.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.415 ' HD2' ' CZ ' ' A' ' 100' ' ' TYR . 4.9 mmtt -57.64 -42.91 84.41 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.152 -0.967 . . . . 0.0 109.474 179.288 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.5 m0 -64.79 -37.46 87.7 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.56 -0.856 . . . . 0.0 110.055 179.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.3 mtp85 -75.68 -32.81 60.29 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.194 -0.941 . . . . 0.0 110.543 179.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -54.06 -176.59 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.7 0 O-C-N 121.065 -1.022 . . . . 0.0 110.657 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -104.03 136.14 44.23 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.129 -0.982 . . . . 0.0 109.694 179.228 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 95.63 11.3 55.63 Favored Glycine 0 N--CA 1.494 2.553 0 C-N-CA 120.172 -1.013 . . . . 0.0 111.023 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.415 ' CZ ' ' HD2' ' A' ' 94' ' ' LYS . 48.2 m-85 -119.28 71.95 0.88 Allowed 'General case' 0 N--CA 1.493 1.715 0 CA-C-N 119.403 1.602 . . . . 0.0 109.777 179.703 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -96.73 -36.26 10.72 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.177 -0.952 . . . . 0.0 110.807 -179.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.33 66.98 0.99 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.015 -1.053 . . . . 0.0 110.822 -179.598 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.2 pp -114.5 153.04 30.72 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.035 -1.041 . . . . 0.0 109.78 179.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.433 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.7 p -114.36 -29.92 6.74 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.172 -0.955 . . . . 0.0 113.569 -178.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.565 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.8 m -142.92 -167.99 2.67 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 120.051 -1.656 . . . . 0.0 109.907 179.263 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 15.0 mt -95.69 -39.04 10.09 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.2 -0.937 . . . . 0.0 109.937 179.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 5.7 ttm-85 -102.83 30.74 4.55 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.026 -1.046 . . . . 0.0 109.933 178.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.565 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.299 1.8 t -128.14 17.98 6.59 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.12 -0.988 . . . . 0.0 108.947 -179.554 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.2 pt -158.28 37.83 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.275 0 O-C-N 120.864 -1.147 . . . . 0.0 110.571 -178.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 . . . . . 0 N--CA 1.51 2.559 0 O-C-N 120.854 -1.154 . . . . 0.0 110.509 -178.94 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 2.7 m . . . . . 0 N--CA 1.495 1.824 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 41.7 t -102.74 155.28 18.42 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.247 -0.908 . . . . 0.0 109.698 179.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.455 HG21 HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -72.96 -36.34 51.13 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.457 0 O-C-N 121.114 -0.991 . . . . 0.0 111.052 -179.36 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.501 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 11.9 p -53.65 -33.17 54.33 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 120.84 -1.163 . . . . 0.0 111.253 -178.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.32 -32.57 70.2 Favored 'General case' 0 N--CA 1.512 2.65 0 O-C-N 120.952 -1.092 . . . . 0.0 109.666 178.392 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 49.3 t -82.84 125.41 75.45 Favored Pre-proline 0 N--CA 1.505 2.297 0 O-C-N 121.06 -1.025 . . . . 0.0 109.85 179.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.64 175.29 4.49 Favored 'Trans proline' 0 N--CA 1.488 1.189 0 O-C-N 123.155 1.082 . . . . 0.0 110.797 179.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.11 -36.71 61.66 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.256 -0.902 . . . . 0.0 110.73 -179.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.65 -40.22 78.8 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 121.031 -1.043 . . . . 0.0 110.105 -179.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -69.84 -41.35 75.02 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 119.356 -0.938 . . . . 0.0 109.288 179.316 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.9 mt -65.04 -38.45 90.87 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.246 -0.909 . . . . 0.0 109.648 179.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -61.22 -40.46 94.08 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.088 -1.008 . . . . 0.0 109.842 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -59.8 -37.49 79.29 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.144 -0.973 . . . . 0.0 110.294 179.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -61.53 -43.44 98.86 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.169 -0.957 . . . . 0.0 110.071 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.29 -40.89 92.09 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.186 -0.946 . . . . 0.0 110.015 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.94 -33.82 69.22 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.183 -0.948 . . . . 0.0 110.401 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 25.1 mttt -76.88 -30.93 56.44 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.065 -1.022 . . . . 0.0 110.949 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 14.8 mtpp -98.42 22.33 9.9 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 120.916 -1.115 . . . . 0.0 111.688 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.67 39.38 46.13 Favored Glycine 0 N--CA 1.5 2.964 0 O-C-N 120.691 -1.255 . . . . 0.0 110.727 179.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 7.0 t -143.55 -166.64 2.38 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.089 -1.242 . . . . 0.0 110.338 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -132.94 155.05 49.81 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.245 -0.91 . . . . 0.0 110.248 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 8.2 p -130.63 161.36 40.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.152 -0.968 . . . . 0.0 109.961 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 42.2 t -166.41 85.52 0.3 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.138 -0.976 . . . . 0.0 111.285 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.501 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 55.1 t80 -97.43 159.94 14.62 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.207 -0.933 . . . . 0.0 110.136 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 9.8 m-70 -136.82 -61.47 0.67 Allowed 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 179.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -136.7 151.0 48.76 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.45 -0.781 . . . . 0.0 108.928 178.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 29.0 p -91.49 154.48 19.09 Favored 'General case' 0 N--CA 1.506 2.331 0 C-N-CA 119.121 -1.032 . . . . 0.0 111.093 -179.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.5 m -72.7 -25.1 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.462 0 C-N-CA 119.742 -0.783 . . . . 0.0 111.541 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -50.43 -60.81 2.63 Favored 'General case' 0 N--CA 1.516 2.856 0 O-C-N 120.906 -1.121 . . . . 0.0 110.022 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.432 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.9 p -126.43 -165.39 1.44 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.215 -0.928 . . . . 0.0 110.393 179.263 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . 0.421 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.39 63.52 0.61 Allowed Glycine 0 N--CA 1.492 2.42 0 N-CA-C 108.053 -2.019 . . . . 0.0 108.053 178.543 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 30.5 t -103.69 138.89 39.69 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.357 -1.084 . . . . 0.0 110.074 -179.191 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -95.03 54.38 1.68 Allowed 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.266 -0.896 . . . . 0.0 109.444 179.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.66 97.93 0.03 OUTLIER Glycine 0 N--CA 1.486 2.024 0 N-CA-C 109.819 -1.312 . . . . 0.0 109.819 -179.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.5 p -107.22 126.23 52.14 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.219 -1.165 . . . . 0.0 110.391 179.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -150.29 148.5 28.93 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.193 -0.942 . . . . 0.0 110.343 -179.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.502 2.174 0 O-C-N 121.248 -0.907 . . . . 0.0 110.772 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.426 ' HB3' ' CZ2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.507 2.405 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -71.82 162.1 43.01 Favored 'Trans proline' 0 C--N 1.318 -1.072 0 O-C-N 123.281 1.148 . . . . 0.0 110.896 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -48.82 -31.96 7.94 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 121.464 -0.773 . . . . 0.0 111.344 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.35 -33.91 40.28 Favored Glycine 0 N--CA 1.498 2.827 0 O-C-N 120.992 -1.067 . . . . 0.0 110.584 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -54.89 -32.6 61.08 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 120.972 -1.311 . . . . 0.0 110.634 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -54.44 -37.94 65.73 Favored 'General case' 0 N--CA 1.512 2.659 0 O-C-N 121.04 -1.037 . . . . 0.0 110.251 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.8 mttm -57.94 -37.14 73.58 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.27 -0.894 . . . . 0.0 110.115 179.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.6 pt -116.1 35.31 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.206 -0.934 . . . . 0.0 110.402 179.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.432 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -83.59 -43.09 0.81 Allowed Pre-proline 0 N--CA 1.51 2.529 0 O-C-N 121.082 -1.011 . . . . 0.0 113.17 -179.179 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.432 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.2 Cg_endo -76.12 -35.79 2.23 Favored 'Trans proline' 0 N--CA 1.487 1.123 0 O-C-N 122.632 0.806 . . . . 0.0 111.66 -178.392 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 88.6 m -60.5 -44.96 95.44 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 120.946 -1.096 . . . . 0.0 109.828 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.4 mt -65.01 -39.36 93.33 Favored 'General case' 0 N--CA 1.505 2.321 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.416 179.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 20.2 m -58.5 -35.41 72.19 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.076 -1.015 . . . . 0.0 110.051 179.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -56.37 -35.87 68.18 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 121.037 -1.039 . . . . 0.0 110.394 179.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.416 ' CD2' HD23 ' A' ' 55' ' ' LEU . 12.9 m-85 -56.82 -36.4 69.9 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.075 -1.016 . . . . 0.0 110.475 179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -57.79 -38.61 75.8 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.069 -1.02 . . . . 0.0 110.499 -179.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.1 mp -65.96 -41.01 88.98 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.412 0 C-N-CA 119.31 -0.956 . . . . 0.0 109.033 179.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 8.7 tp60 -68.97 -46.75 67.31 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.108 -0.995 . . . . 0.0 108.826 179.044 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.4 tp -61.89 -36.97 82.86 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.205 -0.935 . . . . 0.0 109.235 178.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.1 mtt85 -57.24 -36.46 70.96 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.138 -0.976 . . . . 0.0 110.298 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -62.93 -51.78 65.59 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.072 -1.017 . . . . 0.0 109.503 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.41 ' HB1' ' CG1' ' A' ' 52' ' ' ILE . . . -69.08 -42.27 76.43 Favored 'General case' 0 N--CA 1.504 2.274 0 C-N-CA 119.045 -1.062 . . . . 0.0 108.614 178.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -61.26 -33.19 73.13 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 119.455 -0.898 . . . . 0.0 110.297 179.369 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.8 mmtt -94.25 -29.23 15.19 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 120.897 -1.127 . . . . 0.0 111.289 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 . . . . . 0 N--CA 1.513 2.69 0 O-C-N 120.79 -1.194 . . . . 0.0 110.473 -179.869 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.8 m . . . . . 0 N--CA 1.494 1.755 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -56.81 -39.07 73.5 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 121.226 -0.921 . . . . 0.0 109.763 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -58.54 -35.16 71.88 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.243 -0.911 . . . . 0.0 110.137 179.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.406 ' HG2' ' CB ' ' A' ' 33' ' ' ALA . 0.3 OUTLIER -58.72 -46.31 87.63 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 120.974 -1.079 . . . . 0.0 109.585 179.72 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 92.1 mt -63.28 -37.78 88.58 Favored 'General case' 0 N--CA 1.508 2.463 0 C-N-CA 119.305 -0.958 . . . . 0.0 109.916 179.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.445 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 38.3 m0 -59.36 -33.99 71.84 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.153 -0.967 . . . . 0.0 109.405 179.413 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -68.03 -33.49 74.68 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 120.727 -1.233 . . . . 0.0 109.326 178.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.41 ' CG1' ' HB1' ' A' ' 33' ' ' ALA . 11.2 mt -70.82 -53.64 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.245 0 O-C-N 121.03 -1.044 . . . . 0.0 109.491 179.222 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.472 ' CE ' ' HB2' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -59.83 -33.1 71.32 Favored 'General case' 0 N--CA 1.51 2.538 0 C-N-CA 118.764 -1.174 . . . . 0.0 109.718 179.169 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.36 -39.59 91.18 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 120.91 -1.119 . . . . 0.0 109.44 179.129 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.416 HD23 ' CD2' ' A' ' 26' ' ' PHE . 18.0 mt -54.46 -34.31 61.27 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.158 -0.964 . . . . 0.0 110.097 179.235 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.439 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 4.8 t60 -58.55 -39.21 79.6 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 120.983 -1.073 . . . . 0.0 109.85 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.439 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 7.6 m170 -59.95 -48.39 81.91 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.086 -1.009 . . . . 0.0 109.064 179.24 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.88 -38.51 88.59 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.55 -0.86 . . . . 0.0 109.397 179.065 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.23 -44.71 96.83 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.246 -0.909 . . . . 0.0 109.502 179.478 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 52.7 p -66.34 -39.96 89.56 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.091 -1.006 . . . . 0.0 109.151 179.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.421 ' O ' ' OG1' ' A' ' 65' ' ' THR . 60.3 ttt-85 -63.04 -40.24 97.11 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.117 -0.989 . . . . 0.0 109.298 179.086 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -62.2 -50.58 71.23 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.151 -0.968 . . . . 0.0 109.383 179.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 82.3 mt -70.59 -37.56 70.19 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 C-N-CA 119.289 -0.964 . . . . 0.0 109.332 179.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -66.56 -41.65 88.28 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.146 -0.971 . . . . 0.0 108.996 178.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.421 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 86.3 m -60.84 -41.82 96.54 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.112 -0.992 . . . . 0.0 110.098 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.403 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -83.18 -35.65 25.32 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 120.958 -1.089 . . . . 0.0 112.716 -178.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.424 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 41.8 t80 -86.58 -33.56 20.17 Favored 'General case' 0 N--CA 1.514 2.751 0 O-C-N 120.614 -1.304 . . . . 0.0 112.044 -179.066 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -98.25 -3.35 37.56 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.854 -1.153 . . . . 0.0 113.308 -178.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -136.32 -57.52 0.75 Allowed 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.374 -1.454 . . . . 0.0 111.134 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.3 mtp85 -69.19 -28.58 66.51 Favored 'General case' 0 N--CA 1.51 2.557 0 O-C-N 120.949 -1.094 . . . . 0.0 110.731 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.0 tttp 60.22 44.78 12.27 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.781 -1.199 . . . . 0.0 109.985 -179.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.54 35.73 3.71 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.343 -0.848 . . . . 0.0 109.817 179.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.463 HD13 HG23 ' A' ' 73' ' ' ILE . 14.3 tt -155.99 162.69 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 O-C-N 121.151 -0.968 . . . . 0.0 110.052 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.7 p -109.5 147.08 33.53 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.085 -1.009 . . . . 0.0 110.095 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.3 tttt -45.87 -32.23 2.52 Favored 'General case' 0 N--CA 1.515 2.809 0 O-C-N 121.309 -0.869 . . . . 0.0 111.621 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -61.8 -50.54 71.93 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.955 -1.091 . . . . 0.0 109.274 179.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 38.5 tp -66.68 -44.44 81.78 Favored 'General case' 0 N--CA 1.505 2.295 0 C-N-CA 119.241 -0.984 . . . . 0.0 108.442 178.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.424 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 18.5 t80 -60.43 -38.74 85.06 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.327 -0.858 . . . . 0.0 109.564 179.208 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -73.39 -41.92 62.77 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.059 -1.026 . . . . 0.0 109.016 178.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.437 ' CE2' ' HG3' ' A' ' 84' ' ' GLU . 84.1 t90 -57.65 -37.3 73.13 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.219 -0.926 . . . . 0.0 109.756 179.143 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.475 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 60.9 mt -69.28 -47.86 63.35 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.209 -0.932 . . . . 0.0 108.949 179.217 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.449 HD11 HG23 ' A' ' 82' ' ' ILE . 33.1 mm -56.23 -31.72 32.96 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.64 0 O-C-N 121.264 -0.897 . . . . 0.0 109.975 179.383 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 8.3 ttmt -89.24 -16.55 30.99 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 120.868 -1.145 . . . . 0.0 112.136 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.437 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 15.5 mm-40 -104.53 22.73 14.46 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 120.583 -1.323 . . . . 0.0 112.158 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.6 tptt 75.75 71.44 0.08 Allowed 'General case' 0 N--CA 1.512 2.643 0 O-C-N 121.149 -0.969 . . . . 0.0 111.903 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.475 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 33.2 m-85 -134.1 -63.03 0.74 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.42 -0.8 . . . . 0.0 109.019 179.198 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -128.36 164.08 23.44 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.485 -0.759 . . . . 0.0 109.26 179.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.439 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 3.3 t0 -112.04 107.33 16.24 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.102 -0.999 . . . . 0.0 110.468 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.6 mttt -58.82 -39.59 81.64 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.13 -0.981 . . . . 0.0 109.914 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 16.2 tp -60.61 -39.3 87.65 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.233 -0.917 . . . . 0.0 110.05 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.416 ' HG ' ' CZ3' ' A' ' 95' ' ' TRP . 61.0 tp -70.11 -48.2 58.58 Favored 'General case' 0 N--CA 1.507 2.4 0 C-N-CA 119.203 -0.999 . . . . 0.0 108.669 179.229 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.434 HG23 HD11 ' A' ' 92' ' ' ILE . 62.9 mt -61.34 -38.22 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.434 0 C-N-CA 119.32 -0.952 . . . . 0.0 108.552 178.285 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.99 -39.06 83.31 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.146 -0.971 . . . . 0.0 109.087 178.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 5.8 mmtt -57.7 -41.85 82.5 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.043 -1.036 . . . . 0.0 109.43 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.416 ' CZ3' ' HG ' ' A' ' 91' ' ' LEU . 4.7 m0 -68.11 -40.21 82.62 Favored 'General case' 0 N--CA 1.506 2.352 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.475 179.296 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.16 -36.0 81.95 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.274 -0.891 . . . . 0.0 110.229 179.503 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.2 mmtp -53.84 -179.41 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.637 0 O-C-N 121.075 -1.016 . . . . 0.0 110.471 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -106.03 141.26 37.7 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.308 -0.87 . . . . 0.0 109.58 179.428 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.36 -20.49 49.62 Favored Glycine 0 N--CA 1.491 2.366 0 C-N-CA 119.854 -1.165 . . . . 0.0 110.608 -179.298 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -92.55 57.06 2.85 Favored 'General case' 0 N--CA 1.504 2.233 0 CA-C-N 119.313 1.556 . . . . 0.0 110.282 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -74.93 -38.57 61.76 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.009 -1.057 . . . . 0.0 109.66 179.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -111.91 83.95 1.88 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.239 -0.913 . . . . 0.0 109.602 179.583 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 9.3 tp -121.02 137.39 54.67 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.268 -0.895 . . . . 0.0 110.017 -179.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.439 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.8 p -111.6 -38.54 4.88 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.208 -0.932 . . . . 0.0 112.327 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.597 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 5.5 m -139.65 -168.71 2.54 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 120.25 -1.531 . . . . 0.0 109.884 178.939 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 12.4 mt -97.59 -37.98 9.72 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.006 -1.059 . . . . 0.0 110.557 179.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.8 ttt-85 -101.89 32.2 3.54 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.939 -1.101 . . . . 0.0 109.464 178.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.597 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.306 1.7 t -127.36 16.22 7.13 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.231 -0.918 . . . . 0.0 109.119 -179.21 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.406 ' CG2' ' O ' ' A' ' 108' ' ' CYS . 1.1 pt -159.77 39.21 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 O-C-N 120.905 -1.122 . . . . 0.0 110.1 -178.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.428 ' O ' ' OG1' ' A' ' 119' ' ' THR . 1.7 tt0 . . . . . 0 N--CA 1.501 2.113 0 O-C-N 120.813 -1.179 . . . . 0.0 111.124 -178.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.428 ' OG1' ' O ' ' A' ' 110' ' ' GLN . 0.3 OUTLIER . . . . . 0 N--CA 1.494 1.739 0 CA-C-O 120.76 0.314 . . . . 0.0 110.198 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 42.5 t -106.59 155.49 19.57 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.25 -0.906 . . . . 0.0 109.282 178.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.448 ' CG2' ' CE1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -71.22 -36.81 63.66 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.336 0 O-C-N 121.098 -1.001 . . . . 0.0 110.757 -179.637 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.466 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 5.1 p -54.92 -32.68 61.44 Favored 'General case' 0 N--CA 1.512 2.636 0 O-C-N 120.84 -1.163 . . . . 0.0 110.968 -179.161 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.5 -35.59 72.47 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.914 -1.116 . . . . 0.0 109.378 178.171 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 55.8 t -79.92 125.42 82.01 Favored Pre-proline 0 N--CA 1.503 2.187 0 O-C-N 121.21 -0.931 . . . . 0.0 109.478 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -64.94 167.94 14.78 Favored 'Trans proline' 0 N--CA 1.488 1.173 0 O-C-N 123.145 1.076 . . . . 0.0 110.662 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.03 -36.86 61.86 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.259 -0.901 . . . . 0.0 110.794 -179.529 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.11 -40.37 81.02 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.045 -1.035 . . . . 0.0 110.077 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -68.14 -41.52 81.5 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.201 -0.937 . . . . 0.0 109.323 179.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 10.9 mt -62.49 -38.48 90.05 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.496 -0.882 . . . . 0.0 109.859 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -59.98 -40.32 88.73 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.081 -1.012 . . . . 0.0 109.958 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -64.3 -38.96 92.88 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.174 -0.954 . . . . 0.0 109.822 179.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -60.61 -39.94 89.99 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.24 -0.913 . . . . 0.0 109.99 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.08 -45.06 95.18 Favored 'General case' 0 N--CA 1.508 2.452 0 C-N-CA 119.351 -0.94 . . . . 0.0 109.85 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 10.2 ttp85 -60.83 -39.05 87.58 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.203 -0.936 . . . . 0.0 109.789 179.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 27.8 mtmt -61.86 -34.38 75.89 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.144 -0.973 . . . . 0.0 110.602 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 29.4 mttt -102.49 18.48 21.06 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.005 -1.059 . . . . 0.0 111.921 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 55.35 45.45 83.34 Favored Glycine 0 N--CA 1.498 2.792 0 O-C-N 120.607 -1.308 . . . . 0.0 110.38 179.491 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.8 t -140.67 -163.44 1.53 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.171 -1.194 . . . . 0.0 110.079 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -138.51 145.41 40.73 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.184 -0.948 . . . . 0.0 110.253 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.6 p -132.03 160.85 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 O-C-N 121.147 -0.971 . . . . 0.0 110.109 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 41.4 t -168.8 80.68 0.14 Allowed 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.22 -0.925 . . . . 0.0 111.149 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.466 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 49.6 t80 -94.4 159.8 14.95 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.222 -0.924 . . . . 0.0 110.195 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 28.8 m170 -136.16 -61.13 0.71 Allowed 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 178.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -136.79 152.6 50.48 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.459 -0.776 . . . . 0.0 109.357 179.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 26.2 p -94.74 155.65 16.74 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.156 -0.965 . . . . 0.0 110.904 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.8 p -74.15 -25.28 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.532 0 O-C-N 121.344 -0.848 . . . . 0.0 111.583 -179.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -50.59 -46.68 58.04 Favored 'General case' 0 N--CA 1.517 2.896 0 O-C-N 120.755 -1.216 . . . . 0.0 109.594 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.472 ' HB2' ' CE ' ' A' ' 53' ' ' MET . 29.5 p -141.5 -178.58 5.7 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.411 -0.806 . . . . 0.0 110.411 179.315 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -91.02 62.21 2.93 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 107.781 -2.128 . . . . 0.0 107.781 178.116 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.5 t -105.68 138.77 41.33 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.382 -1.069 . . . . 0.0 109.626 -178.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 3.7 tpt85 -92.65 57.05 2.81 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.276 -0.89 . . . . 0.0 109.727 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 61.82 96.25 0.01 OUTLIER Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.739 -1.344 . . . . 0.0 109.739 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.3 p -104.71 128.51 52.82 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.308 -1.113 . . . . 0.0 110.401 179.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -138.44 142.67 39.5 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.168 -0.957 . . . . 0.0 109.85 -179.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.495 1.788 0 O-C-N 121.205 -0.934 . . . . 0.0 110.174 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.431 ' HB1' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.503 2.183 0 CA-C-O 120.453 0.168 . . . . 0.0 110.691 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.56 162.63 40.83 Favored 'Trans proline' 0 C--N 1.318 -1.039 0 O-C-N 123.245 1.129 . . . . 0.0 110.675 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -48.77 -32.14 8.13 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 121.466 -0.771 . . . . 0.0 111.325 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -54.31 -33.42 52.73 Favored Glycine 0 N--CA 1.499 2.847 0 O-C-N 121.067 -1.021 . . . . 0.0 110.572 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -53.51 -31.48 46.27 Favored 'General case' 0 N--CA 1.512 2.662 0 O-C-N 120.903 -1.351 . . . . 0.0 110.818 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -54.37 -36.97 64.45 Favored 'General case' 0 N--CA 1.513 2.711 0 O-C-N 121.038 -1.039 . . . . 0.0 110.33 179.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.6 mmmt -57.14 -35.02 69.0 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.262 -0.899 . . . . 0.0 110.406 179.424 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 3.2 pt -117.32 37.55 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.137 -0.977 . . . . 0.0 110.366 179.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.435 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 2.7 tmtt? -83.79 -42.91 0.79 Allowed Pre-proline 0 N--CA 1.507 2.394 0 O-C-N 121.142 -0.974 . . . . 0.0 113.254 -179.155 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.435 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.4 Cg_endo -75.85 -39.68 0.89 Allowed 'Trans proline' 0 N--CA 1.487 1.118 0 O-C-N 122.615 0.797 . . . . 0.0 111.853 -178.306 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 90.7 m -59.39 -43.25 92.96 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 120.906 -1.121 . . . . 0.0 109.952 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.422 HD21 ' CE2' ' A' ' 86' ' ' TYR . 3.6 mt -63.48 -37.8 88.67 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 119.425 -0.91 . . . . 0.0 109.506 179.304 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.3 m -56.63 -34.82 67.65 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.058 -1.026 . . . . 0.0 110.353 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.11 -38.81 73.95 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.004 -1.06 . . . . 0.0 110.014 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.433 ' CD1' ' HD3' ' A' ' 59' ' ' ARG . 22.6 m-85 -57.85 -40.09 79.28 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.121 -0.987 . . . . 0.0 110.025 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -57.02 -27.64 61.8 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.267 -0.896 . . . . 0.0 111.066 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 2.7 mp -78.09 -35.7 20.53 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.386 0 O-C-N 120.996 -1.065 . . . . 0.0 109.423 179.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.1 tp60 -79.78 -39.85 30.0 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 120.985 -1.072 . . . . 0.0 108.61 178.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.415 ' CD1' ' CG2' ' A' ' 52' ' ' ILE . 6.6 tp -69.6 -34.31 73.93 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.235 -0.916 . . . . 0.0 110.369 179.103 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -71.01 -35.54 72.07 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 120.885 -1.134 . . . . 0.0 109.953 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -65.44 -38.58 90.29 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.062 -1.024 . . . . 0.0 110.006 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.408 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -73.81 -42.02 61.51 Favored 'General case' 0 N--CA 1.504 2.251 0 C-N-CA 118.975 -1.09 . . . . 0.0 109.097 179.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -63.76 -33.19 75.1 Favored 'General case' 0 N--CA 1.505 2.322 0 C-N-CA 119.471 -0.892 . . . . 0.0 110.129 179.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.1 mttm -82.16 -31.35 30.53 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 120.857 -1.152 . . . . 0.0 110.893 179.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.3 t70 . . . . . 0 N--CA 1.512 2.653 0 O-C-N 120.97 -1.081 . . . . 0.0 110.709 179.985 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.499 1.993 0 CA-C-O 120.648 0.261 . . . . 0.0 110.434 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.416 ' O ' ' CG ' ' A' ' 50' ' ' TRP . 35.7 m120 -57.92 -40.01 79.36 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.168 -0.958 . . . . 0.0 109.924 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -66.13 -42.88 88.55 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.163 -0.96 . . . . 0.0 109.59 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 49.5 tp60 -68.51 -40.58 80.78 Favored 'General case' 0 N--CA 1.505 2.278 0 C-N-CA 119.293 -0.963 . . . . 0.0 109.347 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 13.1 mt -63.41 -36.85 85.1 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.238 -0.914 . . . . 0.0 109.924 179.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.449 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 53.6 m0 -58.04 -37.28 74.06 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 120.955 -1.09 . . . . 0.0 109.908 179.663 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -30.17 71.32 Favored 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 119.125 -1.03 . . . . 0.0 109.516 178.181 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.415 ' CG2' ' CD1' ' A' ' 30' ' ' LEU . 17.7 mt -69.61 -58.66 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.268 0 O-C-N 120.875 -1.14 . . . . 0.0 109.181 179.371 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.8 ptm -61.48 -29.96 70.31 Favored 'General case' 0 N--CA 1.51 2.557 0 C-N-CA 118.462 -1.295 . . . . 0.0 109.779 179.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -65.92 -38.23 88.13 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 120.887 -1.133 . . . . 0.0 109.167 178.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.403 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.3 mt -53.3 -32.23 47.82 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 120.962 -1.086 . . . . 0.0 110.182 179.108 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.439 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 72.6 t60 -55.61 -38.23 69.17 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 120.982 -1.074 . . . . 0.0 110.113 179.634 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.422 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.3 m170 -58.57 -47.17 85.18 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.091 -1.006 . . . . 0.0 109.412 179.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 -61.26 -35.64 77.82 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 119.407 -0.917 . . . . 0.0 109.219 178.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.433 ' HD3' ' CD1' ' A' ' 26' ' ' PHE . 20.2 mmm-85 -63.9 -51.14 65.88 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.105 -0.997 . . . . 0.0 109.37 179.212 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 52.0 p -60.58 -39.63 88.74 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.22 -0.925 . . . . 0.0 109.661 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.416 ' O ' ' OG1' ' A' ' 65' ' ' THR . 13.3 ttt85 -65.18 -41.76 94.28 Favored 'General case' 0 N--CA 1.504 2.255 0 C-N-CA 119.115 -1.034 . . . . 0.0 109.012 179.142 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -63.37 -50.06 71.42 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.244 -0.91 . . . . 0.0 109.502 179.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.405 HG22 HD11 ' A' ' 63' ' ' ILE . 84.9 mt -70.2 -37.68 72.31 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.292 0 O-C-N 121.211 -0.931 . . . . 0.0 109.524 179.451 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -67.56 -42.17 83.04 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.168 -0.958 . . . . 0.0 108.995 179.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.416 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 90.0 m -61.19 -40.76 95.14 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.123 -0.986 . . . . 0.0 110.322 -179.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.401 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -83.35 -33.28 25.89 Favored 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 118.894 -1.122 . . . . 0.0 112.504 -178.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.416 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 45.6 t80 -86.35 -32.12 21.15 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 120.611 -1.305 . . . . 0.0 111.927 -179.295 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -98.34 -18.98 18.04 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 120.874 -1.141 . . . . 0.0 112.721 -178.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 13.5 mtpt -119.38 -58.77 1.89 Allowed 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.483 -1.385 . . . . 0.0 110.794 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.8 tpt180 -64.53 -30.59 71.62 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.11 -0.994 . . . . 0.0 110.99 -179.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt 57.51 41.8 25.36 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 120.815 -1.178 . . . . 0.0 110.056 -179.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.07 35.46 3.93 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.409 -0.807 . . . . 0.0 109.941 179.288 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.443 HG23 HD12 ' A' ' 73' ' ' ILE . 13.8 tt -152.83 162.19 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.145 -0.972 . . . . 0.0 109.874 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.0 m -109.64 147.58 32.82 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.038 -1.039 . . . . 0.0 110.133 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.7 ttmt -45.81 -32.42 2.56 Favored 'General case' 0 N--CA 1.514 2.774 0 O-C-N 121.317 -0.865 . . . . 0.0 111.556 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.75 -50.28 73.02 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 120.987 -1.071 . . . . 0.0 109.205 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 41.7 tp -67.24 -44.48 79.35 Favored 'General case' 0 N--CA 1.505 2.292 0 C-N-CA 119.208 -0.997 . . . . 0.0 108.354 178.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.416 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 14.3 t80 -59.97 -37.58 80.04 Favored 'General case' 0 N--CA 1.507 2.397 0 C-N-CA 119.628 -0.829 . . . . 0.0 109.511 179.117 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -75.22 -40.93 58.65 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.141 -0.974 . . . . 0.0 108.902 178.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.431 ' CH2' ' HB1' ' A' ' 12' ' ' ALA . 87.4 t90 -59.26 -37.83 78.6 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.05 -1.031 . . . . 0.0 109.263 178.744 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.438 HD23 ' CD2' ' A' ' 86' ' ' TYR . 11.4 mt -66.68 -57.28 7.48 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.188 -0.945 . . . . 0.0 109.057 178.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -56.01 -27.36 22.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.406 0 O-C-N 121.228 -0.92 . . . . 0.0 110.837 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.9 tttt -89.52 -16.75 30.02 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 120.938 -1.101 . . . . 0.0 111.919 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.429 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 76.3 mm-40 -104.89 25.72 10.1 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.516 -1.365 . . . . 0.0 111.98 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.403 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 18.8 ttmt 76.64 66.92 0.05 Allowed 'General case' 0 N--CA 1.511 2.623 0 O-C-N 121.198 -0.938 . . . . 0.0 112.053 179.274 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.438 ' CD2' HD23 ' A' ' 81' ' ' LEU . 26.1 m-85 -129.95 -63.31 0.92 Allowed 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 178.751 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -135.75 171.21 14.78 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.497 -0.752 . . . . 0.0 109.23 179.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.439 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 11.0 t0 -119.49 111.72 18.46 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.151 -0.968 . . . . 0.0 110.273 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 8.3 mtpt -57.58 -37.93 73.99 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.207 -0.933 . . . . 0.0 110.077 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 17.5 tp -59.08 -37.16 76.44 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.181 -0.949 . . . . 0.0 110.163 179.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.412 HD22 ' CD2' ' A' ' 57' ' ' HIS . 58.8 tp -70.03 -49.34 52.29 Favored 'General case' 0 N--CA 1.506 2.354 0 C-N-CA 119.231 -0.988 . . . . 0.0 108.764 179.275 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.417 HG21 HD12 ' A' ' 92' ' ' ILE . 68.1 mt -57.57 -38.51 64.37 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.52 0 O-C-N 121.148 -0.97 . . . . 0.0 108.693 178.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.04 -41.59 86.29 Favored 'General case' 0 N--CA 1.502 2.165 0 C-N-CA 119.356 -0.938 . . . . 0.0 108.742 178.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 8.3 mmtm -53.21 -39.84 64.02 Favored 'General case' 0 N--CA 1.512 2.669 0 O-C-N 121.162 -0.961 . . . . 0.0 109.892 179.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 3.6 m0 -68.85 -26.48 65.17 Favored 'General case' 0 N--CA 1.508 2.447 0 C-N-CA 119.436 -0.906 . . . . 0.0 110.723 179.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.49 -33.84 25.48 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 120.809 -1.182 . . . . 0.0 110.776 179.48 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? -53.26 -177.7 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.767 0 O-C-N 120.992 -1.068 . . . . 0.0 110.793 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -102.55 146.86 27.53 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.237 -0.914 . . . . 0.0 109.525 179.1 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 86.0 0.31 87.34 Favored Glycine 0 N--CA 1.495 2.619 0 C-N-CA 119.979 -1.105 . . . . 0.0 111.277 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -111.06 67.17 0.64 Allowed 'General case' 0 N--CA 1.498 1.936 0 CA-C-N 119.576 1.688 . . . . 0.0 109.593 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -96.17 -35.35 11.34 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.111 -0.993 . . . . 0.0 110.935 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.54 63.0 0.77 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.021 -1.049 . . . . 0.0 110.895 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.5 pp -111.95 154.61 25.0 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.932 -1.105 . . . . 0.0 109.798 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.422 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.4 p -115.6 -30.47 6.16 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -178.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.553 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.5 m -142.09 -167.45 2.47 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 120.052 -1.655 . . . . 0.0 110.087 179.399 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 13.6 mt -95.53 -40.13 9.61 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.142 -0.974 . . . . 0.0 109.89 179.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -101.15 28.51 5.3 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.044 -1.035 . . . . 0.0 110.067 178.189 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.553 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.8 t -126.92 15.6 7.4 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.047 -1.033 . . . . 0.0 109.112 -179.584 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.404 ' CG2' ' O ' ' A' ' 108' ' ' CYS . 1.0 OUTLIER -159.34 38.75 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 O-C-N 120.931 -1.106 . . . . 0.0 110.345 -178.783 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 . . . . . 0 N--CA 1.501 2.118 0 O-C-N 120.79 -1.194 . . . . 0.0 111.452 -178.503 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.718 0 CA-C-O 120.855 0.36 . . . . 0.0 110.476 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 48.5 t -109.25 155.48 21.07 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.359 -0.838 . . . . 0.0 109.116 178.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.456 ' CG2' ' CE1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -73.65 -30.83 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 121.026 -1.046 . . . . 0.0 111.475 -179.163 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.49 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.4 p -59.79 -35.85 75.51 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 120.598 -1.314 . . . . 0.0 110.486 -179.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.03 -33.13 66.88 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.041 -1.037 . . . . 0.0 109.961 178.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 61.6 t -79.78 123.93 83.65 Favored Pre-proline 0 N--CA 1.504 2.25 0 O-C-N 121.062 -1.024 . . . . 0.0 109.965 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -66.33 -178.22 1.08 Allowed 'Trans proline' 0 N--CA 1.488 1.149 0 O-C-N 123.112 1.059 . . . . 0.0 110.785 179.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -75.06 -38.0 61.48 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.208 -0.932 . . . . 0.0 110.413 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.1 -43.37 91.87 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.052 -1.03 . . . . 0.0 109.95 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 64.1 tp60 -67.3 -41.54 85.21 Favored 'General case' 0 N--CA 1.506 2.331 0 C-N-CA 119.296 -0.962 . . . . 0.0 109.298 179.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.6 mt -63.44 -38.95 93.11 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.274 -0.891 . . . . 0.0 109.508 179.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -59.07 -39.55 82.43 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.058 -1.026 . . . . 0.0 109.989 179.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -58.59 -38.04 77.08 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.122 -0.986 . . . . 0.0 110.212 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -59.98 -41.99 93.23 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.177 -0.952 . . . . 0.0 110.048 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.49 -45.12 95.57 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.17 -0.956 . . . . 0.0 109.809 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 14.2 mmt180 -59.58 -39.26 83.55 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.155 -0.966 . . . . 0.0 109.9 179.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 3.4 ttmt -58.82 -35.75 73.39 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.148 -0.97 . . . . 0.0 110.515 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 43.8 mttt -107.74 21.62 17.16 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 120.961 -1.087 . . . . 0.0 111.827 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.5 46.26 58.57 Favored Glycine 0 N--CA 1.499 2.888 0 O-C-N 120.695 -1.253 . . . . 0.0 110.656 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.0 t -141.03 -165.06 1.87 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.155 -1.203 . . . . 0.0 110.176 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -126.54 171.98 10.62 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.12 -0.988 . . . . 0.0 110.355 -179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 8.7 p -157.06 160.94 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.326 -0.859 . . . . 0.0 110.664 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 27.3 t -167.58 107.31 0.57 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.185 -0.947 . . . . 0.0 110.911 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.49 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 84.2 t80 -108.79 160.23 16.14 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.247 -0.908 . . . . 0.0 111.035 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -138.61 -61.03 0.59 Allowed 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.587 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -142.15 149.12 39.35 Favored 'General case' 0 N--CA 1.495 1.821 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 178.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . 0.412 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 29.6 p -89.88 153.88 20.3 Favored 'General case' 0 N--CA 1.506 2.342 0 C-N-CA 119.078 -1.049 . . . . 0.0 111.187 -179.372 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 19.6 m -72.54 -23.43 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 121.428 -0.795 . . . . 0.0 111.385 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -51.52 -62.6 1.52 Allowed 'General case' 0 N--CA 1.513 2.723 0 O-C-N 120.781 -1.2 . . . . 0.0 110.021 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.449 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 21.9 p -123.9 -164.5 1.24 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.27 -0.894 . . . . 0.0 110.321 179.255 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . 0.413 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -101.58 64.45 0.5 Allowed Glycine 0 N--CA 1.493 2.462 0 N-CA-C 107.897 -2.081 . . . . 0.0 107.897 178.501 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 28.4 t -104.36 141.42 36.35 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.314 -1.109 . . . . 0.0 109.965 -179.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 46.0 ttt180 -97.06 51.01 1.1 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.271 -0.893 . . . . 0.0 109.476 179.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.2 99.32 0.05 OUTLIER Glycine 0 N--CA 1.486 2.028 0 N-CA-C 109.969 -1.252 . . . . 0.0 109.969 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 26.2 p -110.19 126.37 54.04 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.269 -1.136 . . . . 0.0 110.148 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -150.33 148.44 28.82 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.038 -1.039 . . . . 0.0 110.472 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.501 2.092 0 O-C-N 121.26 -0.9 . . . . 0.0 110.562 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.447 ' HB1' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.504 2.235 0 N-CA-C 110.394 -0.224 . . . . 0.0 110.394 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.01 163.77 38.09 Favored 'Trans proline' 0 C--N 1.317 -1.095 0 O-C-N 123.387 1.204 . . . . 0.0 110.718 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -48.27 -32.39 7.22 Favored 'General case' 0 N--CA 1.516 2.841 0 O-C-N 121.435 -0.791 . . . . 0.0 111.426 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.81 -34.89 51.77 Favored Glycine 0 N--CA 1.498 2.812 0 O-C-N 120.967 -1.083 . . . . 0.0 110.417 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -55.17 -33.14 62.72 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 121.039 -1.271 . . . . 0.0 110.739 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.7 tm-20 -54.4 -38.06 65.78 Favored 'General case' 0 N--CA 1.511 2.623 0 O-C-N 120.984 -1.073 . . . . 0.0 110.206 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.8 mttm -59.06 -35.62 73.65 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.257 -0.902 . . . . 0.0 110.21 179.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 1.9 pt -117.99 37.07 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 121.074 -1.016 . . . . 0.0 110.34 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.432 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 2.5 tmtt? -84.82 -43.35 0.69 Allowed Pre-proline 0 N--CA 1.509 2.488 0 O-C-N 121.12 -0.988 . . . . 0.0 113.379 -179.041 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.432 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.7 Cg_endo -76.3 -37.15 1.52 Allowed 'Trans proline' 0 N--CA 1.486 1.065 0 O-C-N 122.586 0.782 . . . . 0.0 111.892 -178.018 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 88.2 m -59.85 -42.07 92.84 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 120.919 -1.113 . . . . 0.0 110.131 -179.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.423 HD22 ' CD2' ' A' ' 86' ' ' TYR . 2.4 mt -64.85 -39.07 92.98 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 119.387 -0.925 . . . . 0.0 109.577 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.0 -35.59 69.4 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.159 -0.963 . . . . 0.0 110.247 179.502 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -57.24 -36.33 70.8 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.056 -1.027 . . . . 0.0 110.389 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.421 ' CE2' ' HG3' ' A' ' 59' ' ' ARG . 15.5 m-85 -59.05 -39.64 82.64 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.07 -1.019 . . . . 0.0 110.525 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -59.45 -39.43 83.6 Favored 'General case' 0 N--CA 1.508 2.427 0 C-N-CA 119.362 -0.935 . . . . 0.0 110.42 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.1 mp -65.37 -41.78 92.04 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.341 0 C-N-CA 119.204 -0.998 . . . . 0.0 108.764 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.66 -50.83 40.31 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.209 -0.997 . . . . 0.0 108.443 178.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.2 tp -58.9 -34.53 71.78 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.25 -0.906 . . . . 0.0 109.502 178.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.08 -39.8 79.47 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 121.061 -1.025 . . . . 0.0 110.194 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -63.03 -51.12 67.97 Favored 'General case' 0 N--CA 1.507 2.403 0 C-N-CA 119.27 -0.972 . . . . 0.0 109.57 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.402 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -68.26 -38.71 82.03 Favored 'General case' 0 N--CA 1.505 2.314 0 C-N-CA 119.249 -0.98 . . . . 0.0 109.262 179.031 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -67.41 -34.04 76.42 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.207 -0.933 . . . . 0.0 110.117 179.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 9.2 mmtt -78.79 -38.03 39.44 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.0 -1.063 . . . . 0.0 110.293 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.8 t70 . . . . . 0 N--CA 1.509 2.515 0 O-C-N 121.06 -1.025 . . . . 0.0 110.162 179.833 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.497 1.923 0 CA-C-O 120.679 0.275 . . . . 0.0 110.406 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -56.87 -39.44 74.33 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 121.167 -0.958 . . . . 0.0 109.962 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -61.48 -40.53 94.86 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.238 -0.914 . . . . 0.0 109.766 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 49.7 tp60 -61.4 -40.54 94.74 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.147 -0.971 . . . . 0.0 109.848 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -60.01 -39.19 84.94 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.124 -0.985 . . . . 0.0 110.083 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.436 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.8 m0 -58.09 -37.03 73.74 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.011 -1.055 . . . . 0.0 110.023 179.603 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -60.59 -30.36 69.76 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.081 -1.012 . . . . 0.0 110.089 178.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.402 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 17.1 mt -72.27 -58.78 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.237 0 O-C-N 120.871 -1.143 . . . . 0.0 109.107 179.424 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.3 ptm -60.79 -29.53 69.5 Favored 'General case' 0 N--CA 1.509 2.515 0 C-N-CA 118.52 -1.272 . . . . 0.0 109.684 178.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -70.33 -38.91 74.98 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 120.904 -1.122 . . . . 0.0 108.931 177.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 11.3 mt -53.69 -31.53 48.29 Favored 'General case' 0 N--CA 1.512 2.642 0 O-C-N 121.058 -1.026 . . . . 0.0 110.3 178.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.445 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 3.9 t60 -57.13 -37.38 71.92 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.002 -1.062 . . . . 0.0 110.097 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.439 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 5.8 m170 -59.31 -48.67 80.77 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.006 -1.059 . . . . 0.0 109.457 179.044 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.6 tp60 -60.82 -37.27 81.43 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 119.34 -0.944 . . . . 0.0 109.071 178.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.421 ' HG3' ' CE2' ' A' ' 26' ' ' PHE . 11.5 mtp85 -66.36 -51.79 53.58 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.147 -0.971 . . . . 0.0 109.024 178.7 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 22.2 p -63.46 -38.78 92.45 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.241 -0.912 . . . . 0.0 109.177 179.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.405 ' O ' ' OG1' ' A' ' 65' ' ' THR . 9.6 ttm180 -65.18 -38.82 91.72 Favored 'General case' 0 N--CA 1.507 2.41 0 C-N-CA 119.242 -0.983 . . . . 0.0 109.25 178.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -60.99 -49.8 75.99 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.155 -0.966 . . . . 0.0 109.313 179.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 87.7 mt -74.3 -41.76 50.63 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 C-N-CA 119.42 -0.912 . . . . 0.0 109.128 179.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.497 ' CD1' ' CD2' ' A' ' 68' ' ' TYR . 45.8 t80 -60.51 -35.38 75.83 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.259 -0.901 . . . . 0.0 109.653 178.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.405 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 79.7 m -74.52 -38.24 62.85 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.926 -1.109 . . . . 0.0 110.422 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.403 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -83.08 -30.86 27.66 Favored 'General case' 0 N--CA 1.505 2.288 0 C-N-CA 119.028 -1.069 . . . . 0.0 112.512 -179.046 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.416 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 42.1 t80 -86.04 -33.25 21.07 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 120.634 -1.291 . . . . 0.0 111.724 -179.203 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.497 ' CD2' ' CD1' ' A' ' 64' ' ' TYR . 29.4 m-85 -97.4 -25.73 15.11 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.708 -1.245 . . . . 0.0 112.432 -178.774 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.6 mttt -113.37 -60.14 1.92 Allowed 'General case' 0 N--CA 1.501 2.078 0 O-C-N 120.659 -1.275 . . . . 0.0 111.131 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.0 ttt85 -62.68 -31.06 71.88 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.127 -0.983 . . . . 0.0 110.641 -179.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.1 tttt 58.29 44.33 18.78 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 120.813 -1.18 . . . . 0.0 110.001 -179.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.33 36.36 3.59 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.358 -0.839 . . . . 0.0 109.891 179.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.403 ' CG2' ' CD1' ' A' ' 66' ' ' LEU . 14.2 tt -157.32 162.53 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.206 -0.934 . . . . 0.0 110.175 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.56 149.49 29.57 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.164 -0.96 . . . . 0.0 110.232 179.848 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.9 tttt -46.29 -32.35 3.06 Favored 'General case' 0 N--CA 1.515 2.807 0 O-C-N 121.362 -0.836 . . . . 0.0 111.584 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -63.1 -51.96 64.49 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.925 -1.109 . . . . 0.0 109.274 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 40.5 tp -65.04 -43.48 92.2 Favored 'General case' 0 N--CA 1.506 2.347 0 C-N-CA 119.141 -1.024 . . . . 0.0 108.559 178.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.417 ' CE1' ' CD1' ' A' ' 82' ' ' ILE . 14.0 t80 -60.99 -41.72 97.03 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.301 -0.875 . . . . 0.0 109.242 179.151 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -70.57 -42.69 70.77 Favored 'General case' 0 N--CA 1.503 2.221 0 C-N-CA 119.321 -0.951 . . . . 0.0 108.518 178.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.447 ' CH2' ' HB1' ' A' ' 12' ' ' ALA . 86.6 t90 -56.99 -35.19 68.89 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.338 -0.851 . . . . 0.0 109.519 178.526 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.45 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 13.4 mt -67.53 -57.94 5.6 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.084 -1.01 . . . . 0.0 109.081 179.077 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.417 ' CD1' ' CE1' ' A' ' 78' ' ' TYR . 0.5 OUTLIER -57.24 -27.22 27.45 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.685 0 C-N-CA 119.044 -1.063 . . . . 0.0 109.897 179.218 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -83.34 -20.42 34.35 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 120.885 -1.134 . . . . 0.0 111.391 179.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.422 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 16.5 mm-40 -107.21 22.97 15.17 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 120.652 -1.28 . . . . 0.0 111.989 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 8.1 tttp 74.44 78.45 0.12 Allowed 'General case' 0 N--CA 1.511 2.61 0 O-C-N 121.072 -1.017 . . . . 0.0 111.37 179.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.45 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 28.4 m-85 -136.52 -63.79 0.61 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.622 -0.674 . . . . 0.0 109.707 -179.781 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -128.5 -173.42 2.95 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.349 -0.844 . . . . 0.0 109.755 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.445 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 7.8 t0 -126.18 102.57 7.26 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.151 -0.968 . . . . 0.0 110.53 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.6 mtmt -59.37 -38.48 80.57 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 121.184 -0.948 . . . . 0.0 109.95 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 26.0 tp -60.44 -41.71 94.62 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.194 -0.941 . . . . 0.0 109.864 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.424 HD21 ' CD2' ' A' ' 57' ' ' HIS . 60.5 tp -67.01 -49.42 65.38 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.068 -1.02 . . . . 0.0 108.961 179.321 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.445 ' CG2' ' CE1' ' A' ' 64' ' ' TYR . 40.7 mt -56.81 -36.36 49.32 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.47 0 O-C-N 121.124 -0.985 . . . . 0.0 108.918 178.609 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.77 -39.64 94.79 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.121 -0.987 . . . . 0.0 109.082 178.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.435 ' NZ ' ' OH ' ' A' ' 100' ' ' TYR . 4.3 mmtt -59.32 -46.58 88.19 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.087 -1.008 . . . . 0.0 109.276 179.274 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.0 m0 -60.17 -37.54 80.48 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.247 -0.908 . . . . 0.0 110.111 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.6 mtp85 -75.14 -31.92 61.21 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.064 -1.023 . . . . 0.0 110.615 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -53.97 -176.9 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.699 0 O-C-N 121.014 -1.054 . . . . 0.0 110.572 179.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 2.4 m -102.89 133.38 48.08 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.183 -0.948 . . . . 0.0 109.751 179.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.39 9.09 57.08 Favored Glycine 0 N--CA 1.493 2.486 0 C-N-CA 120.152 -1.023 . . . . 0.0 111.242 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.435 ' OH ' ' NZ ' ' A' ' 94' ' ' LYS . 51.4 m-85 -116.08 69.02 0.73 Allowed 'General case' 0 N--CA 1.495 1.801 0 CA-C-N 119.569 1.685 . . . . 0.0 109.971 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -97.29 -35.25 10.79 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.143 -0.973 . . . . 0.0 110.915 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.98 71.88 0.95 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.999 -1.063 . . . . 0.0 110.8 -179.611 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.3 pp -123.58 161.78 24.3 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.038 -1.039 . . . . 0.0 109.946 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.439 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.8 p -120.48 -33.0 3.95 Favored 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -178.83 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.549 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.8 m -140.92 -168.39 2.59 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.067 -1.646 . . . . 0.0 110.162 179.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 13.2 mt -95.47 -39.4 10.0 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.235 -0.916 . . . . 0.0 109.909 178.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 9.3 ttm180 -101.15 27.23 6.28 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.913 -1.117 . . . . 0.0 110.271 178.174 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.549 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.287 1.8 t -124.82 14.38 8.6 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.054 -1.029 . . . . 0.0 109.213 -179.779 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -158.67 35.64 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.339 0 O-C-N 120.714 -1.241 . . . . 0.0 111.116 -178.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 . . . . . 0 N--CA 1.5 2.038 0 O-C-N 120.604 -1.31 . . . . 0.0 111.498 -178.894 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 2.8 m . . . . . 0 N--CA 1.494 1.763 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 46.7 t -101.49 155.55 18.01 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.259 -0.9 . . . . 0.0 109.785 179.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.448 ' CD1' ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -71.64 -37.47 63.33 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.347 0 O-C-N 121.087 -1.008 . . . . 0.0 110.682 -179.554 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.492 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 9.2 p -52.82 -32.98 47.13 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 120.953 -1.092 . . . . 0.0 111.262 -178.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -33.19 68.71 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 120.907 -1.121 . . . . 0.0 109.852 178.34 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 48.4 t -81.11 125.73 78.85 Favored Pre-proline 0 N--CA 1.503 2.216 0 O-C-N 121.1 -1.0 . . . . 0.0 109.746 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -65.91 172.02 9.04 Favored 'Trans proline' 0 N--CA 1.489 1.224 0 O-C-N 123.145 1.076 . . . . 0.0 110.815 179.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 5.1 tpt180 -75.07 -37.88 61.47 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.304 -0.873 . . . . 0.0 110.426 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.53 -40.28 78.45 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.071 -1.018 . . . . 0.0 110.107 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -69.41 -40.89 77.03 Favored 'General case' 0 N--CA 1.505 2.302 0 C-N-CA 119.344 -0.942 . . . . 0.0 109.333 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.3 mt -67.14 -38.93 86.39 Favored 'General case' 0 N--CA 1.507 2.377 0 C-N-CA 119.494 -0.882 . . . . 0.0 109.591 179.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -65.96 -40.07 90.96 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.133 -0.98 . . . . 0.0 109.573 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.71 -39.64 94.66 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.165 -0.959 . . . . 0.0 109.791 179.551 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -60.41 -41.78 94.64 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.287 -0.883 . . . . 0.0 110.031 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.41 -40.63 91.69 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.223 -0.923 . . . . 0.0 110.025 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -60.16 -39.59 86.94 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.239 -0.913 . . . . 0.0 109.95 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -61.76 -34.92 76.71 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.247 -0.908 . . . . 0.0 110.697 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.14 19.24 19.93 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 120.948 -1.095 . . . . 0.0 111.942 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 53.35 41.47 62.7 Favored Glycine 0 N--CA 1.5 2.903 0 O-C-N 120.612 -1.305 . . . . 0.0 110.593 179.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.7 t -131.54 -163.49 1.33 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.091 -1.241 . . . . 0.0 109.969 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -142.1 140.78 32.61 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.131 -0.981 . . . . 0.0 110.494 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.4 p -131.87 161.2 41.69 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.186 -0.946 . . . . 0.0 109.886 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 33.2 t -167.59 83.25 0.21 Allowed 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.175 -0.953 . . . . 0.0 111.48 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.492 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 36.5 t80 -93.56 162.1 14.09 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.187 -0.946 . . . . 0.0 109.943 179.501 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -139.07 -59.51 0.59 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.417 -0.802 . . . . 0.0 109.379 179.129 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.82 152.14 51.51 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.324 -0.86 . . . . 0.0 109.384 179.179 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 25.1 p -97.19 156.89 16.21 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.21 -0.931 . . . . 0.0 110.894 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 12.9 p -77.83 -22.18 13.84 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.509 0 O-C-N 121.337 -0.852 . . . . 0.0 111.872 -179.472 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -50.96 -57.88 7.44 Favored 'General case' 0 N--CA 1.516 2.839 0 O-C-N 120.834 -1.166 . . . . 0.0 109.9 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.436 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.8 p -128.78 -163.43 1.29 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.303 -0.873 . . . . 0.0 110.279 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.41 65.22 0.57 Allowed Glycine 0 N--CA 1.493 2.435 0 N-CA-C 108.036 -2.026 . . . . 0.0 108.036 178.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 37.3 t -104.59 147.36 27.71 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.31 -1.111 . . . . 0.0 110.297 -178.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 28.7 mtt85 -102.79 42.94 1.11 Allowed 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.327 -0.858 . . . . 0.0 109.482 179.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 77.06 96.72 0.19 Allowed Glycine 0 N--CA 1.487 2.08 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 22.7 p -111.53 128.42 56.02 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.23 -1.159 . . . . 0.0 110.554 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -154.83 145.86 22.68 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.162 -0.962 . . . . 0.0 110.474 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.632 0 O-C-N 121.199 -0.938 . . . . 0.0 110.349 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.453 ' HB3' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.51 2.539 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -70.6 162.26 43.13 Favored 'Trans proline' 0 N--CA 1.487 1.13 0 O-C-N 123.335 1.177 . . . . 0.0 110.772 -179.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -48.53 -32.03 7.36 Favored 'General case' 0 N--CA 1.514 2.772 0 O-C-N 121.443 -0.786 . . . . 0.0 111.402 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.12 -34.0 38.74 Favored Glycine 0 N--CA 1.499 2.867 0 O-C-N 120.938 -1.101 . . . . 0.0 110.641 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.413 ' CE2' ' HG2' ' A' ' 20' ' ' LYS . 27.2 t80 -55.19 -32.4 62.17 Favored 'General case' 0 N--CA 1.511 2.585 0 O-C-N 120.882 -1.363 . . . . 0.0 110.795 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -53.15 -37.84 62.21 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 120.975 -1.078 . . . . 0.0 110.276 179.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.5 mmtt -59.56 -36.48 76.27 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.579 -0.848 . . . . 0.0 110.213 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.421 HG21 ' OH ' ' A' ' 62' ' ' TYR . 2.2 pt -120.79 35.6 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.175 -0.953 . . . . 0.0 110.602 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -85.22 -43.11 0.66 Allowed Pre-proline 0 N--CA 1.509 2.522 0 O-C-N 121.052 -1.03 . . . . 0.0 113.561 -178.892 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.1 Cg_endo -75.37 -35.86 2.66 Favored 'Trans proline' 0 N--CA 1.486 1.051 0 O-C-N 122.521 0.748 . . . . 0.0 112.007 -177.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 79.5 m -61.83 -46.38 89.75 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 120.982 -1.074 . . . . 0.0 109.945 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.418 HD22 ' CD2' ' A' ' 86' ' ' TYR . 5.0 mt -60.8 -37.2 81.13 Favored 'General case' 0 N--CA 1.507 2.397 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.812 179.512 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 72.6 m -57.22 -36.45 70.91 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 121.066 -1.021 . . . . 0.0 110.22 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -57.4 -38.82 74.93 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.06 -1.025 . . . . 0.0 110.081 179.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.449 ' CD2' ' CD ' ' A' ' 59' ' ' ARG . 15.0 m-85 -58.24 -40.03 80.67 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.094 -1.004 . . . . 0.0 110.131 179.697 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -59.18 -24.45 63.09 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.247 -0.908 . . . . 0.0 111.406 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 2.8 mp -77.96 -36.22 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.459 0 O-C-N 120.877 -1.14 . . . . 0.0 109.851 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 44.1 tt0 -80.73 -37.18 30.99 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.006 -1.058 . . . . 0.0 109.311 178.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.74 -31.84 63.55 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.134 -0.979 . . . . 0.0 110.164 179.023 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.0 ptm85 -71.3 -36.74 71.75 Favored 'General case' 0 N--CA 1.505 2.302 0 C-N-CA 118.738 -1.185 . . . . 0.0 109.724 179.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.42 -41.4 98.71 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.069 -1.052 . . . . 0.0 109.168 179.107 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.411 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -68.62 -43.13 77.04 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.221 -0.925 . . . . 0.0 109.05 179.053 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.84 -38.36 85.22 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.312 -0.868 . . . . 0.0 109.604 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -57.7 -34.49 69.5 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 121.125 -0.984 . . . . 0.0 110.467 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.6 t70 . . . . . 0 N--CA 1.511 2.608 0 O-C-N 121.078 -1.014 . . . . 0.0 110.335 179.893 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 68.4 m . . . . . 0 N--CA 1.497 1.895 0 CA-C-O 120.63 0.252 . . . . 0.0 110.392 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -55.54 -37.88 68.54 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.202 -0.936 . . . . 0.0 110.092 179.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -60.32 -39.73 88.07 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.269 -0.894 . . . . 0.0 109.998 179.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.4 tp60 -61.73 -40.9 96.73 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.157 -0.964 . . . . 0.0 109.819 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 16.9 mt -61.12 -37.86 84.31 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.243 -0.911 . . . . 0.0 110.146 179.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 49.3 m0 -58.8 -37.75 77.05 Favored 'General case' 0 N--CA 1.511 2.596 0 O-C-N 121.146 -0.971 . . . . 0.0 110.086 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -61.81 -31.02 71.22 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.038 -1.039 . . . . 0.0 109.83 178.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.411 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 79.3 mt -71.81 -59.25 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.272 0 O-C-N 121.078 -1.014 . . . . 0.0 109.047 179.238 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -60.86 -29.45 69.54 Favored 'General case' 0 N--CA 1.509 2.523 0 C-N-CA 118.626 -1.23 . . . . 0.0 109.948 178.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -70.15 -37.82 75.33 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 120.808 -1.182 . . . . 0.0 109.136 178.277 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.422 HD22 ' CE2' ' A' ' 26' ' ' PHE . 11.7 mt -54.35 -33.02 58.16 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.146 -0.971 . . . . 0.0 110.296 179.109 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.454 ' NE2' ' N ' ' A' ' 88' ' ' ASP . 5.5 t60 -55.67 -37.33 68.14 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 120.993 -1.067 . . . . 0.0 110.205 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.442 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.0 m170 -61.48 -49.81 75.28 Favored 'General case' 0 N--CA 1.507 2.412 0 C-N-CA 119.254 -0.978 . . . . 0.0 109.332 179.231 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -60.33 -38.51 83.97 Favored 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 119.346 -0.942 . . . . 0.0 109.074 178.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.449 ' CD ' ' CD2' ' A' ' 26' ' ' PHE . 9.3 mtp180 -64.42 -51.49 62.89 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.256 -0.902 . . . . 0.0 109.315 178.753 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.0 p -60.75 -37.5 82.02 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.198 -0.939 . . . . 0.0 109.61 179.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.414 ' O ' ' OG1' ' A' ' 65' ' ' THR . 8.2 tpp180 -64.78 -39.76 94.14 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.058 -1.026 . . . . 0.0 109.442 179.17 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.421 ' OH ' HG21 ' A' ' 19' ' ' ILE . 26.6 t80 -61.58 -49.19 77.66 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.124 -0.985 . . . . 0.0 109.487 179.491 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.453 ' CG2' ' CD1' ' A' ' 78' ' ' TYR . 74.3 mt -73.34 -41.64 57.34 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.381 0 O-C-N 121.232 -0.918 . . . . 0.0 109.0 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.415 ' CE1' HG21 ' A' ' 92' ' ' ILE . 66.3 t80 -62.64 -40.44 97.0 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.309 -0.869 . . . . 0.0 109.386 179.303 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.414 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 86.7 m -66.53 -40.83 89.32 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.997 -1.064 . . . . 0.0 110.477 -179.689 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.404 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -83.2 -32.76 26.37 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 120.922 -1.111 . . . . 0.0 112.643 -178.76 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -86.28 -32.45 21.08 Favored 'General case' 0 N--CA 1.513 2.697 0 O-C-N 120.635 -1.291 . . . . 0.0 111.953 -178.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -97.98 -18.19 18.76 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.632 -1.293 . . . . 0.0 112.674 -178.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.1 mttm -118.64 -58.92 1.92 Allowed 'General case' 0 N--CA 1.503 2.187 0 O-C-N 120.574 -1.329 . . . . 0.0 110.676 179.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 -67.63 -29.25 68.51 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.204 -0.935 . . . . 0.0 110.984 -179.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.7 mttt 56.45 42.92 26.83 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 120.858 -1.151 . . . . 0.0 109.971 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.45 34.68 3.8 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.482 -0.761 . . . . 0.0 109.851 179.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.464 HD13 HG23 ' A' ' 73' ' ' ILE . 13.8 tt -152.52 162.6 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.197 -0.94 . . . . 0.0 109.753 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.0 m -108.36 144.81 35.41 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.106 -0.996 . . . . 0.0 110.434 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.4 tttp -45.9 -32.28 2.59 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.302 -0.874 . . . . 0.0 111.636 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.63 -49.67 75.65 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 120.861 -1.149 . . . . 0.0 109.312 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 37.0 tp -68.24 -44.54 75.45 Favored 'General case' 0 N--CA 1.506 2.348 0 C-N-CA 119.148 -1.021 . . . . 0.0 108.294 178.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.453 ' CD1' ' CG2' ' A' ' 63' ' ' ILE . 13.4 t80 -59.78 -37.51 79.28 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.369 -0.832 . . . . 0.0 109.471 179.091 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -71.33 -41.58 69.64 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 120.981 -1.074 . . . . 0.0 108.919 178.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.453 ' CH2' ' HB3' ' A' ' 12' ' ' ALA . 63.3 t90 -57.11 -39.59 75.38 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.172 -0.955 . . . . 0.0 109.512 179.095 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.419 ' HG ' ' CD2' ' A' ' 86' ' ' TYR . 3.7 mp -65.92 -50.85 62.96 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.222 -0.924 . . . . 0.0 109.183 179.127 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.9 mm -56.42 -34.62 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.658 0 O-C-N 121.121 -0.987 . . . . 0.0 110.02 179.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.7 mmtt -89.44 -5.8 57.06 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 120.947 -1.095 . . . . 0.0 112.526 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.429 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 45.9 mm-40 -114.99 24.16 11.95 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 120.447 -1.408 . . . . 0.0 112.05 -179.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.5 tttt 75.45 71.18 0.09 Allowed 'General case' 0 N--CA 1.512 2.657 0 O-C-N 121.159 -0.963 . . . . 0.0 111.724 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.419 ' CD2' ' HG ' ' A' ' 81' ' ' LEU . 27.2 m-85 -131.56 -62.48 0.87 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.468 -0.77 . . . . 0.0 109.255 179.29 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -136.49 175.92 9.17 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.49 -0.756 . . . . 0.0 109.528 179.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.454 ' N ' ' NE2' ' A' ' 56' ' ' HIS . 13.4 t0 -114.79 108.85 17.31 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.186 -0.946 . . . . 0.0 110.417 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 11.2 mtpp -59.02 -40.32 84.64 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.153 -0.967 . . . . 0.0 109.732 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 16.0 tp -60.08 -37.84 81.1 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.202 -0.936 . . . . 0.0 109.946 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.432 HD21 ' NE2' ' A' ' 57' ' ' HIS . 64.5 tp -68.82 -50.02 53.61 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.013 -1.054 . . . . 0.0 108.808 179.336 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.415 HG21 ' CE1' ' A' ' 64' ' ' TYR . 50.0 mt -57.85 -36.62 56.29 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.511 0 O-C-N 121.179 -0.951 . . . . 0.0 108.803 178.41 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.31 -39.7 89.47 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.178 -0.951 . . . . 0.0 109.244 178.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.43 ' HD2' ' CE2' ' A' ' 100' ' ' TYR . 7.0 mmtt -57.8 -46.1 85.13 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.088 -1.008 . . . . 0.0 109.395 179.313 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.1 m0 -58.24 -25.67 61.99 Favored 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 119.186 -1.006 . . . . 0.0 110.484 179.375 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.7 24.46 12.88 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 120.927 -1.108 . . . . 0.0 111.461 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.6 mmtt -92.52 -83.44 0.3 Allowed 'General case' 0 N--CA 1.505 2.284 0 O-C-N 120.694 -1.254 . . . . 0.0 109.897 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 5.9 t -177.52 128.88 0.15 Allowed 'General case' 0 N--CA 1.506 2.358 0 O-C-N 120.843 -1.161 . . . . 0.0 110.764 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.21 11.81 79.48 Favored Glycine 0 N--CA 1.492 2.376 0 C-N-CA 120.131 -1.033 . . . . 0.0 111.551 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.43 ' CE2' ' HD2' ' A' ' 94' ' ' LYS . 20.0 m-85 -100.5 46.88 0.94 Allowed 'General case' 0 N--CA 1.504 2.261 0 CA-C-N 119.746 1.773 . . . . 0.0 110.239 179.389 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -62.93 -39.96 96.19 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.163 -0.961 . . . . 0.0 109.539 179.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.422 ' HB2' ' OG ' ' A' ' 155' ' ' SER . 1.0 OUTLIER -111.94 100.45 8.9 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.215 -0.928 . . . . 0.0 109.684 179.358 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 9.6 tp -137.41 132.63 33.73 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.226 -0.921 . . . . 0.0 109.925 -179.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.442 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.0 p -109.5 -37.53 5.69 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.286 -0.883 . . . . 0.0 112.197 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.585 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.4 m -140.57 -168.03 2.48 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 120.355 -1.466 . . . . 0.0 110.001 179.018 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 12.5 mt -97.41 -38.38 9.64 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.007 -1.058 . . . . 0.0 110.489 179.277 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 26.8 ttt85 -102.21 31.64 3.88 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 120.995 -1.066 . . . . 0.0 109.614 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.585 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.305 1.7 t -126.94 15.47 7.4 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.193 -0.942 . . . . 0.0 109.003 -179.279 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.1 pt -158.59 36.87 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.361 0 O-C-N 120.799 -1.188 . . . . 0.0 110.844 -178.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 . . . . . 0 N--CA 1.5 2.075 0 O-C-N 120.735 -1.228 . . . . 0.0 111.563 -178.673 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.497 1.918 0 CA-C-O 120.855 0.359 . . . . 0.0 110.353 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 44.4 t -105.02 155.26 19.13 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.409 -0.807 . . . . 0.0 109.575 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.444 HD12 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -70.47 -36.28 65.63 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 121.151 -0.968 . . . . 0.0 110.872 -179.374 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.475 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.9 p -54.83 -32.49 60.53 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 120.809 -1.182 . . . . 0.0 110.932 -179.153 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.26 -34.87 75.87 Favored 'General case' 0 N--CA 1.509 2.525 0 O-C-N 120.986 -1.071 . . . . 0.0 109.415 178.047 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 48.4 t -79.84 126.0 81.0 Favored Pre-proline 0 N--CA 1.504 2.267 0 O-C-N 121.109 -0.994 . . . . 0.0 109.707 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -65.65 172.3 8.3 Favored 'Trans proline' 0 N--CA 1.489 1.255 0 O-C-N 123.159 1.083 . . . . 0.0 110.795 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.1 -37.55 61.47 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.287 -0.883 . . . . 0.0 110.548 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.68 -41.0 80.71 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.071 -1.018 . . . . 0.0 110.044 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -69.48 -41.58 75.98 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.175 -0.953 . . . . 0.0 109.187 179.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.9 mt -65.86 -39.26 90.56 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.258 -0.901 . . . . 0.0 109.455 179.088 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -60.93 -39.69 90.42 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.199 -0.938 . . . . 0.0 109.829 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -59.62 -38.14 80.51 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.208 -0.933 . . . . 0.0 110.188 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -61.16 -44.61 97.04 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.209 -0.932 . . . . 0.0 109.929 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.27 -41.53 93.49 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.103 -0.998 . . . . 0.0 109.961 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.57 -35.37 72.26 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.187 -0.946 . . . . 0.0 110.322 179.652 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 21.3 mttm -71.74 -32.55 67.86 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.088 -1.007 . . . . 0.0 110.94 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 33.8 mttm -98.26 19.35 14.41 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.923 -1.111 . . . . 0.0 111.829 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 54.56 43.59 78.28 Favored Glycine 0 N--CA 1.498 2.825 0 O-C-N 120.591 -1.318 . . . . 0.0 110.502 179.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 7.3 t -142.88 -164.78 1.91 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.127 -1.219 . . . . 0.0 110.088 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.5 mp0 -138.25 149.57 45.87 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.193 -0.942 . . . . 0.0 110.407 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.5 p -131.86 161.49 41.19 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.165 -0.96 . . . . 0.0 109.949 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 29.1 t -165.79 88.88 0.41 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.164 -0.96 . . . . 0.0 111.167 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.475 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 47.1 t80 -97.58 159.9 14.65 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.317 -0.864 . . . . 0.0 110.239 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 53.4 m-70 -137.11 -61.6 0.65 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.482 -0.761 . . . . 0.0 109.001 179.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -133.63 151.96 51.79 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.41 -0.806 . . . . 0.0 108.912 178.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 31.2 p -92.92 153.19 18.93 Favored 'General case' 0 N--CA 1.504 2.243 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.179 -179.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 27.0 m -71.64 -25.94 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 O-C-N 121.396 -0.815 . . . . 0.0 111.387 -179.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -50.65 -55.42 16.49 Favored 'General case' 0 N--CA 1.515 2.779 0 O-C-N 120.764 -1.21 . . . . 0.0 110.079 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 25.5 p -130.96 -165.64 1.59 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.276 -0.89 . . . . 0.0 110.566 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.77 56.61 0.76 Allowed Glycine 0 N--CA 1.493 2.457 0 N-CA-C 107.961 -2.056 . . . . 0.0 107.961 178.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 17.7 t -99.99 142.25 31.72 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.374 -1.074 . . . . 0.0 109.85 -179.225 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 5.2 mtt-85 -95.46 53.69 1.51 Allowed 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.301 -0.874 . . . . 0.0 109.593 179.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 64.5 96.68 0.02 OUTLIER Glycine 0 N--CA 1.487 2.087 0 N-CA-C 109.915 -1.274 . . . . 0.0 109.915 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 26.2 p -106.3 124.8 50.15 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.311 -1.111 . . . . 0.0 110.048 179.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -134.59 135.31 42.12 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.131 -0.981 . . . . 0.0 110.1 -179.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 155' ' ' SER . . . . . 0.422 ' OG ' ' HB2' ' A' ' 102' ' ' LYS . 0.7 OUTLIER . . . . . 0 N--CA 1.497 1.922 0 O-C-N 121.231 -0.918 . . . . 0.0 109.855 179.647 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.429 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.502 2.147 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.31 162.01 43.84 Favored 'Trans proline' 0 C--N 1.317 -1.109 0 O-C-N 123.335 1.176 . . . . 0.0 110.833 -179.421 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -48.79 -31.92 7.82 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.476 -0.765 . . . . 0.0 111.358 -179.828 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.5 -34.95 43.5 Favored Glycine 0 N--CA 1.498 2.825 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 179.776 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -55.95 -33.45 64.76 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 121.057 -1.261 . . . . 0.0 110.656 179.814 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -53.9 -37.94 64.29 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.085 -1.01 . . . . 0.0 110.149 179.693 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 44.1 mmtt -59.55 -37.38 78.26 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.268 -0.895 . . . . 0.0 110.045 179.504 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.452 ' CG2' ' OH ' ' A' ' 62' ' ' TYR . 2.1 pt -116.37 35.29 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.182 -0.949 . . . . 0.0 110.552 179.814 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.423 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 4.5 tttt -84.38 -42.89 0.73 Allowed Pre-proline 0 N--CA 1.509 2.491 0 O-C-N 121.136 -0.977 . . . . 0.0 113.334 -179.163 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.0 Cg_endo -75.44 -35.17 2.99 Favored 'Trans proline' 0 N--CA 1.486 1.073 0 O-C-N 122.467 0.72 . . . . 0.0 111.805 -178.138 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 85.4 m -61.62 -46.79 88.32 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 120.932 -1.105 . . . . 0.0 109.896 -179.875 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.1 mt -62.58 -39.61 94.24 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 119.4 -0.92 . . . . 0.0 109.605 179.446 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.7 m -57.62 -35.69 70.81 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 121.123 -0.985 . . . . 0.0 110.256 179.524 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -57.6 -36.42 71.72 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 121.089 -1.007 . . . . 0.0 110.287 179.756 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.424 ' CD1' ' HD2' ' A' ' 59' ' ' ARG . 16.7 m-85 -57.42 -39.98 77.34 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.062 -1.024 . . . . 0.0 110.323 179.994 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -60.38 -23.28 64.19 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.224 -0.922 . . . . 0.0 111.514 -179.668 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 2.8 mp -81.18 -34.2 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.347 0 O-C-N 120.776 -1.202 . . . . 0.0 109.738 179.655 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.6 tp60 -80.96 -36.32 31.02 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.948 -1.095 . . . . 0.0 109.453 178.752 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.12 -31.83 61.23 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.131 -0.981 . . . . 0.0 109.96 178.913 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -70.17 -36.15 74.48 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 120.865 -1.147 . . . . 0.0 109.745 179.196 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.33 -41.85 93.54 Favored 'General case' 0 N--CA 1.507 2.387 0 C-N-CA 119.145 -1.022 . . . . 0.0 109.329 179.407 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.401 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -69.06 -42.16 76.63 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.301 -0.874 . . . . 0.0 109.53 179.323 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -68.67 -30.89 69.67 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.344 -0.847 . . . . 0.0 110.435 179.575 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.1 mtpt -92.07 -31.46 15.54 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 120.99 -1.068 . . . . 0.0 111.088 -179.971 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.1 t70 . . . . . 0 N--CA 1.513 2.692 0 O-C-N 120.838 -1.164 . . . . 0.0 110.309 -179.972 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.502 2.128 0 CA-C-O 120.596 0.236 . . . . 0.0 110.693 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -58.0 -39.32 77.98 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 121.077 -1.014 . . . . 0.0 110.115 -179.935 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -59.68 -40.02 86.47 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.158 -0.964 . . . . 0.0 110.128 179.943 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 51.3 tp60 -59.5 -39.56 84.2 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.063 -1.023 . . . . 0.0 110.186 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -59.62 -39.66 85.01 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.137 -0.977 . . . . 0.0 110.181 -179.923 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.431 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.3 m0 -59.14 -37.19 76.68 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.186 -0.947 . . . . 0.0 110.164 179.827 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -59.94 -30.95 69.42 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.015 -1.053 . . . . 0.0 110.139 179.119 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.401 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 77.6 mt -71.28 -58.4 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.286 0 O-C-N 120.989 -1.069 . . . . 0.0 109.102 179.355 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.1 ptm -62.84 -29.94 71.12 Favored 'General case' 0 N--CA 1.507 2.408 0 C-N-CA 118.646 -1.221 . . . . 0.0 109.883 178.851 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.6 mm100 -69.43 -36.82 77.05 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.867 -1.146 . . . . 0.0 109.157 178.117 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.421 HD23 ' CE2' ' A' ' 26' ' ' PHE . 11.4 mt -53.24 -32.16 46.93 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.018 -1.052 . . . . 0.0 110.196 179.032 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.459 ' NE2' ' CB ' ' A' ' 88' ' ' ASP . 41.2 t60 -54.6 -39.76 68.18 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.09 -1.006 . . . . 0.0 110.07 179.859 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.428 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 4.9 m170 -62.41 -49.15 76.63 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.668 179.213 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -59.22 -36.23 75.05 Favored 'General case' 0 N--CA 1.508 2.438 0 C-N-CA 119.355 -0.938 . . . . 0.0 109.523 179.154 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.424 ' HD2' ' CD1' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -68.71 -52.09 34.58 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.085 -1.009 . . . . 0.0 108.761 178.769 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 91.7 p -61.21 -38.57 87.05 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.268 -0.895 . . . . 0.0 109.263 178.862 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 57.6 ttp85 -64.05 -38.49 91.26 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.094 -1.004 . . . . 0.0 109.456 179.028 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.452 ' OH ' ' CG2' ' A' ' 19' ' ' ILE . 48.1 t80 -60.31 -47.2 87.03 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.083 -1.011 . . . . 0.0 109.617 179.565 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.431 HG23 HD12 ' A' ' 63' ' ' ILE . 82.8 mt -77.77 -42.47 28.93 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.365 0 O-C-N 121.242 -0.911 . . . . 0.0 109.098 179.16 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.419 ' CE1' HG22 ' A' ' 92' ' ' ILE . 18.7 t80 -61.35 -23.37 65.7 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.354 -0.841 . . . . 0.0 110.659 179.01 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 97.2 m -91.02 -38.78 12.59 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.643 -1.286 . . . . 0.0 110.198 179.831 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.448 ' CD2' ' CE1' ' A' ' 62' ' ' TYR . 3.5 pp -83.04 -30.28 28.19 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.893 -1.13 . . . . 0.0 111.924 -179.429 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.436 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 39.9 t80 -86.25 -35.96 19.68 Favored 'General case' 0 N--CA 1.511 2.591 0 O-C-N 120.573 -1.329 . . . . 0.0 111.467 -179.81 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.403 ' CD2' ' CD1' ' A' ' 64' ' ' TYR . 15.1 m-85 -94.08 -29.88 14.96 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.828 -1.17 . . . . 0.0 112.422 -178.158 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.8 mtpp -105.52 -59.46 1.76 Allowed 'General case' 0 N--CA 1.504 2.268 0 O-C-N 120.684 -1.26 . . . . 0.0 110.42 -179.81 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 29.9 ttt85 -57.13 -33.27 67.21 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 121.109 -0.994 . . . . 0.0 110.366 -179.996 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.6 mttt 57.47 45.84 18.99 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.887 -1.133 . . . . 0.0 110.328 179.965 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -111.11 -57.17 2.28 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.372 -0.83 . . . . 0.0 109.38 179.289 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.481 HD13 HG22 ' A' ' 73' ' ' ILE . 15.1 tt -56.17 162.21 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.574 0 O-C-N 121.443 -0.786 . . . . 0.0 110.121 179.533 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.8 t -111.62 149.76 31.06 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.07 -1.019 . . . . 0.0 109.921 179.106 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.39 -32.71 1.42 Allowed 'General case' 0 N--CA 1.517 2.902 0 O-C-N 121.282 -0.886 . . . . 0.0 111.984 -179.709 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -61.68 -50.94 70.48 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 120.941 -1.099 . . . . 0.0 109.36 179.635 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 52.1 tp -67.96 -42.88 80.22 Favored 'General case' 0 N--CA 1.506 2.345 0 C-N-CA 119.139 -1.024 . . . . 0.0 108.466 178.727 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.436 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 21.8 t80 -60.1 -38.54 83.28 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.324 -0.86 . . . . 0.0 109.479 178.869 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -70.58 -42.67 70.74 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.067 -1.021 . . . . 0.0 108.73 178.745 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.429 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 72.0 t90 -59.03 -38.41 79.24 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.262 -0.899 . . . . 0.0 109.545 178.926 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.451 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 11.8 mt -64.86 -51.27 62.95 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.167 -0.958 . . . . 0.0 109.519 179.365 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.41 HG21 HD12 ' A' ' 82' ' ' ILE . 34.4 mm -57.75 -33.13 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.592 0 O-C-N 121.169 -0.957 . . . . 0.0 110.102 179.645 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -89.23 -9.03 52.27 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 120.898 -1.126 . . . . 0.0 112.437 -179.862 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.428 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 4.3 mm-40 -111.16 22.11 15.6 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 120.449 -1.407 . . . . 0.0 111.974 -179.984 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.4 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 0.0 OUTLIER 74.94 73.58 0.1 Allowed 'General case' 0 N--CA 1.51 2.562 0 O-C-N 121.031 -1.043 . . . . 0.0 111.66 179.451 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.451 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 32.6 m-85 -134.2 -62.8 0.74 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.557 -0.715 . . . . 0.0 109.215 179.456 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -131.16 163.04 28.59 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.478 -0.764 . . . . 0.0 109.248 179.313 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.459 ' CB ' ' NE2' ' A' ' 56' ' ' HIS . 30.7 t0 -111.27 118.27 35.43 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.084 -1.01 . . . . 0.0 110.314 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -57.67 -35.76 71.02 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 121.34 -0.85 . . . . 0.0 110.194 179.72 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.9 tp -60.68 -38.51 85.19 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.121 -0.987 . . . . 0.0 109.684 179.481 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.444 ' CD1' ' CZ3' ' A' ' 95' ' ' TRP . 0.3 OUTLIER -66.56 -56.71 9.5 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.085 -1.009 . . . . 0.0 108.829 179.078 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.419 HG22 ' CE1' ' A' ' 64' ' ' TYR . 38.8 mt -61.0 -33.74 57.03 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.416 0 C-N-CA 119.339 -0.944 . . . . 0.0 109.165 178.851 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.24 -41.1 86.2 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 120.985 -1.072 . . . . 0.0 109.239 178.854 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 10.0 mmtm -57.62 -44.25 85.38 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.177 -0.952 . . . . 0.0 109.49 179.387 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.444 ' CZ3' ' CD1' ' A' ' 91' ' ' LEU . 2.3 m0 -59.05 -26.37 64.54 Favored 'General case' 0 N--CA 1.508 2.44 0 C-N-CA 119.148 -1.021 . . . . 0.0 110.786 179.165 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.18 -35.51 25.43 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 120.736 -1.227 . . . . 0.0 110.671 179.587 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -51.1 175.79 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.803 0 O-C-N 121.025 -1.047 . . . . 0.0 110.831 179.89 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 60.8 m -103.79 138.83 39.85 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.168 -0.957 . . . . 0.0 109.487 179.219 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 103.47 -29.15 12.87 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.84 -1.304 . . . . 0.0 109.84 -178.881 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -94.43 58.16 2.37 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.867 -1.372 . . . . 0.0 109.898 179.658 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -73.0 -38.76 66.49 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.026 -1.046 . . . . 0.0 109.864 179.717 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.01 73.86 1.05 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.157 -0.964 . . . . 0.0 110.143 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.1 pp -110.1 148.77 31.1 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.068 -1.02 . . . . 0.0 110.149 179.941 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.428 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.7 p -110.21 -30.08 7.89 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.238 -0.914 . . . . 0.0 112.997 -179.727 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.544 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.3 m -143.56 -168.13 2.75 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 120.256 -1.527 . . . . 0.0 109.884 179.159 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.4 mt -96.73 -38.14 10.02 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.088 -1.007 . . . . 0.0 110.066 178.986 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 18.0 ttp180 -102.45 30.56 4.53 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 120.972 -1.08 . . . . 0.0 109.826 178.051 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.544 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.304 1.8 t -128.65 18.43 6.27 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.11 -0.994 . . . . 0.0 108.97 -179.575 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.7 pt -156.39 36.81 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.158 0 O-C-N 120.78 -1.2 . . . . 0.0 110.493 -178.631 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.413 ' O ' ' OG1' ' A' ' 119' ' ' THR . 9.5 tt0 . . . . . 0 N--CA 1.51 2.554 0 O-C-N 120.995 -1.066 . . . . 0.0 110.788 -178.854 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.413 ' OG1' ' O ' ' A' ' 110' ' ' GLN . 7.1 m . . . . . 0 N--CA 1.494 1.774 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 41.5 t -82.21 153.93 25.7 Favored 'General case' 0 N--CA 1.501 2.109 0 C-N-CA 119.321 -0.952 . . . . 0.0 108.802 178.766 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.443 HG21 ' CE1' ' A' ' 142' ' ' PHE . 14.1 tt -81.11 -29.33 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 O-C-N 121.047 -1.033 . . . . 0.0 112.448 -178.787 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.493 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 14.4 p -53.97 -35.14 61.47 Favored 'General case' 0 N--CA 1.512 2.647 0 O-C-N 120.707 -1.246 . . . . 0.0 110.658 -178.736 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -58.54 -26.85 63.98 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.118 -0.988 . . . . 0.0 109.836 177.707 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 48.9 t -73.89 118.24 67.74 Favored Pre-proline 0 N--CA 1.509 2.48 0 O-C-N 120.866 -1.146 . . . . 0.0 110.584 179.975 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . 0.419 ' HB3' ' CB ' ' A' ' 154' ' ' ALA . 37.4 Cg_endo -64.79 168.11 14.15 Favored 'Trans proline' 0 N--CA 1.489 1.224 0 O-C-N 123.026 1.013 . . . . 0.0 110.553 178.611 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.18 -38.81 60.67 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.203 -0.935 . . . . 0.0 110.189 179.971 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.28 -40.65 82.48 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.034 -1.041 . . . . 0.0 110.053 -179.811 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 -67.08 -41.1 86.96 Favored 'General case' 0 N--CA 1.507 2.42 0 C-N-CA 119.359 -0.936 . . . . 0.0 109.399 179.46 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 5.4 mt -64.27 -40.66 96.43 Favored 'General case' 0 N--CA 1.507 2.389 0 C-N-CA 119.446 -0.902 . . . . 0.0 109.552 179.318 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.68 -39.91 86.1 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.16 -0.962 . . . . 0.0 109.936 179.78 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -60.93 -40.02 91.67 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.148 -0.97 . . . . 0.0 109.964 179.781 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -62.19 -41.92 98.8 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.201 -0.937 . . . . 0.0 109.872 179.797 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.37 -41.6 97.34 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.215 -0.928 . . . . 0.0 109.886 179.955 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 6.9 mmt85 -59.65 -38.55 81.72 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.143 -0.973 . . . . 0.0 109.991 179.658 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 13.9 mttp -61.63 -35.68 78.61 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.18 -0.95 . . . . 0.0 110.567 -179.902 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -105.45 21.68 16.77 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.007 -1.058 . . . . 0.0 111.836 -179.913 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.39 46.06 58.14 Favored Glycine 0 N--CA 1.498 2.812 0 O-C-N 120.641 -1.287 . . . . 0.0 110.773 179.315 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.5 t -138.74 -165.31 1.8 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.113 -1.228 . . . . 0.0 110.189 179.747 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.4 mp0 -133.34 167.72 19.88 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.188 -0.945 . . . . 0.0 110.471 -179.896 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 8.6 p -159.82 161.14 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.041 0 O-C-N 121.336 -0.853 . . . . 0.0 110.646 -179.981 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 38.8 t -169.05 113.92 0.57 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.18 -0.95 . . . . 0.0 111.256 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.493 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 85.1 t80 -102.97 158.79 16.04 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.234 -0.916 . . . . 0.0 110.156 179.586 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 15.2 m80 -137.17 -61.54 0.65 Allowed 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.822 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -148.01 149.33 31.93 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.576 -0.702 . . . . 0.0 109.247 178.81 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 26.3 p -93.67 155.24 17.37 Favored 'General case' 0 N--CA 1.505 2.275 0 C-N-CA 119.038 -1.065 . . . . 0.0 110.813 -179.485 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.9 p -71.86 -25.15 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.493 0 O-C-N 121.287 -0.883 . . . . 0.0 111.77 -179.252 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -50.25 -59.78 3.62 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 120.832 -1.168 . . . . 0.0 110.171 -179.898 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.431 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.8 p -126.95 -165.11 1.42 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.213 -0.929 . . . . 0.0 110.491 179.424 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . 0.421 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.51 60.99 0.65 Allowed Glycine 0 N--CA 1.492 2.38 0 N-CA-C 107.945 -2.062 . . . . 0.0 107.945 178.3 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 16.9 t -99.15 138.69 35.9 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.353 -1.087 . . . . 0.0 109.64 -179.182 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.63 49.45 1.03 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.23 -0.919 . . . . 0.0 109.882 179.398 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 75.16 93.58 0.16 Allowed Glycine 0 N--CA 1.488 2.156 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 179.757 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.4 p -104.83 127.25 52.58 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.237 -1.154 . . . . 0.0 109.665 179.107 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . 0.419 ' CB ' ' HB3' ' A' ' 125' ' ' PRO . . . -153.98 149.51 27.31 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.052 -1.03 . . . . 0.0 110.554 -179.057 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.502 2.141 0 O-C-N 121.269 -0.895 . . . . 0.0 110.422 179.949 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.435 ' HB3' ' CE3' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.503 2.212 0 CA-C-O 120.466 0.174 . . . . 0.0 110.62 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -74.02 161.11 41.79 Favored 'Trans proline' 0 N--CA 1.485 1.0 0 O-C-N 123.192 1.101 . . . . 0.0 110.611 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -49.15 -31.81 8.97 Favored 'General case' 0 N--CA 1.515 2.815 0 O-C-N 121.431 -0.793 . . . . 0.0 111.318 -179.82 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.2 -33.37 45.42 Favored Glycine 0 N--CA 1.499 2.851 0 O-C-N 121.031 -1.043 . . . . 0.0 110.635 179.855 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -54.18 -32.01 54.32 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 120.962 -1.317 . . . . 0.0 110.766 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -54.93 -37.34 66.29 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 121.037 -1.04 . . . . 0.0 110.242 179.868 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.8 mtpp -57.68 -35.39 70.52 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.152 -0.968 . . . . 0.0 110.359 179.588 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 3.1 pt -116.26 36.73 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.15 -0.969 . . . . 0.0 110.428 179.592 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.441 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -82.53 -43.03 0.95 Allowed Pre-proline 0 N--CA 1.508 2.459 0 O-C-N 121.078 -1.014 . . . . 0.0 113.003 -179.436 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.441 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.2 Cg_endo -76.14 -34.73 2.74 Favored 'Trans proline' 0 N--CA 1.486 1.07 0 O-C-N 122.571 0.774 . . . . 0.0 111.875 -178.366 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.442 ' CG2' ' CE2' ' A' ' 62' ' ' TYR . 91.4 m -61.3 -47.99 83.41 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.885 -1.135 . . . . 0.0 109.833 -179.762 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.8 mt -62.07 -40.21 95.03 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.465 179.555 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.7 m -57.56 -35.41 70.31 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.155 -0.966 . . . . 0.0 110.187 179.229 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -56.72 -37.9 71.62 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.041 -1.037 . . . . 0.0 110.128 179.691 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.422 ' CD2' ' HD3' ' A' ' 59' ' ' ARG . 14.1 m-85 -58.69 -39.05 79.64 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.101 -1.0 . . . . 0.0 110.284 179.965 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -59.81 -40.14 87.38 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.17 -0.956 . . . . 0.0 110.362 -179.512 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.2 mp -65.65 -42.07 91.94 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.376 0 C-N-CA 119.12 -1.032 . . . . 0.0 108.668 179.48 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.7 tp60 -68.03 -50.99 51.99 Favored 'General case' 0 N--CA 1.506 2.337 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 178.494 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.6 tp -59.09 -36.28 74.84 Favored 'General case' 0 N--CA 1.509 2.516 0 C-N-CA 119.546 -0.861 . . . . 0.0 109.471 178.403 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.6 mtt85 -57.93 -37.79 74.73 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.124 -0.985 . . . . 0.0 110.333 179.675 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -62.74 -50.42 71.14 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.094 -1.003 . . . . 0.0 109.748 -179.636 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.405 ' HB1' ' CG1' ' A' ' 52' ' ' ILE . . . -71.46 -40.0 70.58 Favored 'General case' 0 N--CA 1.503 2.188 0 C-N-CA 118.829 -1.149 . . . . 0.0 108.827 178.796 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -62.1 -32.7 73.28 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.21 -0.931 . . . . 0.0 110.246 179.207 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.3 mtpt -96.42 -35.85 11.02 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 120.934 -1.104 . . . . 0.0 111.065 -179.818 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 . . . . . 0 N--CA 1.511 2.612 0 O-C-N 120.955 -1.09 . . . . 0.0 110.359 179.975 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 5.6 m . . . . . 0 N--CA 1.503 2.187 0 CA-C-O 120.525 0.202 . . . . 0.0 110.578 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.417 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 34.7 m120 -60.28 -45.03 94.75 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.126 -0.984 . . . . 0.0 109.828 179.937 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -60.16 -44.89 94.65 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.144 -0.973 . . . . 0.0 109.708 179.867 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.56 -43.78 92.85 Favored 'General case' 0 N--CA 1.506 2.375 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.272 179.29 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 20.6 mt -61.46 -35.65 78.21 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.332 -0.855 . . . . 0.0 110.185 179.818 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.446 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 49.4 m0 -58.7 -39.28 80.31 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 120.962 -1.086 . . . . 0.0 109.742 179.762 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -62.16 -31.25 71.72 Favored 'General case' 0 N--CA 1.504 2.257 0 C-N-CA 119.144 -1.022 . . . . 0.0 109.715 178.409 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.405 ' CG1' ' HB1' ' A' ' 33' ' ' ALA . 17.8 mt -71.81 -58.19 5.68 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.145 0 O-C-N 120.93 -1.106 . . . . 0.0 109.157 179.298 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.0 ptm -61.48 -29.58 70.06 Favored 'General case' 0 N--CA 1.508 2.458 0 C-N-CA 118.57 -1.252 . . . . 0.0 109.787 178.81 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -69.11 -38.17 78.78 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 120.793 -1.192 . . . . 0.0 109.009 178.078 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 11.1 mt -53.34 -32.05 47.33 Favored 'General case' 0 N--CA 1.513 2.681 0 O-C-N 120.951 -1.093 . . . . 0.0 110.163 178.963 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.467 ' NE2' ' CB ' ' A' ' 88' ' ' ASP . 67.6 t60 -56.19 -38.9 71.6 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.061 -1.025 . . . . 0.0 110.24 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.405 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 7.4 m170 -60.13 -47.99 83.61 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.103 -0.998 . . . . 0.0 109.449 179.361 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -60.38 -35.88 76.77 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.262 -0.899 . . . . 0.0 109.651 178.974 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.422 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -64.97 -49.11 71.61 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.045 -1.034 . . . . 0.0 109.615 179.385 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.7 p -62.77 -38.56 91.09 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.139 -0.976 . . . . 0.0 109.409 179.329 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.421 ' O ' ' OG1' ' A' ' 65' ' ' THR . 19.5 ttt85 -63.13 -40.31 97.22 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.064 -1.022 . . . . 0.0 109.342 179.281 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.442 ' CE2' ' CG2' ' A' ' 22' ' ' THR . 43.0 t80 -62.35 -50.87 69.86 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.181 -0.949 . . . . 0.0 109.379 179.506 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 86.9 mt -69.5 -39.53 78.67 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.345 0 C-N-CA 119.271 -0.972 . . . . 0.0 109.126 179.351 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 9.5 t80 -64.48 -42.39 95.92 Favored 'General case' 0 N--CA 1.503 2.216 0 C-N-CA 119.409 -0.917 . . . . 0.0 109.055 179.022 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.421 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 87.4 m -60.89 -42.01 97.14 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.055 -1.028 . . . . 0.0 110.5 -179.575 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.406 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -83.29 -33.16 26.03 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 118.923 -1.111 . . . . 0.0 112.759 -178.766 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.422 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 51.0 t80 -86.32 -32.43 21.04 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 120.599 -1.313 . . . . 0.0 111.734 -179.363 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -98.38 -16.75 19.17 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 120.827 -1.171 . . . . 0.0 112.713 -178.872 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.8 mttt -124.15 -59.31 1.5 Allowed 'General case' 0 N--CA 1.501 2.114 0 O-C-N 120.46 -1.4 . . . . 0.0 111.008 179.79 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 4.8 tpt180 -61.87 -30.21 70.71 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.147 -0.971 . . . . 0.0 110.825 -179.649 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.2 tttp 57.87 42.05 23.75 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 120.754 -1.216 . . . . 0.0 110.093 -179.592 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.38 35.72 3.88 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.369 -0.832 . . . . 0.0 109.952 179.303 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.471 HG21 HD11 ' A' ' 73' ' ' ILE . 14.0 tt -154.64 162.37 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 O-C-N 121.214 -0.929 . . . . 0.0 109.905 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.8 m -110.02 147.82 32.83 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.172 -0.955 . . . . 0.0 110.18 179.791 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.9 ttmt -45.42 -32.27 2.06 Favored 'General case' 0 N--CA 1.516 2.835 0 O-C-N 121.401 -0.812 . . . . 0.0 111.656 -179.971 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -62.25 -50.99 69.54 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 120.938 -1.101 . . . . 0.0 109.3 179.559 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 50.1 tp -65.63 -46.03 80.82 Favored 'General case' 0 N--CA 1.505 2.306 0 C-N-CA 119.106 -1.038 . . . . 0.0 108.481 178.959 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.422 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 18.8 t80 -59.8 -38.98 83.47 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.276 -0.89 . . . . 0.0 109.545 179.224 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -72.73 -42.14 64.41 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.112 -0.993 . . . . 0.0 108.971 178.933 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.435 ' CE3' ' HB3' ' A' ' 12' ' ' ALA . 83.0 t90 -57.48 -37.27 72.64 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.218 -0.927 . . . . 0.0 109.717 179.091 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.477 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 62.9 mt -68.5 -48.12 65.22 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.19 -0.944 . . . . 0.0 108.981 179.149 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.4 mm -56.01 -33.36 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.56 0 O-C-N 121.206 -0.934 . . . . 0.0 109.941 179.374 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -89.29 -16.23 31.65 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.004 -1.06 . . . . 0.0 112.082 179.929 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.423 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 8.4 mm-40 -102.88 21.61 15.29 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.547 -1.345 . . . . 0.0 112.05 -179.829 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 17.1 tttp 75.54 72.04 0.09 Allowed 'General case' 0 N--CA 1.511 2.599 0 O-C-N 121.201 -0.937 . . . . 0.0 111.735 179.443 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.477 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 33.9 m-85 -134.2 -62.89 0.74 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.519 -0.738 . . . . 0.0 109.119 179.267 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -129.09 160.15 33.72 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.507 -0.745 . . . . 0.0 109.4 179.243 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.467 ' CB ' ' NE2' ' A' ' 56' ' ' HIS . 8.2 t70 -107.61 115.25 29.82 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.035 -1.041 . . . . 0.0 110.346 -179.866 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -58.64 -37.22 75.47 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.255 -0.903 . . . . 0.0 110.03 179.668 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.1 tp -60.79 -38.79 86.5 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.124 -0.985 . . . . 0.0 109.601 179.504 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.455 ' CD1' ' CZ3' ' A' ' 95' ' ' TRP . 0.3 OUTLIER -65.13 -55.54 18.1 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.094 -1.004 . . . . 0.0 108.856 179.155 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.405 HD13 HG21 ' A' ' 92' ' ' ILE . 57.7 mt -61.67 -36.97 76.75 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.41 0 C-N-CA 119.401 -0.919 . . . . 0.0 109.038 178.974 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.74 -39.3 90.99 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.164 -0.96 . . . . 0.0 109.428 178.891 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.419 ' HD2' ' CE1' ' A' ' 100' ' ' TYR . 12.8 mmtm -59.36 -43.94 92.78 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.115 -0.99 . . . . 0.0 109.635 179.543 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.455 ' CZ3' ' CD1' ' A' ' 91' ' ' LEU . 2.9 m0 -63.86 -33.86 76.65 Favored 'General case' 0 N--CA 1.51 2.526 0 C-N-CA 119.311 -0.956 . . . . 0.0 110.343 179.461 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.54 -30.49 29.69 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.043 -1.036 . . . . 0.0 110.993 179.722 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -54.15 -176.57 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.68 0 O-C-N 120.912 -1.118 . . . . 0.0 110.601 179.87 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -104.16 136.54 43.59 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.16 -0.962 . . . . 0.0 109.874 179.296 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 94.09 13.17 55.28 Favored Glycine 0 N--CA 1.494 2.501 0 C-N-CA 120.295 -0.955 . . . . 0.0 110.938 -179.418 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.419 ' CE1' ' HD2' ' A' ' 94' ' ' LYS . 49.6 m-85 -120.14 71.34 0.9 Allowed 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 119.322 1.561 . . . . 0.0 110.003 179.748 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -92.84 -36.66 12.71 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.08 -1.012 . . . . 0.0 110.474 179.89 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.28 76.94 1.52 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.051 -1.031 . . . . 0.0 110.698 -179.854 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.2 pp -122.58 147.34 46.52 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.06 -1.025 . . . . 0.0 109.957 179.536 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.405 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.6 p -111.58 -32.06 6.8 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 119.491 -0.884 . . . . 0.0 112.988 -179.447 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.536 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.1 m -142.22 -168.15 2.65 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 120.26 -1.525 . . . . 0.0 110.156 179.246 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.2 mt -95.97 -38.26 10.31 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.153 -0.967 . . . . 0.0 110.021 179.018 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 18.0 ttt85 -102.46 30.83 4.37 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.958 -1.089 . . . . 0.0 109.721 178.109 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.536 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.311 1.8 t -130.51 20.07 5.19 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.168 -0.958 . . . . 0.0 108.746 -179.429 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 2.1 pt -156.63 38.17 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 O-C-N 120.938 -1.101 . . . . 0.0 110.107 -178.574 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.419 ' O ' ' OG1' ' A' ' 119' ' ' THR . 31.0 mt-30 . . . . . 0 N--CA 1.508 2.474 0 O-C-N 120.953 -1.092 . . . . 0.0 110.869 -178.639 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.419 ' OG1' ' O ' ' A' ' 110' ' ' GLN . 1.6 m . . . . . 0 N--CA 1.5 2.03 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 43.0 t -70.27 153.23 43.3 Favored 'General case' 0 N--CA 1.501 2.087 0 C-N-CA 118.895 -1.122 . . . . 0.0 108.244 178.527 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.454 ' CD1' ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -70.41 -31.74 47.78 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.391 0 O-C-N 121.072 -1.017 . . . . 0.0 111.523 -178.667 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.512 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.4 p -60.95 -35.98 78.18 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 120.701 -1.249 . . . . 0.0 110.28 -179.8 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 23.5 tpt85 -57.31 -36.93 71.71 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 120.905 -1.122 . . . . 0.0 109.603 178.539 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 49.1 t -75.13 119.5 77.23 Favored Pre-proline 0 N--CA 1.505 2.302 0 O-C-N 121.204 -0.935 . . . . 0.0 109.85 179.718 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -64.43 178.9 1.43 Allowed 'Trans proline' 0 N--CA 1.488 1.188 0 O-C-N 123.133 1.07 . . . . 0.0 110.768 179.584 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.7 mmm-85 -74.99 -37.53 61.85 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.193 -0.942 . . . . 0.0 110.596 -179.784 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.46 -40.61 83.14 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.071 -1.018 . . . . 0.0 109.968 -179.867 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -69.92 -41.49 74.56 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 119.382 -0.927 . . . . 0.0 109.266 179.246 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 11.1 mt -65.34 -38.69 90.87 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.272 -0.893 . . . . 0.0 109.576 179.188 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -60.98 -38.75 87.07 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.179 -0.951 . . . . 0.0 109.924 179.653 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.26 -36.21 72.91 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.148 -0.97 . . . . 0.0 110.416 179.845 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -63.77 -49.42 73.02 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.182 -0.949 . . . . 0.0 109.807 179.973 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.25 -38.25 86.01 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.122 -0.986 . . . . 0.0 109.84 179.733 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 15.6 mtp85 -61.69 -36.24 80.32 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.114 -0.991 . . . . 0.0 110.12 179.562 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 6.7 mttm -87.13 -34.96 18.9 Favored 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.029 -1.044 . . . . 0.0 110.747 179.798 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -82.48 -35.99 26.92 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 120.987 -1.07 . . . . 0.0 110.667 179.776 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.87 34.78 8.09 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.804 -1.319 . . . . 0.0 109.804 -179.861 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.9 t -131.17 23.14 4.85 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.992 -1.299 . . . . 0.0 111.531 179.702 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 48.62 -179.06 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.862 -1.149 . . . . 0.0 111.928 179.462 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.7 p -174.07 159.28 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.307 0 O-C-N 121.051 -1.031 . . . . 0.0 110.698 -179.841 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 41.5 t -171.98 92.5 0.13 Allowed 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.219 -0.926 . . . . 0.0 110.939 179.787 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.512 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 80.8 t80 -99.79 158.9 15.46 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.24 -0.912 . . . . 0.0 110.724 -179.881 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -139.46 -61.33 0.55 Allowed 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 178.615 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 1.6 pm0 -137.67 150.81 47.65 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.49 -0.756 . . . . 0.0 108.972 178.621 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . 0.406 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.4 p -91.99 153.88 19.16 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.973 -1.08 . . . . 0.0 111.034 -179.735 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.3 p -72.4 -23.4 21.21 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.416 0 C-N-CA 119.733 -0.787 . . . . 0.0 111.51 -179.76 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -51.55 -60.6 2.96 Favored 'General case' 0 N--CA 1.514 2.746 0 O-C-N 120.711 -1.243 . . . . 0.0 110.044 179.921 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.446 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 21.6 p -125.8 -164.11 1.28 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.265 -0.897 . . . . 0.0 110.395 179.327 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -101.64 61.53 0.55 Allowed Glycine 0 N--CA 1.492 2.384 0 N-CA-C 107.958 -2.057 . . . . 0.0 107.958 178.202 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 18.9 t -100.32 146.38 27.02 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.293 -1.122 . . . . 0.0 109.866 -179.13 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 6.7 ttm-85 -100.42 45.65 0.97 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.254 -0.904 . . . . 0.0 109.566 179.349 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 74.08 97.03 0.1 OUTLIER Glycine 0 N--CA 1.486 2.015 0 N-CA-C 109.806 -1.318 . . . . 0.0 109.806 179.993 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 26.3 p -109.47 125.74 52.77 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.275 -1.132 . . . . 0.0 110.133 179.606 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -144.79 144.93 31.41 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.088 -1.008 . . . . 0.0 110.181 -179.414 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.503 2.18 0 O-C-N 121.235 -0.916 . . . . 0.0 111.025 -179.824 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.442 ' HB1' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.514 2.728 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -70.97 160.43 49.38 Favored 'Trans proline' 0 C--N 1.316 -1.152 0 O-C-N 123.314 1.165 . . . . 0.0 110.831 -179.538 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -48.72 -32.06 7.87 Favored 'General case' 0 N--CA 1.515 2.816 0 O-C-N 121.384 -0.822 . . . . 0.0 111.403 -179.718 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.63 -33.27 41.12 Favored Glycine 0 N--CA 1.498 2.773 0 O-C-N 121.011 -1.055 . . . . 0.0 110.653 179.751 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.427 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 16.6 t80 -55.3 -34.23 63.96 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 120.939 -1.33 . . . . 0.0 110.701 179.888 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -55.17 -37.22 66.74 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 121.05 -1.031 . . . . 0.0 110.239 179.727 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.3 mtpt -57.65 -35.51 70.62 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.237 -0.915 . . . . 0.0 110.319 179.604 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.426 HG23 ' OH ' ' A' ' 62' ' ' TYR . 3.2 pt -115.25 36.33 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 O-C-N 121.186 -0.947 . . . . 0.0 110.328 179.548 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -84.98 -42.93 0.67 Allowed Pre-proline 0 N--CA 1.511 2.59 0 O-C-N 121.149 -0.969 . . . . 0.0 113.509 -179.143 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.8 Cg_endo -75.06 -37.23 2.09 Favored 'Trans proline' 0 N--CA 1.488 1.188 0 O-C-N 122.63 0.805 . . . . 0.0 111.921 -177.828 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 70.6 m -61.32 -43.38 98.96 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.019 -1.051 . . . . 0.0 110.139 -179.569 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 34.1 mt -65.07 -40.18 94.32 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.219 -0.926 . . . . 0.0 109.58 179.746 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -34.17 69.2 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.107 -0.995 . . . . 0.0 110.276 179.337 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -56.72 -36.36 69.62 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.004 -1.06 . . . . 0.0 110.288 179.628 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.429 ' CE1' ' HG2' ' A' ' 59' ' ' ARG . 26.2 m-85 -57.2 -39.89 76.33 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.098 -1.001 . . . . 0.0 110.325 179.866 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -60.06 -23.63 63.92 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.316 -0.865 . . . . 0.0 111.483 -179.461 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 2.7 mp -81.19 -34.72 13.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.426 0 O-C-N 120.767 -1.208 . . . . 0.0 109.727 179.623 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 25.3 tt0 -82.53 -36.21 26.56 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 120.951 -1.093 . . . . 0.0 109.179 178.543 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.18 -31.65 62.75 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.134 -0.979 . . . . 0.0 110.054 178.864 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -69.56 -36.71 76.57 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 120.808 -1.183 . . . . 0.0 109.911 179.419 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -64.19 -42.09 96.82 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.104 -1.038 . . . . 0.0 109.168 179.277 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.413 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -68.43 -41.95 79.59 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.272 -0.893 . . . . 0.0 109.096 178.964 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -59.41 -35.13 73.4 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.226 -0.922 . . . . 0.0 110.218 179.579 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -82.79 -39.73 21.39 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.009 -1.057 . . . . 0.0 110.147 179.818 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.6 t0 . . . . . 0 N--CA 1.509 2.49 0 O-C-N 121.214 -0.929 . . . . 0.0 109.959 179.681 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.0 m . . . . . 0 N--CA 1.497 1.888 0 CA-C-O 120.676 0.274 . . . . 0.0 110.501 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -56.25 -38.36 71.02 Favored 'General case' 0 N--CA 1.511 2.599 0 O-C-N 121.138 -0.976 . . . . 0.0 110.06 179.884 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -62.01 -40.84 97.05 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.211 -0.931 . . . . 0.0 109.804 179.773 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 48.9 tp60 -62.21 -40.49 96.26 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.183 -0.948 . . . . 0.0 109.782 179.805 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.6 mt -59.32 -39.28 82.61 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.142 -0.974 . . . . 0.0 110.092 179.87 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.425 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.8 m0 -61.17 -36.22 79.24 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.114 -0.991 . . . . 0.0 110.149 179.86 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.96 -31.21 68.52 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.988 -1.07 . . . . 0.0 110.107 178.871 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.413 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 79.6 mt -72.08 -60.29 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.286 0 O-C-N 120.921 -1.112 . . . . 0.0 108.816 179.148 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 5.6 ptm -61.67 -29.32 70.0 Favored 'General case' 0 N--CA 1.508 2.443 0 C-N-CA 118.771 -1.171 . . . . 0.0 109.685 178.568 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -70.39 -38.32 74.65 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.832 -1.168 . . . . 0.0 109.001 178.307 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.426 HD23 ' CD1' ' A' ' 26' ' ' PHE . 11.7 mt -53.72 -33.39 55.42 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.057 -1.027 . . . . 0.0 110.067 178.959 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.447 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 38.4 t60 -54.63 -38.79 67.28 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 120.961 -1.087 . . . . 0.0 109.943 179.816 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.427 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 5.2 m170 -59.15 -46.14 89.14 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.152 -0.967 . . . . 0.0 109.321 179.354 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 -61.64 -37.36 83.71 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.406 -0.917 . . . . 0.0 109.272 178.93 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.429 ' HG2' ' CE1' ' A' ' 26' ' ' PHE . 3.5 mmm-85 -64.51 -50.46 67.29 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.125 -0.984 . . . . 0.0 109.216 178.999 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 89.4 p -62.82 -40.11 96.39 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.197 -0.939 . . . . 0.0 109.193 179.455 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.405 ' O ' ' OG1' ' A' ' 65' ' ' THR . 12.5 ttm-85 -64.72 -38.25 90.34 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.127 -0.983 . . . . 0.0 109.399 178.995 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.426 ' OH ' HG23 ' A' ' 19' ' ' ILE . 37.7 t80 -60.61 -48.69 80.66 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.094 -1.004 . . . . 0.0 109.583 179.542 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.435 HG23 HD11 ' A' ' 63' ' ' ILE . 84.7 mt -76.51 -42.25 35.32 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.338 0 O-C-N 121.222 -0.924 . . . . 0.0 108.875 179.119 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.429 ' OH ' ' HD2' ' A' ' 96' ' ' ARG . 44.4 t80 -61.44 -22.74 65.31 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.402 -0.811 . . . . 0.0 110.507 178.824 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.405 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 86.9 m -90.73 -36.0 14.56 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.609 -1.307 . . . . 0.0 110.503 179.955 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.6 pp -82.9 -32.3 27.37 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.898 -1.126 . . . . 0.0 112.343 -179.179 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.427 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 34.3 t80 -86.21 -37.87 18.21 Favored 'General case' 0 N--CA 1.512 2.648 0 O-C-N 120.738 -1.226 . . . . 0.0 111.299 -179.375 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -89.68 -21.63 22.64 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.977 -1.077 . . . . 0.0 112.548 -178.647 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.6 mttm -119.87 -60.71 1.68 Allowed 'General case' 0 N--CA 1.501 2.104 0 O-C-N 120.489 -1.382 . . . . 0.0 111.153 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.8 ttt85 -60.38 -30.33 69.51 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.079 -1.013 . . . . 0.0 110.92 -179.464 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.1 tttt 57.5 42.04 25.03 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.859 -1.15 . . . . 0.0 110.025 -179.462 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -111.93 35.31 3.76 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.342 -0.849 . . . . 0.0 109.87 179.219 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.421 HD13 HG21 ' A' ' 73' ' ' ILE . 13.6 tt -156.14 162.1 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.214 -0.929 . . . . 0.0 109.913 -179.956 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 40.5 m -108.78 149.56 28.88 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.117 -0.989 . . . . 0.0 110.211 179.967 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.0 tttt -46.83 -32.08 3.48 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.307 -0.871 . . . . 0.0 111.462 -179.972 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.19 -50.6 71.14 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 120.893 -1.129 . . . . 0.0 109.39 179.521 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 38.0 tp -66.9 -44.3 81.17 Favored 'General case' 0 N--CA 1.505 2.301 0 C-N-CA 119.108 -1.037 . . . . 0.0 108.488 178.856 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.427 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 17.5 t80 -60.24 -38.64 84.05 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.305 -0.872 . . . . 0.0 109.425 178.933 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -72.75 -42.7 63.78 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.04 -1.037 . . . . 0.0 108.656 178.495 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.442 ' CH2' ' HB1' ' A' ' 12' ' ' ALA . 75.0 t90 -57.68 -37.13 72.91 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.271 -0.893 . . . . 0.0 109.576 178.825 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.455 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 12.7 mt -67.6 -51.44 50.27 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.18 -0.95 . . . . 0.0 109.113 179.178 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.401 HG21 HD12 ' A' ' 82' ' ' ILE . 36.3 mm -57.34 -31.64 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.507 0 O-C-N 121.246 -0.909 . . . . 0.0 110.228 179.559 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -89.26 -13.13 38.81 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 120.907 -1.12 . . . . 0.0 112.222 -179.804 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.424 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 76.4 mm-40 -108.84 23.12 15.0 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 120.535 -1.353 . . . . 0.0 111.977 -179.879 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.65 74.18 0.11 Allowed 'General case' 0 N--CA 1.512 2.671 0 O-C-N 121.188 -0.945 . . . . 0.0 111.71 179.227 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.455 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 32.0 m-85 -134.05 -62.94 0.75 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.512 -0.743 . . . . 0.0 109.22 179.433 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -131.2 163.06 28.56 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.472 -0.768 . . . . 0.0 109.418 179.315 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.447 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 8.3 t0 -107.93 108.65 19.89 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.091 -1.006 . . . . 0.0 110.417 -179.911 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -58.7 -37.54 76.32 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.249 -0.907 . . . . 0.0 110.19 179.742 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 18.4 tp -59.03 -39.01 80.63 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.102 -0.999 . . . . 0.0 110.19 -179.973 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.411 HD23 ' CD2' ' A' ' 57' ' ' HIS . 58.4 tp -71.02 -45.5 63.8 Favored 'General case' 0 N--CA 1.505 2.29 0 C-N-CA 119.123 -1.031 . . . . 0.0 108.884 179.318 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.421 HG22 ' CE1' ' A' ' 64' ' ' TYR . 20.6 mt -60.91 -39.09 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.384 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 178.358 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.77 -39.88 95.57 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.116 -0.99 . . . . 0.0 109.355 178.741 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 13.5 mmtm -59.54 -47.73 84.4 Favored 'General case' 0 N--CA 1.51 2.575 0 O-C-N 121.137 -0.977 . . . . 0.0 109.287 179.455 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.6 m0 -59.68 -35.18 73.96 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.364 -0.835 . . . . 0.0 110.244 179.549 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . 0.429 ' HD2' ' OH ' ' A' ' 64' ' ' TYR . 8.9 mtp85 -81.94 -33.02 30.53 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.112 -0.992 . . . . 0.0 110.757 179.76 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 7.9 mmtt -51.82 178.01 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.782 0 O-C-N 121.007 -1.058 . . . . 0.0 110.851 -179.855 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 28.5 m -105.38 140.43 38.5 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.252 -0.905 . . . . 0.0 109.395 179.188 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.88 -22.85 37.84 Favored Glycine 0 N--CA 1.494 2.534 0 C-N-CA 119.709 -1.234 . . . . 0.0 110.465 -179.26 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -91.22 58.43 3.68 Favored 'General case' 0 N--CA 1.505 2.277 0 CA-C-N 119.181 1.49 . . . . 0.0 110.056 179.831 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -66.6 -36.08 81.75 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.076 -1.015 . . . . 0.0 110.272 179.891 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.1 mmmt -127.95 97.36 4.77 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.054 -1.029 . . . . 0.0 110.819 -179.708 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.2 pp -134.64 136.62 42.98 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.111 -0.993 . . . . 0.0 109.983 179.24 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.427 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.9 p -103.9 -28.42 11.6 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.193 -0.942 . . . . 0.0 112.337 -179.787 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.62 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 14.3 m -145.46 -166.63 2.48 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.301 -1.499 . . . . 0.0 109.547 178.955 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 25.6 mt -99.0 -45.84 5.81 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.111 -0.993 . . . . 0.0 109.63 178.613 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 61.8 ttt-85 -93.42 -1.67 55.5 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 120.977 -1.077 . . . . 0.0 111.498 178.911 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.62 ' HB2' ' HB2' ' A' ' 105' ' ' CYS . 1.6 t -83.04 -48.13 10.94 Favored 'General case' 0 N--CA 1.512 2.635 0 N-CA-C 105.331 -2.1 . . . . 0.0 105.331 178.61 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 14.4 pt -76.13 -25.21 16.69 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.553 0 O-C-N 121.208 -0.933 . . . . 0.0 110.83 177.568 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 . . . . . 0 N--CA 1.494 1.744 0 O-C-N 121.004 -1.06 . . . . 0.0 110.127 -179.767 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.495 1.804 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 34.3 t -58.72 153.91 15.76 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.172 -0.955 . . . . 0.0 109.87 179.802 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.452 HG22 HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -72.87 -34.53 46.78 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.394 0 O-C-N 121.126 -0.984 . . . . 0.0 111.217 -179.207 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.511 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 12.3 p -55.64 -33.82 64.39 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 120.817 -1.177 . . . . 0.0 111.165 -178.788 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 6.6 ttp85 -59.56 -35.15 73.7 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 120.882 -1.136 . . . . 0.0 109.55 178.382 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 58.7 t -79.95 125.19 82.43 Favored Pre-proline 0 N--CA 1.503 2.18 0 O-C-N 121.121 -0.987 . . . . 0.0 109.653 179.468 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.12 177.12 2.66 Favored 'Trans proline' 0 N--CA 1.488 1.155 0 O-C-N 123.104 1.055 . . . . 0.0 110.814 179.734 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 3.8 tpp85 -75.01 -38.12 61.64 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.257 -0.902 . . . . 0.0 110.529 -179.818 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.18 -40.67 82.08 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.066 -1.021 . . . . 0.0 110.031 -179.946 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 14.8 tm0? -69.94 -42.28 73.46 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.21 -0.931 . . . . 0.0 109.17 179.25 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 8.2 mt -65.5 -38.44 89.72 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 119.526 -0.869 . . . . 0.0 109.464 179.08 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -59.81 -38.53 82.22 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.113 -0.992 . . . . 0.0 110.013 179.563 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -58.44 -37.29 75.11 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.133 -0.98 . . . . 0.0 110.379 179.895 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -60.19 -43.38 95.96 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.091 -1.006 . . . . 0.0 110.041 -179.969 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.91 -45.79 92.16 Favored 'General case' 0 N--CA 1.509 2.487 0 C-N-CA 119.305 -0.958 . . . . 0.0 109.726 179.875 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 3.3 mmt85 -58.19 -34.28 70.18 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.207 -0.933 . . . . 0.0 110.373 179.618 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -76.73 -31.42 57.13 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.116 -0.99 . . . . 0.0 110.914 179.919 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 42.0 mttt -98.73 23.93 8.16 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 120.812 -1.18 . . . . 0.0 111.642 -179.9 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.71 47.02 53.68 Favored Glycine 0 N--CA 1.5 2.905 0 O-C-N 120.696 -1.252 . . . . 0.0 110.717 179.212 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.7 t -153.47 -171.06 3.78 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.087 -1.243 . . . . 0.0 110.726 179.822 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -123.65 176.77 6.03 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.232 -0.917 . . . . 0.0 110.241 -179.831 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.2 p -158.89 161.17 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.193 -0.942 . . . . 0.0 110.765 -179.953 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 31.6 t -166.3 97.62 0.6 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.325 -0.859 . . . . 0.0 110.971 -179.999 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.511 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 59.4 t80 -101.08 158.65 15.85 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.295 -0.878 . . . . 0.0 110.483 -179.87 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 21.0 m170 -137.59 -60.51 0.65 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.437 -0.789 . . . . 0.0 109.102 179.04 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -138.0 149.13 45.82 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.374 -0.829 . . . . 0.0 109.139 178.793 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . 0.415 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.3 p -88.88 154.98 19.81 Favored 'General case' 0 N--CA 1.507 2.397 0 C-N-CA 119.112 -1.035 . . . . 0.0 111.033 -179.553 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.1 p -74.89 -23.78 17.71 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.327 0 O-C-N 121.318 -0.864 . . . . 0.0 111.678 -179.382 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -52.01 -61.5 2.22 Favored 'General case' 0 N--CA 1.515 2.791 0 O-C-N 120.659 -1.276 . . . . 0.0 110.115 -179.933 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.425 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.9 p -125.61 -167.12 1.65 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.224 -0.923 . . . . 0.0 110.404 179.711 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -97.79 66.93 0.8 Allowed Glycine 0 N--CA 1.493 2.47 0 N-CA-C 108.076 -2.009 . . . . 0.0 108.076 178.54 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 36.7 t -102.97 144.18 31.58 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.305 -1.115 . . . . 0.0 110.111 -179.165 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 32.5 mtp85 -99.29 48.39 0.95 Allowed 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.156 -0.965 . . . . 0.0 109.38 178.993 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.17 96.39 0.05 OUTLIER Glycine 0 N--CA 1.486 1.994 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 -179.814 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 22.8 p -109.17 127.88 54.57 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.151 -1.205 . . . . 0.0 110.339 179.72 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -141.96 141.99 32.96 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.115 -0.991 . . . . 0.0 109.863 -179.734 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.499 1.98 0 O-C-N 121.252 -0.905 . . . . 0.0 110.563 -179.801 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.432 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.5 2.071 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -68.36 164.24 33.35 Favored 'Trans proline' 0 C--N 1.317 -1.131 0 O-C-N 123.282 1.148 . . . . 0.0 110.94 -179.772 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -48.11 -31.65 5.85 Favored 'General case' 0 N--CA 1.516 2.825 0 O-C-N 121.484 -0.76 . . . . 0.0 111.544 -179.739 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.76 -36.15 40.3 Favored Glycine 0 N--CA 1.498 2.8 0 O-C-N 120.898 -1.126 . . . . 0.0 110.548 179.887 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 23.0 t80 -57.48 -34.18 68.76 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.983 -1.304 . . . . 0.0 110.504 179.76 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -52.58 -36.64 56.47 Favored 'General case' 0 N--CA 1.513 2.697 0 O-C-N 120.912 -1.117 . . . . 0.0 110.212 179.743 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.9 mtmt -58.56 -36.09 73.37 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.216 -0.927 . . . . 0.0 110.259 179.534 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 1.7 pt -120.7 35.01 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 O-C-N 121.109 -0.995 . . . . 0.0 110.77 179.881 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.436 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.7 OUTLIER -83.7 -43.33 0.8 Allowed Pre-proline 0 N--CA 1.51 2.557 0 O-C-N 121.031 -1.043 . . . . 0.0 113.313 -179.085 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.436 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.5 Cg_endo -75.37 -35.24 3.0 Favored 'Trans proline' 0 N--CA 1.486 1.044 0 O-C-N 122.6 0.789 . . . . 0.0 111.903 -178.094 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 88.6 m -60.16 -43.26 95.94 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 120.95 -1.094 . . . . 0.0 110.1 -179.738 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.9 mt -65.95 -41.16 91.61 Favored 'General case' 0 N--CA 1.507 2.418 0 C-N-CA 119.472 -0.891 . . . . 0.0 109.355 179.512 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.17 -34.63 72.34 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.259 -0.9 . . . . 0.0 110.077 179.277 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -58.49 -36.72 74.19 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.145 -0.972 . . . . 0.0 110.349 179.869 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.424 ' CD2' ' HD3' ' A' ' 59' ' ' ARG . 11.6 m-85 -55.78 -41.47 74.11 Favored 'General case' 0 N--CA 1.512 2.634 0 O-C-N 120.905 -1.122 . . . . 0.0 109.869 179.56 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -58.24 -25.98 62.35 Favored 'General case' 0 N--CA 1.506 2.352 0 C-N-CA 119.302 -0.959 . . . . 0.0 110.501 179.05 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 15.2 mm -68.41 -52.23 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.342 0 O-C-N 120.923 -1.111 . . . . 0.0 109.162 179.488 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -66.89 -42.47 85.45 Favored 'General case' 0 N--CA 1.508 2.451 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.018 179.31 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.69 -35.53 81.35 Favored 'General case' 0 N--CA 1.506 2.358 0 C-N-CA 119.44 -0.904 . . . . 0.0 109.106 178.744 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.71 -40.38 83.54 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.082 -1.011 . . . . 0.0 109.997 179.582 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -62.55 -47.74 82.57 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.202 -0.937 . . . . 0.0 109.717 -179.957 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.405 ' HB2' ' CG1' ' A' ' 52' ' ' ILE . . . -69.05 -40.24 78.65 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.164 -0.96 . . . . 0.0 109.278 179.213 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 41.4 mm-40 -67.57 -31.69 71.93 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.248 -0.907 . . . . 0.0 110.398 179.465 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.2 mmmt -92.89 -34.66 13.72 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 120.861 -1.149 . . . . 0.0 110.736 179.965 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 . . . . . 0 N--CA 1.51 2.572 0 O-C-N 121.017 -1.052 . . . . 0.0 110.153 179.836 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.9 t . . . . . 0 N--CA 1.496 1.852 0 CA-C-O 120.694 0.283 . . . . 0.0 110.508 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.7 m-20 -55.12 -38.29 68.0 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.094 -1.004 . . . . 0.0 110.036 179.763 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -59.8 -38.31 81.58 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.274 -0.891 . . . . 0.0 110.144 179.708 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -64.47 -40.71 96.22 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.113 -0.992 . . . . 0.0 109.925 179.947 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 24.8 mt -67.85 -35.78 79.17 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.223 -0.923 . . . . 0.0 110.344 179.899 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 47.1 m0 -58.79 -37.82 77.16 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.003 -1.06 . . . . 0.0 110.019 179.879 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -62.96 -32.17 73.44 Favored 'General case' 0 N--CA 1.504 2.235 0 C-N-CA 119.074 -1.05 . . . . 0.0 109.494 178.425 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.405 ' CG1' ' HB2' ' A' ' 33' ' ' ALA . 68.6 mt -71.83 -59.04 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.232 0 O-C-N 120.91 -1.119 . . . . 0.0 108.999 179.216 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -60.69 -29.11 69.12 Favored 'General case' 0 N--CA 1.511 2.605 0 C-N-CA 118.483 -1.287 . . . . 0.0 109.918 178.9 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.4 mm-40 -68.75 -37.9 79.72 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 120.846 -1.159 . . . . 0.0 109.138 178.215 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.408 HD23 ' CE2' ' A' ' 26' ' ' PHE . 10.9 mt -53.74 -32.18 51.22 Favored 'General case' 0 N--CA 1.511 2.6 0 O-C-N 120.92 -1.112 . . . . 0.0 110.375 179.026 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.444 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 17.6 t60 -56.62 -37.0 70.09 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.004 -1.06 . . . . 0.0 110.302 179.91 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.443 ' NE2' HD21 ' A' ' 91' ' ' LEU . 5.5 m170 -61.41 -51.13 70.04 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.141 -0.974 . . . . 0.0 109.458 179.407 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -57.98 -35.92 71.88 Favored 'General case' 0 N--CA 1.509 2.478 0 C-N-CA 119.377 -0.929 . . . . 0.0 109.715 179.206 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.424 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -65.48 -50.27 65.95 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.102 -0.999 . . . . 0.0 109.353 179.272 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 60.7 p -62.24 -39.12 91.77 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.097 -1.002 . . . . 0.0 109.209 179.24 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.402 ' O ' ' OG1' ' A' ' 65' ' ' THR . 4.9 ttt180 -63.78 -37.39 87.2 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.292 -0.963 . . . . 0.0 109.416 179.001 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -61.0 -50.6 72.71 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.154 -0.966 . . . . 0.0 109.344 179.504 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.428 HG21 HD12 ' A' ' 63' ' ' ILE . 92.0 mt -74.5 -41.91 49.23 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 C-N-CA 119.329 -0.949 . . . . 0.0 108.872 179.193 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.435 ' OH ' ' NH1' ' A' ' 96' ' ' ARG . 58.6 t80 -59.77 -36.21 76.21 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.3 -0.875 . . . . 0.0 109.821 179.032 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.402 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 76.2 m -75.04 -38.77 61.34 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.943 -1.098 . . . . 0.0 110.356 180.0 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.419 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.5 pp -83.23 -31.47 26.99 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.85 -1.156 . . . . 0.0 112.142 -179.275 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.424 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 40.8 t80 -86.4 -41.47 14.44 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 120.658 -1.277 . . . . 0.0 111.874 -179.575 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -90.39 -26.36 19.94 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 120.89 -1.131 . . . . 0.0 112.818 -177.723 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.42 ' HE2' ' CD2' ' A' ' 64' ' ' TYR . 0.7 OUTLIER -109.11 -58.2 2.06 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.673 -1.267 . . . . 0.0 110.668 -179.988 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.1 tpt180 -58.32 -33.58 69.66 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.015 -1.053 . . . . 0.0 110.364 179.721 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.7 tttp 59.26 47.21 11.8 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 120.896 -1.128 . . . . 0.0 110.37 179.903 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.8 -58.1 2.2 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.378 -0.826 . . . . 0.0 109.507 179.339 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.439 HG23 HD12 ' A' ' 73' ' ' ILE . 14.8 tt -54.91 162.39 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.601 0 O-C-N 121.366 -0.834 . . . . 0.0 110.224 179.55 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.0 t -110.53 147.36 34.32 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.188 -0.945 . . . . 0.0 109.805 178.975 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -43.15 -33.83 0.98 Allowed 'General case' 0 N--CA 1.52 3.04 0 O-C-N 121.376 -0.828 . . . . 0.0 111.986 -179.594 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.6 -48.04 83.52 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 120.956 -1.09 . . . . 0.0 109.474 179.556 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 23.9 tp -70.52 -41.79 72.12 Favored 'General case' 0 N--CA 1.504 2.233 0 C-N-CA 119.236 -0.986 . . . . 0.0 108.705 178.611 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.424 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 26.2 t80 -61.71 -36.56 81.29 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.27 -0.894 . . . . 0.0 109.478 178.821 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -71.96 -43.77 64.63 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.024 -1.048 . . . . 0.0 108.905 179.047 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.432 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 72.8 t90 -59.42 -37.97 79.42 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.227 -0.921 . . . . 0.0 109.428 178.979 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.447 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 18.8 mt -65.74 -49.77 67.21 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.247 -0.908 . . . . 0.0 109.55 179.531 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.455 HD11 HG21 ' A' ' 82' ' ' ILE . 39.7 mm -59.6 -33.16 50.92 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.515 0 O-C-N 121.258 -0.901 . . . . 0.0 110.164 179.68 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.13 -6.3 57.11 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 120.909 -1.119 . . . . 0.0 112.379 -179.802 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.422 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 7.6 mm-40 -114.46 21.81 14.24 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.537 -1.352 . . . . 0.0 111.899 -179.941 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.01 77.74 0.12 Allowed 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.014 -1.054 . . . . 0.0 111.433 179.371 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.447 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 33.0 m-85 -136.7 -63.46 0.62 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.499 -0.75 . . . . 0.0 109.418 179.653 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -125.6 -174.26 3.03 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.431 -0.793 . . . . 0.0 109.293 179.342 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.444 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 5.4 t0 -121.67 102.76 8.43 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.098 -1.001 . . . . 0.0 110.343 -179.956 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.5 mtpt -60.37 -40.38 90.6 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.143 -0.973 . . . . 0.0 109.874 179.618 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 30.9 tp -59.97 -42.78 94.88 Favored 'General case' 0 N--CA 1.508 2.425 0 C-N-CA 119.408 -0.917 . . . . 0.0 109.67 179.711 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.443 HD21 ' NE2' ' A' ' 57' ' ' HIS . 37.0 tp -64.97 -50.44 66.34 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.168 -0.957 . . . . 0.0 108.927 179.529 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.411 HG23 ' CE1' ' A' ' 64' ' ' TYR . 55.9 mt -59.25 -36.04 61.19 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.413 0 O-C-N 121.188 -0.945 . . . . 0.0 108.797 178.593 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -64.53 -44.93 89.29 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.135 -0.978 . . . . 0.0 109.341 178.726 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.416 ' CD ' ' CD2' ' A' ' 106' ' ' LEU . 8.7 mttp -59.66 -44.68 93.46 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.087 -1.008 . . . . 0.0 109.862 179.163 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.408 ' CH2' HD21 ' A' ' 91' ' ' LEU . 5.5 m0 -59.04 -35.49 73.4 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.158 -0.964 . . . . 0.0 110.105 179.262 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . 0.435 ' NH1' ' OH ' ' A' ' 64' ' ' TYR . 13.2 mtp85 -85.04 -30.4 24.16 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.07 -1.019 . . . . 0.0 110.513 179.269 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.43 -176.93 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.719 0 O-C-N 120.987 -1.07 . . . . 0.0 110.697 179.865 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 12.0 m -102.23 135.11 44.4 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.208 -0.933 . . . . 0.0 109.594 179.012 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 97.04 10.42 54.92 Favored Glycine 0 N--CA 1.494 2.522 0 O-C-N 121.132 -0.98 . . . . 0.0 111.081 -179.345 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -118.35 71.87 0.85 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 119.339 1.57 . . . . 0.0 109.641 179.576 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -94.62 -33.75 12.88 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.158 -0.964 . . . . 0.0 110.871 -179.804 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.68 77.08 1.77 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.99 -1.069 . . . . 0.0 110.997 -179.49 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.3 pp -125.44 159.36 32.1 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.031 -1.043 . . . . 0.0 109.83 179.042 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.441 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.6 p -120.3 -33.06 3.98 Favored 'General case' 0 N--CA 1.501 2.101 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -178.709 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.558 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.3 m -140.27 -168.04 2.45 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 120.056 -1.653 . . . . 0.0 110.254 179.573 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.416 ' CD2' ' CD ' ' A' ' 94' ' ' LYS . 46.1 mt -95.65 -39.45 9.9 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.166 -0.959 . . . . 0.0 110.069 179.134 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.86 28.26 5.36 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 120.934 -1.104 . . . . 0.0 110.042 178.006 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.558 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.8 t -126.32 15.55 7.75 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.093 -1.004 . . . . 0.0 108.855 -179.669 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.2 pt -157.81 36.86 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.292 0 O-C-N 120.803 -1.185 . . . . 0.0 110.55 -178.776 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 . . . . . 0 N--CA 1.501 2.09 0 O-C-N 120.73 -1.231 . . . . 0.0 111.824 -178.071 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.509 2.493 0 N-CA-C 109.978 -0.378 . . . . 0.0 109.978 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 49.3 t -95.2 154.13 17.33 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 119.555 -0.858 . . . . 0.0 109.186 178.913 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.445 HD13 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -71.56 -37.18 62.85 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.441 0 O-C-N 121.115 -0.99 . . . . 0.0 110.987 -179.053 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.478 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 10.8 p -53.97 -34.35 59.49 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 120.932 -1.105 . . . . 0.0 111.127 -178.703 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 10.9 ttp85 -59.53 -34.88 73.18 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 120.966 -1.084 . . . . 0.0 109.542 178.38 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 49.5 t -79.9 124.75 83.07 Favored Pre-proline 0 N--CA 1.505 2.29 0 O-C-N 121.14 -0.975 . . . . 0.0 109.925 179.614 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -65.13 178.7 1.81 Allowed 'Trans proline' 0 N--CA 1.488 1.205 0 O-C-N 123.113 1.06 . . . . 0.0 110.804 179.517 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.2 mmt85 -75.05 -37.73 61.61 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.233 -0.917 . . . . 0.0 110.489 -179.803 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.64 -42.81 89.18 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.043 -1.035 . . . . 0.0 109.971 -179.752 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -68.79 -41.65 78.44 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.281 -0.968 . . . . 0.0 109.128 179.256 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 5.6 mt -64.17 -38.57 91.54 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.172 -0.955 . . . . 0.0 109.701 179.166 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -60.61 -40.15 90.81 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.095 -1.003 . . . . 0.0 109.853 179.765 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -59.62 -37.07 77.64 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.12 -0.987 . . . . 0.0 110.16 179.739 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -60.67 -45.15 95.23 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.114 -0.991 . . . . 0.0 109.843 179.859 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.13 -46.41 89.12 Favored 'General case' 0 N--CA 1.507 2.389 0 C-N-CA 119.337 -0.945 . . . . 0.0 109.687 179.759 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.79 -35.2 74.16 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.192 -0.943 . . . . 0.0 110.11 179.559 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -73.89 -32.64 63.69 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.101 -1.0 . . . . 0.0 110.773 179.887 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 1.4 ttmt -98.87 23.32 9.0 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.944 -1.098 . . . . 0.0 111.685 179.996 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.92 46.73 55.06 Favored Glycine 0 N--CA 1.499 2.873 0 O-C-N 120.69 -1.256 . . . . 0.0 110.702 179.288 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.8 t -148.79 -165.15 2.2 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.154 -1.204 . . . . 0.0 110.468 179.848 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -131.62 153.52 49.84 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.214 -0.929 . . . . 0.0 110.186 -179.874 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 8.1 p -131.55 160.66 42.2 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 O-C-N 121.193 -0.942 . . . . 0.0 110.349 179.964 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 47.7 t -168.57 86.68 0.19 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.232 -0.917 . . . . 0.0 110.744 179.99 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.478 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 57.8 t80 -102.47 161.72 13.49 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.181 -0.949 . . . . 0.0 110.821 -179.483 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 3.3 m170 -139.5 -60.96 0.55 Allowed 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 178.995 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -134.86 150.17 50.42 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.339 -0.85 . . . . 0.0 108.774 178.47 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 28.3 p -92.65 154.09 18.58 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.096 -1.042 . . . . 0.0 111.117 -179.42 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.9 p -73.31 -25.19 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 O-C-N 121.39 -0.819 . . . . 0.0 111.475 -179.603 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -49.73 -55.79 12.61 Favored 'General case' 0 N--CA 1.516 2.835 0 O-C-N 120.828 -1.17 . . . . 0.0 110.231 -179.875 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 23.1 p -131.55 -163.41 1.32 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.218 -0.926 . . . . 0.0 110.226 179.651 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -102.23 63.47 0.48 Allowed Glycine 0 N--CA 1.492 2.394 0 N-CA-C 108.015 -2.034 . . . . 0.0 108.015 178.4 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 31.6 t -104.01 141.48 36.11 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.362 -1.081 . . . . 0.0 110.162 -178.993 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 6.0 ttt-85 -96.33 53.26 1.31 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.303 -0.873 . . . . 0.0 109.423 178.995 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.23 96.87 0.03 OUTLIER Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.714 -1.355 . . . . 0.0 109.714 -179.857 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.2 p -107.24 127.21 53.33 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.165 -1.197 . . . . 0.0 110.34 179.608 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -152.99 148.82 27.53 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.167 -0.958 . . . . 0.0 110.355 -179.546 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.501 2.096 0 O-C-N 121.191 -0.943 . . . . 0.0 110.759 -179.727 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.427 ' HB3' ' CZ2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.51 2.566 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -72.45 160.41 46.85 Favored 'Trans proline' 0 C--N 1.317 -1.116 0 O-C-N 123.346 1.182 . . . . 0.0 110.722 -179.823 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -49.37 -31.55 9.67 Favored 'General case' 0 N--CA 1.515 2.789 0 O-C-N 121.394 -0.816 . . . . 0.0 111.361 -179.869 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.55 -33.4 40.76 Favored Glycine 0 N--CA 1.498 2.798 0 O-C-N 120.941 -1.099 . . . . 0.0 110.686 179.888 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -55.21 -33.08 62.75 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 120.938 -1.331 . . . . 0.0 110.665 179.939 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -54.16 -37.71 64.73 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 120.981 -1.074 . . . . 0.0 110.325 179.776 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.3 mtpp -59.74 -36.94 77.64 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.227 -0.921 . . . . 0.0 110.201 179.545 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 1.6 pt -114.96 33.85 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 O-C-N 121.129 -0.982 . . . . 0.0 110.702 179.759 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.427 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 1.1 ttpt -83.81 -43.21 0.79 Allowed Pre-proline 0 N--CA 1.508 2.469 0 O-C-N 121.005 -1.059 . . . . 0.0 113.102 -179.356 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.3 Cg_endo -75.7 -35.14 2.82 Favored 'Trans proline' 0 N--CA 1.487 1.103 0 O-C-N 122.592 0.785 . . . . 0.0 111.563 -178.448 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 90.5 m -58.48 -41.86 86.21 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 120.948 -1.095 . . . . 0.0 110.05 -179.926 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.0 mt -68.18 -41.3 81.64 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.514 -0.874 . . . . 0.0 109.297 179.398 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.3 m -60.42 -33.95 73.26 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.168 -0.958 . . . . 0.0 109.845 178.926 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -55.57 -34.96 65.24 Favored 'General case' 0 N--CA 1.511 2.579 0 O-C-N 121.01 -1.056 . . . . 0.0 110.198 179.465 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.431 ' CD1' ' HD3' ' A' ' 59' ' ' ARG . 15.7 m-85 -55.32 -35.79 65.52 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.103 -0.998 . . . . 0.0 110.516 179.704 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -57.16 -38.19 73.2 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.095 -1.003 . . . . 0.0 110.647 -179.628 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.2 mp -66.36 -40.81 87.66 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 C-N-CA 119.316 -0.954 . . . . 0.0 109.158 179.725 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -70.32 -46.87 63.35 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.125 -0.985 . . . . 0.0 108.784 178.97 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.407 ' CD1' ' CG2' ' A' ' 52' ' ' ILE . 2.2 tp -62.07 -35.54 78.94 Favored 'General case' 0 N--CA 1.507 2.419 0 C-N-CA 119.377 -0.929 . . . . 0.0 109.305 178.555 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.92 -36.08 69.78 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.106 -0.996 . . . . 0.0 110.391 179.699 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -62.88 -52.4 63.23 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.054 -1.029 . . . . 0.0 109.458 -179.883 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.42 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -68.91 -41.96 77.48 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 119.042 -1.063 . . . . 0.0 108.589 178.809 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -60.45 -32.42 71.36 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.22 -0.925 . . . . 0.0 110.187 179.309 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 41.8 mtpt -93.6 -30.16 15.1 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 120.939 -1.1 . . . . 0.0 111.037 179.952 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.0 t0 . . . . . 0 N--CA 1.513 2.677 0 O-C-N 120.861 -1.15 . . . . 0.0 110.407 -179.947 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.503 2.213 0 CA-C-O 120.497 0.189 . . . . 0.0 110.616 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -61.34 -40.88 95.89 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.112 -0.992 . . . . 0.0 109.66 179.99 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -61.03 -39.45 89.81 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.217 -0.927 . . . . 0.0 109.788 179.455 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.411 ' HG2' ' CB ' ' A' ' 33' ' ' ALA . 0.3 OUTLIER -59.44 -44.59 92.9 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.187 -0.946 . . . . 0.0 109.53 179.694 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 20.8 mt -59.41 -35.97 74.97 Favored 'General case' 0 N--CA 1.508 2.449 0 C-N-CA 119.318 -0.953 . . . . 0.0 110.296 -179.736 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.463 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.1 m0 -54.0 -38.62 65.28 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 120.885 -1.135 . . . . 0.0 109.52 179.195 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -67.83 -37.27 81.71 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.328 -0.857 . . . . 0.0 109.553 178.817 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.42 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 16.6 mt -66.97 -42.84 89.27 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.329 0 O-C-N 121.038 -1.039 . . . . 0.0 109.42 179.604 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.43 ' CE ' ' HB3' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -68.68 -29.44 67.9 Favored 'General case' 0 N--CA 1.502 2.166 0 C-N-CA 118.66 -1.216 . . . . 0.0 109.864 179.285 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.408 ' N ' ' HG3' ' A' ' 53' ' ' MET . 23.4 mt-30 -66.24 -37.69 86.12 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.997 -1.065 . . . . 0.0 109.282 178.896 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.41 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.6 mt -52.77 -32.83 45.68 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.013 -1.054 . . . . 0.0 109.959 179.187 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.435 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 8.4 t60 -56.93 -37.27 71.25 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.058 -1.026 . . . . 0.0 109.966 179.247 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.44 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 5.5 m170 -59.42 -49.35 78.15 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.097 -1.002 . . . . 0.0 109.103 179.215 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -58.78 -35.99 73.69 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.305 -0.872 . . . . 0.0 109.43 178.856 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.431 ' HD3' ' CD1' ' A' ' 26' ' ' PHE . 32.6 mmm-85 -62.81 -51.98 64.97 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.159 -0.963 . . . . 0.0 109.078 178.978 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 92.9 p -63.7 -39.23 93.79 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.237 -0.914 . . . . 0.0 109.127 179.262 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.407 ' O ' ' OG1' ' A' ' 65' ' ' THR . 58.7 ttt-85 -64.48 -37.88 89.06 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 121.094 -1.004 . . . . 0.0 109.634 179.195 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -62.3 -49.54 75.22 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.075 -1.016 . . . . 0.0 109.485 179.528 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.428 HG22 HD11 ' A' ' 63' ' ' ILE . 86.9 mt -75.43 -40.62 42.25 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.328 0 O-C-N 121.168 -0.957 . . . . 0.0 109.313 179.382 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.422 ' CE1' HG21 ' A' ' 92' ' ' ILE . 38.6 t80 -63.03 -22.06 66.59 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.202 -0.937 . . . . 0.0 110.551 178.758 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.407 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 87.4 m -90.78 -35.51 14.81 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 120.665 -1.272 . . . . 0.0 110.39 179.751 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.7 pp -82.87 -31.95 27.67 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.917 -1.114 . . . . 0.0 112.207 -179.246 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.429 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 40.3 t80 -86.13 -38.01 18.18 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 120.657 -1.277 . . . . 0.0 111.271 -179.477 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.403 ' CD2' ' CD1' ' A' ' 64' ' ' TYR . 17.2 m-85 -89.65 -21.93 22.53 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.896 -1.128 . . . . 0.0 112.614 -178.663 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.7 mttm -119.58 -61.07 1.66 Allowed 'General case' 0 N--CA 1.501 2.093 0 O-C-N 120.466 -1.396 . . . . 0.0 111.211 -179.671 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.81 -30.65 67.78 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.113 -0.992 . . . . 0.0 110.808 -179.502 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.0 ttmm 57.28 41.59 26.48 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 120.852 -1.155 . . . . 0.0 110.023 -179.498 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.14 35.64 3.87 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.425 -0.797 . . . . 0.0 109.871 179.288 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 14.1 tt -155.29 162.14 1.89 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.197 -0.939 . . . . 0.0 109.918 -179.975 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.1 148.92 30.09 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.105 -0.997 . . . . 0.0 110.245 179.966 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -46.38 -32.29 3.12 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 121.35 -0.843 . . . . 0.0 111.553 179.97 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -62.02 -50.55 71.57 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 120.843 -1.16 . . . . 0.0 109.349 179.427 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 54.4 tp -66.37 -45.4 80.25 Favored 'General case' 0 N--CA 1.506 2.336 0 C-N-CA 119.141 -1.024 . . . . 0.0 108.465 178.818 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.429 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 18.4 t80 -59.78 -38.26 81.36 Favored 'General case' 0 N--CA 1.506 2.331 0 C-N-CA 119.694 -0.802 . . . . 0.0 109.551 179.112 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -73.75 -42.43 61.11 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.102 -0.999 . . . . 0.0 108.764 178.726 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.429 ' CE2' ' HG3' ' A' ' 84' ' ' GLU . 72.1 t90 -57.88 -36.12 71.93 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.228 -0.92 . . . . 0.0 109.772 178.943 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.455 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 11.9 mt -69.56 -50.28 46.29 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.119 -0.988 . . . . 0.0 108.84 179.213 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.455 HG23 HD11 ' A' ' 82' ' ' ILE . 35.5 mm -57.16 -30.88 35.88 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.639 0 O-C-N 121.205 -0.934 . . . . 0.0 110.117 179.362 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -89.18 -20.87 23.68 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 120.886 -1.134 . . . . 0.0 112.159 -179.549 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.429 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 77.9 mm-40 -101.63 22.19 13.17 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 120.659 -1.276 . . . . 0.0 112.08 -179.767 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 73.46 77.75 0.13 Allowed 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.05 -1.031 . . . . 0.0 111.659 179.079 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.455 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 29.0 m-85 -134.64 -64.71 0.66 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.553 -0.717 . . . . 0.0 109.468 179.721 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -120.63 -174.06 2.72 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.378 -0.826 . . . . 0.0 109.513 179.336 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.435 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 5.9 t0 -124.7 102.86 7.8 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.165 -0.96 . . . . 0.0 110.348 -179.878 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -60.22 -40.28 89.6 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.226 -0.921 . . . . 0.0 109.806 179.646 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.2 tp -60.33 -37.85 81.89 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 121.204 -0.935 . . . . 0.0 110.045 179.829 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.429 ' CD2' ' CZ3' ' A' ' 95' ' ' TRP . 45.2 tp -70.63 -49.3 49.01 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.078 -1.014 . . . . 0.0 108.813 179.179 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.422 HG21 ' CE1' ' A' ' 64' ' ' TYR . 34.5 mt -59.0 -34.03 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 121.255 -0.903 . . . . 0.0 109.098 178.556 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.12 -46.64 76.84 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.089 -1.007 . . . . 0.0 109.356 178.933 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.41 ' CD ' ' CD2' ' A' ' 106' ' ' LEU . 10.9 mttp -60.5 -44.36 96.06 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.129 -0.982 . . . . 0.0 109.804 179.32 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.429 ' CZ3' ' CD2' ' A' ' 91' ' ' LEU . 3.3 m0 -58.66 -28.66 65.92 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.086 -1.009 . . . . 0.0 109.966 178.926 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . 0.405 ' CD ' ' OH ' ' A' ' 64' ' ' TYR . 0.0 OUTLIER -99.69 22.53 10.81 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 120.939 -1.101 . . . . 0.0 110.886 178.676 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -109.41 -174.28 2.47 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.732 -1.23 . . . . 0.0 109.851 179.366 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 29.2 m -104.6 137.8 41.9 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.214 -0.929 . . . . 0.0 109.441 179.149 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 102.2 -25.77 26.6 Favored Glycine 0 N--CA 1.493 2.496 0 C-N-CA 119.815 -1.184 . . . . 0.0 110.2 -179.004 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 -92.37 58.63 3.25 Favored 'General case' 0 N--CA 1.504 2.258 0 CA-C-N 119.009 1.404 . . . . 0.0 109.994 179.771 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -72.88 -37.64 67.26 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.006 -1.059 . . . . 0.0 110.2 179.909 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.87 82.67 2.1 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.039 -1.038 . . . . 0.0 110.47 179.949 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -119.71 148.36 43.48 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.168 -0.958 . . . . 0.0 110.349 179.759 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.44 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.1 p -113.03 -26.66 8.37 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.163 -0.96 . . . . 0.0 113.374 -179.516 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.59 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 11.4 m -143.48 -167.31 2.54 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 120.068 -1.645 . . . . 0.0 109.642 179.065 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.41 ' CD2' ' CD ' ' A' ' 94' ' ' LYS . 14.4 mt -97.15 -38.28 9.78 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.103 -0.998 . . . . 0.0 110.306 179.224 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 22.7 ttt85 -102.98 31.83 4.02 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 120.893 -1.129 . . . . 0.0 109.678 178.153 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.59 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.308 1.7 t -127.71 16.53 6.93 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.154 -0.966 . . . . 0.0 108.953 -179.257 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.1 pt -159.25 38.06 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 120.947 -1.095 . . . . 0.0 110.628 -178.545 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.402 ' O ' ' OG1' ' A' ' 119' ' ' THR . 1.5 mm-40 . . . . . 0 N--CA 1.502 2.133 0 O-C-N 120.749 -1.22 . . . . 0.0 111.321 -178.49 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.402 ' OG1' ' O ' ' A' ' 110' ' ' GLN . 0.9 OUTLIER . . . . . 0 N--CA 1.494 1.773 0 CA-C-O 120.704 0.288 . . . . 0.0 110.26 . . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 48.9 t -106.7 155.02 20.11 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.405 -0.81 . . . . 0.0 109.531 179.231 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.448 HD13 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -72.74 -35.72 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.395 0 O-C-N 121.081 -1.012 . . . . 0.0 111.255 -179.172 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.503 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 11.0 p -54.21 -31.86 54.2 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.805 -1.185 . . . . 0.0 111.298 -178.861 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 6.7 ttp85 -58.22 -32.86 68.71 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 120.929 -1.107 . . . . 0.0 109.798 178.375 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 60.8 t -81.87 125.24 78.21 Favored Pre-proline 0 N--CA 1.506 2.328 0 O-C-N 121.124 -0.985 . . . . 0.0 109.923 179.68 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -66.65 178.99 2.35 Favored 'Trans proline' 0 N--CA 1.488 1.152 0 O-C-N 123.097 1.051 . . . . 0.0 110.551 179.407 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -75.17 -37.77 61.15 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.184 -0.948 . . . . 0.0 110.513 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.06 -41.12 82.64 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.001 -1.062 . . . . 0.0 110.097 -179.732 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -66.91 -41.78 86.5 Favored 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.319 179.494 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.4 mt -63.27 -39.97 96.09 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.226 -0.922 . . . . 0.0 109.693 179.561 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -60.1 -38.31 82.58 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.19 -0.943 . . . . 0.0 109.993 179.782 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -57.79 -36.12 71.75 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.072 -1.018 . . . . 0.0 110.381 179.802 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.36 -49.56 73.39 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.072 -1.017 . . . . 0.0 109.754 179.902 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.11 -38.95 90.85 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.148 -0.97 . . . . 0.0 109.797 179.754 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 43.4 ttp85 -66.78 -35.53 80.31 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.155 -0.966 . . . . 0.0 110.452 179.771 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 25.4 mttm -86.84 -35.04 19.28 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.048 -1.032 . . . . 0.0 110.479 179.86 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 16.8 mttm -80.96 -22.55 39.46 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.086 -1.009 . . . . 0.0 111.472 179.692 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.83 32.91 9.48 Favored Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.673 -1.371 . . . . 0.0 109.673 -179.537 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.1 t -135.9 -161.22 1.13 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.054 -1.262 . . . . 0.0 109.792 179.946 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -130.85 143.08 50.47 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.07 -1.018 . . . . 0.0 109.959 179.944 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 8.1 p -129.85 160.2 41.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.216 -0.927 . . . . 0.0 110.373 -179.981 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 43.6 t -169.94 87.83 0.15 Allowed 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.261 -0.9 . . . . 0.0 111.031 179.96 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.503 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 62.3 t80 -99.68 159.81 14.77 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.187 -0.945 . . . . 0.0 110.491 -179.882 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -138.26 -59.76 0.63 Allowed 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 179.015 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -139.47 151.07 45.9 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.341 -0.849 . . . . 0.0 109.05 178.778 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 29.7 p -91.73 154.49 18.93 Favored 'General case' 0 N--CA 1.505 2.282 0 C-N-CA 119.05 -1.06 . . . . 0.0 111.093 -179.502 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.9 p -72.58 -26.26 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 O-C-N 121.379 -0.826 . . . . 0.0 111.57 -179.455 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -51.05 -51.74 50.23 Favored 'General case' 0 N--CA 1.516 2.839 0 O-C-N 120.764 -1.21 . . . . 0.0 110.195 -179.955 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.463 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 31.8 p -135.0 -169.03 2.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.237 -0.914 . . . . 0.0 111.121 179.764 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -98.39 60.97 0.9 Allowed Glycine 0 N--CA 1.491 2.329 0 N-CA-C 107.756 -2.138 . . . . 0.0 107.756 178.366 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 20.8 t -100.98 143.24 31.36 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.39 -1.065 . . . . 0.0 109.971 -179.021 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 50.5 mtm-85 -97.16 51.94 1.12 Allowed 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.237 -0.914 . . . . 0.0 109.308 179.046 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.41 96.72 0.03 OUTLIER Glycine 0 N--CA 1.487 2.095 0 N-CA-C 109.746 -1.342 . . . . 0.0 109.746 -179.726 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.0 p -106.65 125.24 50.76 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.19 -1.182 . . . . 0.0 110.258 179.67 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -149.28 151.3 33.97 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.199 -0.938 . . . . 0.0 110.162 -179.622 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 4.9 m . . . . . 0 N--CA 1.5 2.074 0 O-C-N 121.326 -0.859 . . . . 0.0 110.48 -179.892 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.431 ' HB2' ' CE3' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.504 2.273 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.49 162.52 42.0 Favored 'Trans proline' 0 C--N 1.317 -1.081 0 O-C-N 123.273 1.144 . . . . 0.0 110.801 -179.611 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -48.96 -31.76 7.95 Favored 'General case' 0 N--CA 1.515 2.803 0 O-C-N 121.433 -0.792 . . . . 0.0 111.318 -179.874 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.0 -35.11 39.96 Favored Glycine 0 N--CA 1.499 2.873 0 O-C-N 120.951 -1.093 . . . . 0.0 110.388 179.801 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -54.88 -32.44 60.86 Favored 'General case' 0 N--CA 1.512 2.664 0 O-C-N 121.013 -1.286 . . . . 0.0 110.617 179.626 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -54.11 -37.86 64.76 Favored 'General case' 0 N--CA 1.512 2.662 0 O-C-N 121.01 -1.056 . . . . 0.0 110.244 179.823 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.6 mmtp -58.86 -37.93 77.61 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.28 -0.887 . . . . 0.0 110.107 179.59 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.422 HG21 ' OH ' ' A' ' 62' ' ' TYR . 2.0 pt -114.4 33.51 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 O-C-N 121.237 -0.914 . . . . 0.0 110.544 179.458 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.423 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 5.7 tmtt? -83.6 -43.57 0.81 Allowed Pre-proline 0 N--CA 1.508 2.466 0 O-C-N 121.005 -1.059 . . . . 0.0 113.019 -179.171 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.4 Cg_endo -76.63 -35.6 1.98 Allowed 'Trans proline' 0 N--CA 1.486 1.069 0 O-C-N 122.545 0.76 . . . . 0.0 111.434 -178.485 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 91.5 m -59.22 -42.32 90.71 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 120.98 -1.075 . . . . 0.0 110.042 -179.752 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.3 mt -65.73 -40.51 92.23 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.225 -0.922 . . . . 0.0 109.574 179.516 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -59.58 -35.87 75.13 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.145 -0.972 . . . . 0.0 110.048 179.287 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -56.49 -36.4 69.1 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 121.019 -1.05 . . . . 0.0 110.315 179.707 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.504 ' CE1' HD12 ' A' ' 55' ' ' LEU . 12.1 m-85 -57.39 -35.76 70.42 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.162 -0.961 . . . . 0.0 110.877 -179.964 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -61.62 -38.56 88.1 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.092 -1.005 . . . . 0.0 111.006 -179.145 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 2.9 mp -62.82 -39.36 84.63 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.499 0 C-N-CA 119.038 -1.065 . . . . 0.0 109.35 -179.989 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.5 tp60 -68.82 -54.63 14.69 Favored 'General case' 0 N--CA 1.506 2.366 0 C-N-CA 119.106 -1.037 . . . . 0.0 108.661 178.9 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.407 ' CD2' ' CG2' ' A' ' 52' ' ' ILE . 0.1 OUTLIER -58.72 -33.96 70.8 Favored 'General case' 0 N--CA 1.511 2.616 0 O-C-N 121.193 -0.942 . . . . 0.0 109.342 178.407 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -57.8 -41.94 83.17 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.004 -1.06 . . . . 0.0 109.98 179.655 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 -63.18 -49.91 72.41 Favored 'General case' 0 N--CA 1.508 2.453 0 C-N-CA 119.135 -1.026 . . . . 0.0 109.411 -179.982 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.436 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -64.78 -40.22 94.91 Favored 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 119.306 -0.958 . . . . 0.0 109.179 179.051 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -58.38 -34.16 70.41 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.238 -0.914 . . . . 0.0 110.348 179.707 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 17.5 mmtm -93.59 -38.68 11.24 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.048 -1.032 . . . . 0.0 110.45 179.879 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.7 t0 . . . . . 0 N--CA 1.51 2.571 0 O-C-N 121.139 -0.976 . . . . 0.0 110.531 179.992 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 43.1 m . . . . . 0 N--CA 1.497 1.912 0 CA-C-O 120.64 0.257 . . . . 0.0 110.364 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.402 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 85.8 m-20 -56.82 -39.79 74.82 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.169 -0.957 . . . . 0.0 109.951 179.739 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -60.15 -39.29 85.83 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.243 -0.911 . . . . 0.0 109.98 179.633 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 35.5 tp60 -63.76 -46.56 84.74 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.146 -0.971 . . . . 0.0 109.788 179.858 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 51.0 mt -60.88 -35.08 75.69 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.188 -0.945 . . . . 0.0 110.339 179.94 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.421 ' CE3' ' HA2' ' A' ' 149' ' ' GLY . 41.2 m0 -58.31 -39.64 79.93 Favored 'General case' 0 N--CA 1.511 2.579 0 O-C-N 120.973 -1.079 . . . . 0.0 109.675 179.623 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -63.62 -33.15 74.98 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 119.165 -1.014 . . . . 0.0 109.334 178.186 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.436 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 66.9 mt -70.6 -58.52 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.247 0 O-C-N 121.054 -1.029 . . . . 0.0 109.301 179.303 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.01 -25.18 63.44 Favored 'General case' 0 N--CA 1.511 2.616 0 C-N-CA 118.309 -1.356 . . . . 0.0 110.15 178.77 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.4 mm-40 -65.6 -38.84 90.62 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.795 -1.191 . . . . 0.0 109.396 178.495 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.504 HD12 ' CE1' ' A' ' 26' ' ' PHE . 0.2 OUTLIER -54.86 -32.56 60.86 Favored 'General case' 0 N--CA 1.512 2.675 0 O-C-N 120.952 -1.093 . . . . 0.0 110.084 179.308 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.443 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 13.7 t60 -57.5 -40.83 79.54 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.013 -1.054 . . . . 0.0 110.052 -179.666 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.436 ' NE2' HD21 ' A' ' 91' ' ' LEU . 4.8 m170 -64.23 -53.17 53.3 Favored 'General case' 0 N--CA 1.508 2.444 0 C-N-CA 119.338 -0.945 . . . . 0.0 109.342 179.33 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 5.2 tp60 -57.24 -35.08 69.26 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.265 -0.897 . . . . 0.0 109.878 179.547 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.437 ' HG2' ' CE1' ' A' ' 26' ' ' PHE . 1.1 mmt85 -66.44 -49.25 67.32 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.179 -0.951 . . . . 0.0 109.28 179.157 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 84.0 p -64.26 -40.3 95.72 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.187 -0.945 . . . . 0.0 109.152 179.216 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.429 ' O ' ' OG1' ' A' ' 65' ' ' THR . 11.8 ttt85 -62.4 -39.65 93.94 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.155 -0.966 . . . . 0.0 109.413 179.076 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.422 ' OH ' HG21 ' A' ' 19' ' ' ILE . 34.2 t80 -62.14 -51.2 68.81 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.094 -1.003 . . . . 0.0 109.431 179.403 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.427 HG22 HD13 ' A' ' 63' ' ' ILE . 79.5 mt -70.3 -36.98 69.56 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.341 0 O-C-N 121.18 -0.95 . . . . 0.0 109.449 179.342 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.418 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 10.2 t80 -67.09 -42.26 84.91 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.03 -1.044 . . . . 0.0 108.933 178.97 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.429 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 89.4 m -60.72 -41.08 94.56 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.177 -0.952 . . . . 0.0 110.181 179.91 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.402 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.8 pp -83.1 -36.72 24.61 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.997 -1.064 . . . . 0.0 112.407 -179.081 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.429 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 51.6 t80 -86.7 -35.06 19.5 Favored 'General case' 0 N--CA 1.512 2.641 0 O-C-N 120.519 -1.363 . . . . 0.0 111.817 -179.508 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.418 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 6.9 m-85 -98.3 -3.51 37.07 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 120.851 -1.155 . . . . 0.0 113.2 -178.474 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.91 -58.98 0.61 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.326 -1.484 . . . . 0.0 110.762 179.502 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 9.5 ttt85 -62.89 -29.54 70.84 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.048 -1.032 . . . . 0.0 110.722 179.987 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.7 mttt 60.16 43.71 13.77 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.801 -1.187 . . . . 0.0 109.966 -179.569 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.16 37.47 3.67 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.322 -0.861 . . . . 0.0 109.806 179.322 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.429 HD13 HG23 ' A' ' 73' ' ' ILE . 14.4 tt -156.95 162.64 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.165 -0.959 . . . . 0.0 110.221 -179.821 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -110.82 147.97 33.38 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.19 -0.944 . . . . 0.0 110.09 179.554 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -45.17 -32.68 1.95 Allowed 'General case' 0 N--CA 1.517 2.878 0 O-C-N 121.361 -0.837 . . . . 0.0 111.7 -179.779 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -62.14 -49.82 74.34 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 120.978 -1.076 . . . . 0.0 109.494 179.685 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 31.3 tp -66.54 -46.44 76.1 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.14 -1.024 . . . . 0.0 108.688 179.052 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.429 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 18.9 t80 -60.65 -37.26 80.94 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.3 -0.875 . . . . 0.0 109.535 179.143 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -72.78 -42.76 63.62 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.06 -1.025 . . . . 0.0 108.936 178.986 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.431 ' CE3' ' HB2' ' A' ' 12' ' ' ALA . 79.8 t90 -58.48 -36.43 73.72 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.312 -0.867 . . . . 0.0 109.757 179.094 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.476 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 30.7 mt -69.28 -47.45 64.56 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.079 -1.013 . . . . 0.0 109.037 179.45 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.428 HG21 HD13 ' A' ' 82' ' ' ILE . 34.2 mm -57.68 -32.91 43.67 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.588 0 O-C-N 121.18 -0.95 . . . . 0.0 110.151 179.231 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.33 -22.33 28.54 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 120.951 -1.093 . . . . 0.0 111.747 -179.886 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.419 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 10.5 mm-40 -100.35 20.29 15.08 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 120.752 -1.217 . . . . 0.0 112.046 179.956 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 71.3 tttt 72.7 83.06 0.13 Allowed 'General case' 0 N--CA 1.51 2.536 0 O-C-N 120.974 -1.079 . . . . 0.0 111.29 179.393 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.476 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 28.0 m-85 -139.32 -63.69 0.51 Allowed 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.509 -0.745 . . . . 0.0 110.117 -179.385 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -114.68 -171.77 1.99 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.395 -0.815 . . . . 0.0 110.147 179.877 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.443 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 21.2 t0 -123.17 102.88 8.21 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.158 -0.964 . . . . 0.0 110.263 -179.839 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.11 -40.41 74.92 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.159 -0.963 . . . . 0.0 109.892 179.753 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 20.7 tp -62.52 -46.6 87.67 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.156 -0.965 . . . . 0.0 109.611 179.71 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.436 HD21 ' NE2' ' A' ' 57' ' ' HIS . 65.9 tp -65.81 -44.88 84.33 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.261 -0.975 . . . . 0.0 108.947 179.216 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.431 HD13 HG21 ' A' ' 92' ' ' ILE . 54.1 mt -58.28 -36.5 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.508 0 O-C-N 121.149 -0.969 . . . . 0.0 108.74 178.654 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.65 -40.21 96.29 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.086 -1.009 . . . . 0.0 109.269 178.733 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.427 ' HD2' ' CZ ' ' A' ' 100' ' ' TYR . 5.2 mmtm -59.15 -47.97 83.34 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.085 -1.009 . . . . 0.0 109.393 179.295 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.411 ' CH2' HD21 ' A' ' 91' ' ' LEU . 5.9 m0 -59.13 -33.19 70.59 Favored 'General case' 0 N--CA 1.508 2.466 0 C-N-CA 119.542 -0.863 . . . . 0.0 110.301 179.591 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.36 -30.68 30.17 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.053 -1.03 . . . . 0.0 110.851 179.547 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.1 mmtt -53.69 -176.95 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.738 0 O-C-N 120.959 -1.088 . . . . 0.0 110.674 -179.972 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -103.36 134.71 46.28 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.126 -0.984 . . . . 0.0 109.699 179.207 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 95.77 11.19 55.64 Favored Glycine 0 N--CA 1.493 2.475 0 C-N-CA 120.172 -1.013 . . . . 0.0 111.094 -179.465 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.427 ' CZ ' ' HD2' ' A' ' 94' ' ' LYS . 47.8 m-85 -117.82 71.22 0.81 Allowed 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 119.405 1.602 . . . . 0.0 109.876 179.738 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -95.21 -36.16 11.56 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.129 -0.982 . . . . 0.0 110.666 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.65 72.88 1.09 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.025 -1.047 . . . . 0.0 110.736 -179.577 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -122.24 154.73 37.13 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.032 -1.043 . . . . 0.0 109.945 179.449 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.435 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.7 p -116.11 -31.45 5.68 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -179.15 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.538 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.6 m -141.71 -167.87 2.53 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 120.119 -1.613 . . . . 0.0 109.961 179.257 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 20.1 mt -95.92 -38.99 10.02 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.12 -0.987 . . . . 0.0 109.929 179.139 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -101.86 28.48 5.66 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 120.969 -1.082 . . . . 0.0 109.999 178.055 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.538 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.297 1.8 t -126.96 15.02 7.4 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.086 -1.009 . . . . 0.0 109.351 -179.631 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.405 ' CG2' ' O ' ' A' ' 108' ' ' CYS . 1.0 OUTLIER -159.48 37.54 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.375 0 O-C-N 120.832 -1.167 . . . . 0.0 111.018 -178.71 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.501 2.12 0 O-C-N 120.643 -1.285 . . . . 0.0 111.652 -178.987 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 2.4 m . . . . . 0 N--CA 1.493 1.718 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 49.5 t -100.67 155.09 18.08 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.2 -0.937 . . . . 0.0 109.526 179.262 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.446 HG22 HD11 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -71.4 -37.07 63.47 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.37 0 O-C-N 121.102 -0.999 . . . . 0.0 110.877 -179.444 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.489 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 11.2 p -53.57 -33.36 54.52 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 120.89 -1.131 . . . . 0.0 111.22 -178.824 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.61 -34.4 74.19 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.051 -1.031 . . . . 0.0 109.539 178.35 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 47.2 t -80.64 125.34 80.78 Favored Pre-proline 0 N--CA 1.504 2.271 0 O-C-N 121.131 -0.98 . . . . 0.0 109.824 179.629 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -65.41 175.13 4.42 Favored 'Trans proline' 0 N--CA 1.489 1.229 0 O-C-N 123.181 1.095 . . . . 0.0 110.803 179.516 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.12 -36.39 61.64 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.275 -0.891 . . . . 0.0 110.791 -179.721 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.56 -40.69 79.5 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 120.992 -1.067 . . . . 0.0 110.16 -179.657 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -70.07 -41.35 74.24 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.222 179.233 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.9 mt -65.7 -38.78 90.16 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.579 179.148 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -61.23 -39.35 89.95 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.175 -0.953 . . . . 0.0 109.838 179.645 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -59.75 -38.57 82.11 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.131 -0.981 . . . . 0.0 110.143 179.825 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -60.8 -44.31 97.03 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.127 -0.983 . . . . 0.0 109.917 179.996 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.47 -44.42 97.13 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.168 -0.957 . . . . 0.0 109.833 179.854 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.93 -34.27 71.54 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.258 -0.901 . . . . 0.0 110.288 179.663 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 24.4 mttt -75.9 -31.96 59.42 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.045 -1.035 . . . . 0.0 110.934 179.997 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.14 23.77 8.7 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 120.926 -1.108 . . . . 0.0 111.681 -179.934 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.59 46.62 53.36 Favored Glycine 0 N--CA 1.5 2.945 0 O-C-N 120.663 -1.273 . . . . 0.0 110.722 179.257 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.9 t -147.61 -164.92 2.12 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.092 -1.24 . . . . 0.0 110.371 179.842 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.6 mp0 -136.27 150.83 49.11 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.227 -0.921 . . . . 0.0 110.285 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 8.0 p -130.72 160.93 41.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 121.203 -0.935 . . . . 0.0 110.034 179.79 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 31.9 t -167.98 81.18 0.18 Allowed 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.126 -0.984 . . . . 0.0 111.233 -179.964 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.489 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 42.7 t80 -93.86 161.39 14.33 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.197 -0.94 . . . . 0.0 110.099 179.761 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 4.5 m80 -139.47 -60.55 0.56 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.605 -0.684 . . . . 0.0 109.175 179.065 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -132.77 152.21 51.82 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.44 -0.787 . . . . 0.0 109.198 178.967 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 25.7 p -97.08 156.56 16.32 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.13 -0.981 . . . . 0.0 110.803 -179.84 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 21.3 m -76.48 -24.4 15.88 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 O-C-N 121.315 -0.866 . . . . 0.0 111.859 -179.384 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -49.83 -53.69 23.9 Favored 'General case' 0 N--CA 1.515 2.822 0 O-C-N 120.728 -1.232 . . . . 0.0 110.42 -179.733 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 25.2 p -133.88 -163.05 1.31 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.308 -0.87 . . . . 0.0 110.387 179.851 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . 0.421 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.19 63.46 0.63 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 108.209 -1.956 . . . . 0.0 108.209 178.549 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 38.4 t -104.49 144.77 31.22 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.301 -1.117 . . . . 0.0 110.068 -179.175 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 19.0 mtt85 -101.59 44.63 1.0 Allowed 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.398 -0.813 . . . . 0.0 109.509 179.275 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 76.61 95.93 0.18 Allowed Glycine 0 N--CA 1.488 2.123 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 -179.823 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.3 p -109.02 126.26 52.94 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.093 -1.239 . . . . 0.0 110.435 179.842 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -148.68 150.37 33.09 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.16 -0.962 . . . . 0.0 110.27 -179.543 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.497 1.914 0 O-C-N 121.27 -0.894 . . . . 0.0 110.665 -179.747 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.431 ' HB1' ' CZ2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.507 2.424 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 . . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -71.8 166.84 28.29 Favored 'Trans proline' 0 C--N 1.317 -1.083 0 O-C-N 123.174 1.091 . . . . 0.0 110.696 -179.617 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -47.53 -32.61 5.48 Favored 'General case' 0 N--CA 1.516 2.838 0 O-C-N 121.549 -0.719 . . . . 0.0 111.404 -179.814 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.07 -32.31 42.35 Favored Glycine 0 N--CA 1.498 2.822 0 O-C-N 121.047 -1.033 . . . . 0.0 110.571 179.636 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -52.01 -33.2 37.3 Favored 'General case' 0 N--CA 1.514 2.741 0 O-C-N 120.935 -1.332 . . . . 0.0 110.44 179.758 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -53.55 -34.99 60.26 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.108 -0.995 . . . . 0.0 110.208 179.457 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.13 -39.77 83.36 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.264 -0.897 . . . . 0.0 110.034 179.574 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.1 pt -113.51 34.61 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.21 -0.931 . . . . 0.0 110.497 179.658 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.426 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 7.4 tmtt? -85.02 -43.31 0.67 Allowed Pre-proline 0 N--CA 1.51 2.539 0 O-C-N 121.07 -1.019 . . . . 0.0 113.441 -178.993 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.426 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.4 Cg_endo -75.73 -36.74 1.99 Allowed 'Trans proline' 0 N--CA 1.486 1.074 0 O-C-N 122.591 0.785 . . . . 0.0 111.699 -178.134 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 89.4 m -60.61 -42.83 97.59 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 120.942 -1.099 . . . . 0.0 109.934 -179.737 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 84.8 mt -65.35 -39.66 92.63 Favored 'General case' 0 N--CA 1.507 2.401 0 C-N-CA 119.477 -0.889 . . . . 0.0 109.554 179.51 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -58.39 -35.85 72.65 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.138 -0.976 . . . . 0.0 110.127 179.355 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -56.63 -36.0 68.97 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.058 -1.026 . . . . 0.0 110.368 179.647 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.43 ' CE2' HD22 ' A' ' 55' ' ' LEU . 22.2 m-85 -57.72 -38.78 75.89 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.04 -1.037 . . . . 0.0 110.479 -179.965 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -63.07 -23.35 67.4 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.214 -0.929 . . . . 0.0 111.82 -179.483 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 2.6 mp -81.21 -33.59 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.412 0 O-C-N 120.759 -1.213 . . . . 0.0 109.827 179.659 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -82.37 -36.31 26.92 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 120.997 -1.064 . . . . 0.0 109.28 178.557 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.29 -31.88 62.67 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.118 -0.989 . . . . 0.0 110.102 178.843 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -68.75 -35.73 77.47 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 120.842 -1.161 . . . . 0.0 110.01 179.479 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -65.87 -41.8 91.14 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.012 -1.055 . . . . 0.0 109.428 179.583 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.418 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -67.37 -41.94 84.22 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.215 -0.928 . . . . 0.0 109.223 179.142 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.0 mm100 -58.72 -34.39 71.29 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.352 -0.843 . . . . 0.0 110.365 179.812 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.2 mtmm -92.91 -38.88 11.47 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.029 -1.045 . . . . 0.0 110.372 179.887 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.51 2.55 0 O-C-N 121.204 -0.935 . . . . 0.0 110.011 179.847 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.504 2.232 0 CA-C-O 120.43 0.157 . . . . 0.0 110.747 . . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -58.71 -39.36 80.6 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.181 -0.949 . . . . 0.0 110.132 -179.889 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -60.39 -39.67 88.12 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.15 -0.969 . . . . 0.0 110.086 179.898 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 39.3 tp60 -60.85 -42.23 97.41 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.098 -1.001 . . . . 0.0 110.02 -179.948 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.4 mt -60.08 -38.1 81.9 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.162 -0.961 . . . . 0.0 110.436 179.988 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.443 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 52.6 m0 -57.05 -40.47 76.88 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.094 -1.003 . . . . 0.0 109.574 179.794 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -60.88 -35.47 76.7 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.321 -0.862 . . . . 0.0 109.799 179.007 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.418 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 73.8 mt -65.23 -51.45 65.08 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 121.109 -0.994 . . . . 0.0 109.394 179.585 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.422 ' HG3' ' N ' ' A' ' 54' ' ' GLN . 0.0 OUTLIER -64.8 -30.78 71.79 Favored 'General case' 0 N--CA 1.501 2.123 0 C-N-CA 118.65 -1.22 . . . . 0.0 109.692 179.307 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.422 ' N ' ' HG3' ' A' ' 53' ' ' MET . 5.0 mm100 -64.95 -36.79 85.52 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.089 -1.007 . . . . 0.0 109.358 178.733 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.43 HD22 ' CE2' ' A' ' 26' ' ' PHE . 13.9 mt -52.78 -33.71 50.0 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.081 -1.012 . . . . 0.0 109.928 179.217 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.434 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 19.6 t60 -56.71 -38.02 71.73 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.086 -1.009 . . . . 0.0 109.771 179.235 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.439 ' NE2' HD21 ' A' ' 91' ' ' LEU . 5.9 m170 -60.0 -49.64 76.88 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.027 -1.046 . . . . 0.0 109.048 178.999 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 26.2 tp60 -59.69 -38.17 80.82 Favored 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 119.634 -0.826 . . . . 0.0 109.427 179.134 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.415 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.86 -48.83 75.16 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.233 -0.987 . . . . 0.0 108.879 179.03 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 92.1 p -64.58 -42.14 95.81 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.148 -0.97 . . . . 0.0 108.763 178.834 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 46.8 ttt85 -62.54 -39.83 94.86 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.185 -0.947 . . . . 0.0 109.303 178.803 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 44.2 t80 -61.96 -49.55 75.66 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.261 -0.9 . . . . 0.0 109.386 179.494 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.438 HD13 HG23 ' A' ' 63' ' ' ILE . 90.2 mt -71.76 -39.16 68.14 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.36 0 O-C-N 121.26 -0.9 . . . . 0.0 109.022 179.153 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.431 ' CE1' HG22 ' A' ' 92' ' ' ILE . 40.3 t80 -62.77 -41.17 99.11 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.136 -0.977 . . . . 0.0 109.005 178.901 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 51.8 m -67.1 -38.19 85.25 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.202 -0.936 . . . . 0.0 110.793 -179.825 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.4 ' HA ' ' CB ' ' A' ' 70' ' ' ARG . 3.7 pp -83.17 -36.35 24.78 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 120.949 -1.094 . . . . 0.0 112.489 -178.875 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.437 ' CD1' ' HB2' ' A' ' 78' ' ' TYR . 66.1 t80 -86.55 -35.4 19.53 Favored 'General case' 0 N--CA 1.512 2.652 0 O-C-N 120.54 -1.35 . . . . 0.0 111.907 -179.299 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -98.35 -3.39 37.16 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 120.873 -1.142 . . . . 0.0 113.077 -178.649 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -139.25 -60.27 0.57 Allowed 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.383 -1.448 . . . . 0.0 111.04 179.698 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.4 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 6.9 tpt85 -59.66 -29.59 68.16 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.081 -1.012 . . . . 0.0 110.754 -179.749 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.8 tttt 59.68 43.44 15.58 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.866 -1.146 . . . . 0.0 109.947 -179.609 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -117.99 37.34 4.0 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.425 -0.797 . . . . 0.0 109.925 179.401 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.476 HG23 HD12 ' A' ' 73' ' ' ILE . 14.2 tt -157.19 162.27 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.19 -0.944 . . . . 0.0 110.345 -179.88 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.5 t -110.7 149.46 30.45 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.184 -0.948 . . . . 0.0 109.788 179.356 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.0 ttmt -45.31 -33.11 2.28 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.273 -0.892 . . . . 0.0 111.587 -179.78 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -62.36 -49.31 76.06 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 120.928 -1.108 . . . . 0.0 109.479 179.379 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.18 -47.62 76.32 Favored 'General case' 0 N--CA 1.507 2.395 0 C-N-CA 119.149 -1.02 . . . . 0.0 108.6 178.917 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.437 ' HB2' ' CD1' ' A' ' 67' ' ' TYR . 18.1 t80 -60.21 -38.72 84.18 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 119.661 -0.815 . . . . 0.0 109.692 179.436 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -69.59 -42.05 74.97 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.065 -1.022 . . . . 0.0 108.825 178.766 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.431 ' CZ2' ' HB1' ' A' ' 12' ' ' ALA . 67.9 t90 -58.27 -38.88 77.83 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.243 -0.911 . . . . 0.0 109.595 179.116 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.45 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 9.5 mt -65.65 -52.11 54.28 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.234 -0.916 . . . . 0.0 109.282 179.425 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.438 HG21 HD13 ' A' ' 82' ' ' ILE . 35.6 mm -59.12 -32.73 48.58 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.521 0 O-C-N 121.23 -0.919 . . . . 0.0 110.098 179.466 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 20.0 tttp -85.84 -14.3 45.43 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 120.938 -1.101 . . . . 0.0 112.032 -179.913 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.42 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 22.3 mm-40 -108.53 21.39 17.35 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 120.554 -1.341 . . . . 0.0 112.076 -179.97 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 73.25 78.4 0.14 Allowed 'General case' 0 N--CA 1.511 2.576 0 O-C-N 120.981 -1.074 . . . . 0.0 111.418 179.278 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.45 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 25.9 m-85 -134.04 -65.0 0.68 Allowed 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.493 -0.755 . . . . 0.0 109.808 -179.869 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -121.16 -175.61 3.1 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.304 -0.873 . . . . 0.0 109.937 179.68 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.434 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 7.9 t0 -117.3 122.08 42.92 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.145 -0.972 . . . . 0.0 110.134 179.906 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 12.3 mtmt -74.71 -40.57 61.25 Favored 'General case' 0 N--CA 1.506 2.37 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.725 179.742 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.16 -42.96 99.76 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.157 -0.964 . . . . 0.0 109.341 179.514 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.439 HD21 ' NE2' ' A' ' 57' ' ' HIS . 22.1 tp -63.73 -48.4 77.2 Favored 'General case' 0 N--CA 1.507 2.381 0 C-N-CA 119.289 -0.964 . . . . 0.0 109.14 179.737 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.461 HG21 HD12 ' A' ' 92' ' ' ILE . 49.0 mt -60.95 -37.14 76.37 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.447 0 O-C-N 121.081 -1.012 . . . . 0.0 108.336 178.198 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.79 -39.55 76.53 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.125 -0.984 . . . . 0.0 108.694 177.907 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.437 ' CD ' ' CZ ' ' A' ' 100' ' ' TYR . 5.7 mmtm -58.72 -45.32 89.86 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.175 -0.953 . . . . 0.0 109.295 178.933 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.0 m0 -64.12 -35.37 80.55 Favored 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 119.485 -0.886 . . . . 0.0 110.079 179.356 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.23 -29.66 34.41 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.064 -1.023 . . . . 0.0 110.71 179.369 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.8 mmtt -53.72 -176.85 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.681 0 O-C-N 121.0 -1.062 . . . . 0.0 110.607 179.802 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 36.8 m -103.66 131.83 50.46 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.137 -0.977 . . . . 0.0 109.687 179.175 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.27 9.55 50.82 Favored Glycine 0 N--CA 1.493 2.47 0 C-N-CA 120.242 -0.98 . . . . 0.0 111.053 -179.458 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.437 ' CZ ' ' CD ' ' A' ' 94' ' ' LYS . 51.4 m-85 -118.22 71.13 0.82 Allowed 'General case' 0 N--CA 1.493 1.724 0 CA-C-N 119.459 1.629 . . . . 0.0 109.921 179.697 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -95.17 -32.41 13.07 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.087 -1.008 . . . . 0.0 110.872 179.979 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -126.55 68.42 1.23 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.923 -1.11 . . . . 0.0 110.883 -179.516 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.53 155.12 29.22 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.907 -1.121 . . . . 0.0 109.85 179.225 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.432 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.8 p -115.96 -34.8 4.63 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.156 -0.965 . . . . 0.0 113.473 -178.852 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.562 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.0 m -139.59 -167.6 2.3 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 120.18 -1.575 . . . . 0.0 110.088 179.501 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 14.8 mt -96.65 -39.51 9.46 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.204 -0.935 . . . . 0.0 110.048 179.338 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -100.86 28.03 5.53 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 120.967 -1.083 . . . . 0.0 109.98 177.903 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.562 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.301 1.8 t -125.68 14.81 8.12 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.107 -0.995 . . . . 0.0 109.017 -179.707 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.1 pt -158.11 36.06 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.263 0 O-C-N 120.832 -1.168 . . . . 0.0 110.955 -178.492 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 60.7 tp60 . . . . . 0 N--CA 1.499 1.998 0 O-C-N 120.707 -1.246 . . . . 0.0 111.45 -178.671 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 6.6 m . . . . . 0 N--CA 1.494 1.772 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 37.5 t -86.19 154.7 21.13 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.273 -0.892 . . . . 0.0 109.73 179.482 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.465 ' CG2' ' CE1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -76.68 -29.85 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.383 0 O-C-N 121.139 -0.976 . . . . 0.0 111.593 -179.201 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.458 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.7 p -58.01 -35.38 71.17 Favored 'General case' 0 N--CA 1.511 2.607 0 O-C-N 120.655 -1.278 . . . . 0.0 110.659 -179.163 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 1.2 ttt-85 -55.84 -32.92 64.04 Favored 'General case' 0 N--CA 1.513 2.686 0 O-C-N 121.023 -1.048 . . . . 0.0 110.071 178.904 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 60.8 t -79.44 124.6 83.93 Favored Pre-proline 0 N--CA 1.504 2.243 0 O-C-N 121.119 -0.988 . . . . 0.0 109.936 179.729 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.21 178.76 2.3 Favored 'Trans proline' 0 N--CA 1.488 1.203 0 O-C-N 123.11 1.058 . . . . 0.0 110.81 179.71 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -75.21 -36.93 61.33 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.255 -0.903 . . . . 0.0 110.574 179.979 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.17 -40.54 77.52 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 120.981 -1.074 . . . . 0.0 110.066 -179.761 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -69.48 -42.32 74.98 Favored 'General case' 0 N--CA 1.505 2.301 0 C-N-CA 119.402 -0.919 . . . . 0.0 109.075 179.247 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.9 mt -64.41 -38.79 92.25 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.52 -0.872 . . . . 0.0 109.476 179.184 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -60.13 -39.39 86.12 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.16 -0.962 . . . . 0.0 109.929 179.728 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -58.89 -38.55 79.11 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.187 -0.946 . . . . 0.0 110.263 179.903 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -63.48 -39.76 95.3 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.144 -0.973 . . . . 0.0 109.993 179.783 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.84 -41.95 97.71 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 121.211 -0.931 . . . . 0.0 109.82 179.891 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -60.21 -38.1 82.33 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.158 -0.964 . . . . 0.0 109.823 179.515 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -58.0 -35.37 71.13 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.132 -0.98 . . . . 0.0 110.555 179.859 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -105.08 16.63 25.51 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 120.963 -1.085 . . . . 0.0 112.061 -179.993 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 58.01 44.44 94.59 Favored Glycine 0 N--CA 1.497 2.731 0 O-C-N 120.635 -1.291 . . . . 0.0 110.174 179.448 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 7.4 t -137.83 -162.7 1.33 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.136 -1.214 . . . . 0.0 110.028 179.957 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -136.97 147.11 46.12 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.104 -0.997 . . . . 0.0 110.29 179.963 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.5 p -133.67 161.62 40.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.165 -0.959 . . . . 0.0 110.288 -179.858 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 45.6 t -164.06 111.16 1.1 Allowed 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.302 -0.874 . . . . 0.0 110.926 179.948 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.465 ' CE1' ' CG2' ' A' ' 121' ' ' ILE . 81.7 t80 -104.83 137.24 42.92 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.226 -0.921 . . . . 0.0 110.869 -179.783 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 11.3 m-70 -111.93 -56.76 2.35 Favored 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 178.122 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -151.71 156.03 39.5 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.5 -0.75 . . . . 0.0 109.574 179.115 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . 0.424 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 27.3 p -95.0 155.24 16.81 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.07 -1.019 . . . . 0.0 111.036 -179.553 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.9 p -72.38 -24.09 21.8 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.461 0 O-C-N 121.391 -0.818 . . . . 0.0 111.696 -179.528 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -51.79 -53.08 43.9 Favored 'General case' 0 N--CA 1.513 2.714 0 O-C-N 120.749 -1.219 . . . . 0.0 110.182 -179.918 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.443 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 28.3 p -135.41 -164.94 1.61 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.208 -0.932 . . . . 0.0 111.026 -179.997 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.39 59.42 0.71 Allowed Glycine 0 N--CA 1.491 2.315 0 N-CA-C 107.9 -2.08 . . . . 0.0 107.9 178.539 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 21.0 t -100.59 138.34 37.78 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.401 -1.058 . . . . 0.0 109.809 -179.228 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -96.44 51.58 1.19 Allowed 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.233 -0.917 . . . . 0.0 109.623 179.108 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 72.0 99.37 0.06 OUTLIER Glycine 0 N--CA 1.487 2.071 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 179.761 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 p -110.73 127.16 55.23 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.261 -1.14 . . . . 0.0 110.099 179.38 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -152.03 148.9 28.25 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.061 -1.024 . . . . 0.0 110.479 -179.391 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.495 1.785 0 O-C-N 121.135 -0.978 . . . . 0.0 110.261 -179.891 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.444 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.509 2.5 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 . . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -70.91 161.79 44.89 Favored 'Trans proline' 0 C--N 1.316 -1.175 0 O-C-N 123.374 1.197 . . . . 0.0 110.63 -179.928 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -48.51 -31.93 7.16 Favored 'General case' 0 N--CA 1.515 2.799 0 O-C-N 121.366 -0.833 . . . . 0.0 111.441 -179.761 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.21 -34.13 46.92 Favored Glycine 0 N--CA 1.499 2.845 0 O-C-N 120.95 -1.094 . . . . 0.0 110.588 179.939 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -54.57 -31.03 55.96 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 120.913 -1.346 . . . . 0.0 110.879 179.818 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -54.09 -37.61 64.45 Favored 'General case' 0 N--CA 1.512 2.664 0 O-C-N 120.984 -1.073 . . . . 0.0 110.169 179.756 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.2 mptt -59.11 -36.4 75.12 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.154 -0.966 . . . . 0.0 110.224 179.492 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.427 HG22 ' OH ' ' A' ' 62' ' ' TYR . 2.7 pt -116.9 36.04 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.973 0 O-C-N 121.089 -1.007 . . . . 0.0 110.527 179.705 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.434 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.6 OUTLIER -83.97 -42.71 0.77 Allowed Pre-proline 0 N--CA 1.509 2.499 0 O-C-N 121.095 -1.003 . . . . 0.0 113.264 -179.092 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.434 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.7 Cg_endo -75.95 -38.57 1.17 Allowed 'Trans proline' 0 N--CA 1.487 1.126 0 O-C-N 122.596 0.787 . . . . 0.0 111.631 -178.292 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 68.2 m -60.27 -43.86 95.81 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 120.991 -1.068 . . . . 0.0 109.99 -179.768 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.421 HD22 ' CE2' ' A' ' 86' ' ' TYR . 2.2 mt -62.88 -37.92 88.8 Favored 'General case' 0 N--CA 1.507 2.387 0 C-N-CA 119.331 -0.947 . . . . 0.0 109.689 179.435 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 4.1 m -57.5 -37.51 73.1 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.101 -0.999 . . . . 0.0 110.24 179.627 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -58.01 -38.64 76.55 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.075 -1.015 . . . . 0.0 109.997 179.699 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.434 ' CD2' ' HD2' ' A' ' 59' ' ' ARG . 13.9 m-85 -57.76 -39.32 77.14 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.178 -0.951 . . . . 0.0 110.26 179.821 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.64 -22.53 65.35 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.199 -0.938 . . . . 0.0 111.668 -179.554 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 2.7 mp -80.22 -34.12 14.69 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.469 0 O-C-N 120.842 -1.161 . . . . 0.0 109.978 179.931 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 40.4 tt0 -81.29 -34.11 32.19 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.908 -1.12 . . . . 0.0 109.514 178.786 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.64 -32.7 58.17 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.062 -1.024 . . . . 0.0 109.841 178.769 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -68.76 -34.94 76.44 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 120.969 -1.082 . . . . 0.0 109.878 179.307 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.74 -41.07 79.47 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.047 -1.033 . . . . 0.0 109.647 179.564 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.419 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -65.57 -40.98 93.37 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.181 -0.95 . . . . 0.0 109.499 179.342 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 -58.33 -34.64 70.84 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.212 -0.93 . . . . 0.0 110.507 -179.996 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.37 -39.17 10.16 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 120.939 -1.101 . . . . 0.0 110.678 -179.904 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 N--CA 1.511 2.576 0 O-C-N 121.128 -0.982 . . . . 0.0 110.139 -179.963 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 67.1 m . . . . . 0 N--CA 1.496 1.856 0 CA-C-O 120.64 0.257 . . . . 0.0 110.393 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -55.1 -36.87 66.15 Favored 'General case' 0 N--CA 1.512 2.652 0 O-C-N 121.19 -0.944 . . . . 0.0 110.069 179.628 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -58.98 -39.99 83.46 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.124 -0.985 . . . . 0.0 109.985 179.651 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.2 tp60 -61.49 -40.27 93.97 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.121 -0.987 . . . . 0.0 109.82 179.695 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 94.3 mt -66.51 -34.63 78.35 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.213 -0.929 . . . . 0.0 110.371 179.783 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.43 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 37.3 m0 -58.52 -36.83 74.45 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.037 -1.039 . . . . 0.0 109.449 179.703 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -66.66 -33.7 76.23 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.757 -1.214 . . . . 0.0 109.227 177.96 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.419 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 75.5 mt -70.33 -54.61 17.77 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 O-C-N 120.986 -1.071 . . . . 0.0 109.323 179.285 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.477 ' CE ' ' HB2' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -60.71 -32.64 71.87 Favored 'General case' 0 N--CA 1.508 2.465 0 C-N-CA 118.61 -1.236 . . . . 0.0 109.54 178.868 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.38 -39.59 87.82 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 120.875 -1.14 . . . . 0.0 109.398 179.022 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.429 HD21 ' CE2' ' A' ' 26' ' ' PHE . 21.2 mt -54.59 -34.31 61.77 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.097 -1.002 . . . . 0.0 110.012 179.242 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.432 ' CE1' ' HB2' ' A' ' 88' ' ' ASP . 82.2 t60 -56.46 -40.23 74.49 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 120.991 -1.068 . . . . 0.0 109.626 179.184 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.423 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 7.5 m170 -61.23 -49.1 78.49 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.206 -0.934 . . . . 0.0 108.991 178.966 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -62.72 -41.01 98.95 Favored 'General case' 0 N--CA 1.504 2.249 0 C-N-CA 119.417 -0.913 . . . . 0.0 108.87 178.747 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.434 ' HD2' ' CD2' ' A' ' 26' ' ' PHE . 2.5 mtp85 -61.18 -45.9 92.7 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.247 -0.908 . . . . 0.0 109.302 179.087 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 93.2 p -65.9 -40.02 91.13 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.231 -0.918 . . . . 0.0 109.194 179.226 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.4 ' O ' ' OG1' ' A' ' 65' ' ' THR . 24.0 ttt85 -65.17 -38.73 91.48 Favored 'General case' 0 N--CA 1.508 2.452 0 C-N-CA 119.212 -0.995 . . . . 0.0 109.453 179.082 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.427 ' OH ' HG22 ' A' ' 19' ' ' ILE . 43.0 t80 -61.21 -48.3 82.14 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.124 -0.985 . . . . 0.0 109.52 179.507 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.413 HG23 HD13 ' A' ' 63' ' ' ILE . 86.9 mt -76.77 -41.66 33.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.3 0 O-C-N 121.217 -0.927 . . . . 0.0 109.216 179.399 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.443 ' OH ' ' NH1' ' A' ' 96' ' ' ARG . 46.8 t80 -59.54 -31.14 69.13 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.253 -0.904 . . . . 0.0 109.831 178.71 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.4 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 59.7 m -80.67 -37.52 30.7 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 120.917 -1.115 . . . . 0.0 110.364 179.837 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.408 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -82.96 -32.44 27.1 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 120.942 -1.099 . . . . 0.0 112.512 -179.061 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.426 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 62.1 t80 -86.52 -35.31 19.64 Favored 'General case' 0 N--CA 1.512 2.654 0 O-C-N 120.696 -1.253 . . . . 0.0 111.916 -179.207 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -98.37 -23.83 15.44 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.851 -1.156 . . . . 0.0 112.8 -178.29 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.421 ' HE2' ' CD2' ' A' ' 64' ' ' TYR . 0.7 OUTLIER -114.8 -56.45 2.38 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.617 -1.302 . . . . 0.0 111.26 -179.311 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.6 ttt85 -67.67 -30.65 70.24 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.067 -1.02 . . . . 0.0 110.63 -179.906 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 tttm 59.08 44.72 15.67 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 120.829 -1.169 . . . . 0.0 110.164 -179.817 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -114.24 37.05 3.47 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.307 -0.871 . . . . 0.0 109.716 179.181 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.451 HG22 HD13 ' A' ' 73' ' ' ILE . 14.6 tt -157.83 162.65 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.253 -0.904 . . . . 0.0 110.14 -179.694 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -108.74 148.89 29.81 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.098 -1.001 . . . . 0.0 110.226 179.759 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.7 tttm -46.6 -32.26 3.36 Favored 'General case' 0 N--CA 1.516 2.864 0 O-C-N 121.392 -0.818 . . . . 0.0 111.495 -179.859 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.29 -51.76 66.38 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.869 -1.145 . . . . 0.0 109.253 179.478 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 44.8 tp -65.34 -44.16 88.6 Favored 'General case' 0 N--CA 1.505 2.292 0 C-N-CA 119.19 -1.004 . . . . 0.0 108.504 178.812 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.426 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 18.0 t80 -59.57 -40.61 87.91 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.397 -0.814 . . . . 0.0 109.36 178.979 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -72.68 -42.95 63.7 Favored 'General case' 0 N--CA 1.504 2.249 0 C-N-CA 119.369 -0.932 . . . . 0.0 108.687 178.603 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.444 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 85.9 t90 -56.86 -35.76 69.25 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.228 -0.92 . . . . 0.0 109.432 178.462 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.452 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 13.9 mt -66.89 -59.43 3.53 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.159 -0.963 . . . . 0.0 108.963 178.898 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.419 HD11 ' CE1' ' A' ' 78' ' ' TYR . 1.6 mt -56.83 -27.02 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.614 0 O-C-N 120.938 -1.101 . . . . 0.0 109.99 179.577 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 6.3 mmtm -82.53 -18.54 41.12 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.793 -1.192 . . . . 0.0 111.105 178.669 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.426 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 72.4 mm-40 -108.72 23.32 14.7 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.731 -1.23 . . . . 0.0 111.968 179.983 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.413 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 2.6 tptp 76.51 71.2 0.07 Allowed 'General case' 0 N--CA 1.514 2.76 0 O-C-N 121.198 -0.939 . . . . 0.0 111.827 179.326 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.452 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 26.4 m-85 -133.13 -62.43 0.8 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.45 -0.781 . . . . 0.0 109.202 179.354 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -131.09 162.38 29.99 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.495 -0.753 . . . . 0.0 109.738 179.736 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.432 ' HB2' ' CE1' ' A' ' 56' ' ' HIS . 9.8 t70 -115.12 112.93 23.31 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.109 -0.995 . . . . 0.0 110.093 179.7 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 11.2 mttt -58.07 -37.17 73.94 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.212 -0.93 . . . . 0.0 110.286 -179.975 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.2 tp -60.61 -37.12 80.37 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.122 -0.986 . . . . 0.0 110.385 -179.734 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.422 HD23 ' CD2' ' A' ' 57' ' ' HIS . 55.2 tp -71.42 -49.11 45.07 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.998 -1.064 . . . . 0.0 108.835 179.343 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.429 HG21 ' CE1' ' A' ' 64' ' ' TYR . 51.7 mt -62.02 -38.93 81.99 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.307 0 O-C-N 121.124 -0.985 . . . . 0.0 108.347 178.245 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.32 -37.74 83.8 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.179 -0.95 . . . . 0.0 109.157 178.333 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.2 mmtm -57.89 -42.42 84.58 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.062 -1.024 . . . . 0.0 109.754 179.469 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.9 m0 -67.01 -31.65 72.35 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.231 -0.918 . . . . 0.0 110.869 -179.778 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . 0.443 ' NH1' ' OH ' ' A' ' 64' ' ' TYR . 0.0 OUTLIER -77.39 -32.62 54.96 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.926 -1.109 . . . . 0.0 110.426 178.89 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 15.6 mmtt -54.98 -176.57 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.677 0 O-C-N 120.935 -1.103 . . . . 0.0 110.367 179.575 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 68.1 m -106.56 139.71 40.58 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.238 -0.914 . . . . 0.0 109.658 179.37 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.99 -22.05 41.98 Favored Glycine 0 N--CA 1.494 2.507 0 C-N-CA 119.83 -1.176 . . . . 0.0 110.735 -179.365 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -92.35 58.17 3.16 Favored 'General case' 0 N--CA 1.504 2.248 0 CA-C-N 119.254 1.527 . . . . 0.0 110.193 179.909 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -78.39 -38.61 41.31 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.076 -1.015 . . . . 0.0 109.865 179.39 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -113.99 79.66 1.28 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.095 -1.003 . . . . 0.0 109.753 179.664 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 14.3 tp -115.9 137.1 52.41 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.217 -0.927 . . . . 0.0 109.991 -179.49 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.423 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.9 p -108.39 -38.76 5.63 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.262 -0.899 . . . . 0.0 112.025 179.81 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.595 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 5.4 m -139.29 -170.31 2.86 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 120.36 -1.463 . . . . 0.0 109.718 178.881 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 12.4 mt -97.88 -35.58 10.45 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 120.896 -1.128 . . . . 0.0 110.84 179.32 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 -102.49 33.69 3.06 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.819 -1.176 . . . . 0.0 109.264 177.819 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.595 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.313 1.7 t -128.48 16.42 6.52 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.186 -0.946 . . . . 0.0 108.988 -179.017 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.3 pt -157.91 35.94 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 120.68 -1.263 . . . . 0.0 111.114 -178.732 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 . . . . . 0 N--CA 1.501 2.111 0 O-C-N 120.637 -1.29 . . . . 0.0 111.558 -178.743 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.5 2.073 0 CA-C-O 121.105 0.478 . . . . 0.0 110.938 . . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 46.0 t -113.71 156.53 23.61 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.509 -0.744 . . . . 0.0 109.251 179.466 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.46 ' CG2' ' CE1' ' A' ' 142' ' ' PHE . 15.4 tt -75.0 -29.88 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.338 0 C-N-CA 119.097 -1.041 . . . . 0.0 111.708 -179.517 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.511 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 12.3 p -55.14 -33.56 63.02 Favored 'General case' 0 N--CA 1.514 2.746 0 O-C-N 120.444 -1.41 . . . . 0.0 109.875 -179.902 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 7.5 tpt180 -59.49 -34.01 72.05 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.042 -1.036 . . . . 0.0 108.698 176.885 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.3 t -68.7 116.55 41.9 Favored Pre-proline 0 N--CA 1.507 2.389 0 O-C-N 121.147 -0.971 . . . . 0.0 109.801 179.271 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -66.11 179.48 1.89 Allowed 'Trans proline' 0 N--CA 1.488 1.189 0 O-C-N 123.015 1.008 . . . . 0.0 110.597 179.1 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.9 tpt180 -75.1 -40.26 60.08 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.259 -0.901 . . . . 0.0 110.154 179.979 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.96 -41.4 91.85 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.141 -0.975 . . . . 0.0 109.945 -179.929 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -63.72 -40.82 97.7 Favored 'General case' 0 N--CA 1.507 2.394 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.724 179.761 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.401 ' CD1' ' CB ' ' A' ' 142' ' ' PHE . 12.3 mt -62.19 -40.92 97.67 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.174 -0.954 . . . . 0.0 109.696 179.665 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -57.71 -37.52 73.67 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.132 -0.98 . . . . 0.0 110.219 179.853 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -58.21 -37.49 74.92 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.045 -1.034 . . . . 0.0 110.42 179.86 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -68.37 -40.08 81.55 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.204 -0.935 . . . . 0.0 109.848 179.798 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -68.09 -38.24 82.12 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.112 -0.993 . . . . 0.0 109.968 179.59 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 29.9 mtp85 -68.07 -32.03 72.07 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.107 -0.996 . . . . 0.0 110.586 179.59 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 4.3 mtmp? -79.62 -31.19 41.63 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 120.99 -1.069 . . . . 0.0 110.992 -179.934 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 2.6 mmtt -100.57 22.94 11.04 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 120.884 -1.135 . . . . 0.0 111.761 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.08 46.92 42.03 Favored Glycine 0 N--CA 1.501 2.969 0 O-C-N 120.745 -1.222 . . . . 0.0 110.998 179.201 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.7 t -146.46 -167.65 2.8 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.095 -1.239 . . . . 0.0 110.5 179.855 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -123.61 171.11 9.79 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.304 -0.872 . . . . 0.0 110.357 -179.913 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.1 p -157.99 161.0 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 O-C-N 121.359 -0.838 . . . . 0.0 110.672 -179.926 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 29.4 t -169.9 100.99 0.3 Allowed 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.137 -0.977 . . . . 0.0 111.074 179.859 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.511 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 87.8 t80 -97.85 156.72 16.46 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.231 -0.918 . . . . 0.0 110.203 179.643 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 20.3 m80 -136.23 -61.74 0.69 Allowed 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.782 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -145.84 147.67 32.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.563 -0.711 . . . . 0.0 109.373 178.896 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . 0.43 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 29.5 p -88.33 157.04 18.85 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.074 -1.016 . . . . 0.0 111.152 -179.344 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.2 p -74.91 -24.1 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.403 0 O-C-N 121.319 -0.863 . . . . 0.0 111.753 -179.488 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -52.73 -44.89 66.7 Favored 'General case' 0 N--CA 1.516 2.836 0 O-C-N 120.715 -1.241 . . . . 0.0 109.274 179.559 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.477 ' HB2' ' CE ' ' A' ' 53' ' ' MET . 29.4 p -142.66 -178.89 6.0 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 121.451 -0.78 . . . . 0.0 110.564 179.619 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . 0.413 ' CA ' ' CE3' ' A' ' 50' ' ' TRP . . . -92.43 61.71 2.45 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 107.526 -2.23 . . . . 0.0 107.526 178.035 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 15.9 t -100.66 138.49 37.65 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.366 -1.079 . . . . 0.0 109.336 -179.053 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -93.27 56.43 2.48 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.163 -0.961 . . . . 0.0 109.648 179.468 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 63.17 96.71 0.01 OUTLIER Glycine 0 N--CA 1.487 2.041 0 N-CA-C 110.055 -1.218 . . . . 0.0 110.055 179.71 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 28.7 p -104.82 118.55 36.84 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.282 -1.128 . . . . 0.0 110.128 179.291 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -118.97 136.16 54.24 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.758 -1.214 . . . . 0.0 110.099 -179.433 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.492 1.635 0 O-C-N 121.269 -0.894 . . . . 0.0 110.285 -179.969 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.432 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.5 2.036 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 . . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -69.97 160.0 51.24 Favored 'Trans proline' 0 C--N 1.316 -1.166 0 O-C-N 123.353 1.186 . . . . 0.0 110.95 -179.727 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -48.96 -31.92 8.23 Favored 'General case' 0 N--CA 1.515 2.804 0 O-C-N 121.411 -0.805 . . . . 0.0 111.254 -179.821 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.94 -32.81 35.04 Favored Glycine 0 N--CA 1.498 2.819 0 O-C-N 120.997 -1.064 . . . . 0.0 110.711 179.782 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -55.24 -33.64 63.31 Favored 'General case' 0 N--CA 1.511 2.596 0 O-C-N 120.876 -1.367 . . . . 0.0 110.709 179.861 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -54.09 -37.17 63.97 Favored 'General case' 0 N--CA 1.512 2.639 0 O-C-N 121.048 -1.033 . . . . 0.0 110.313 179.772 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.5 mttt -58.58 -36.44 73.97 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.234 -0.917 . . . . 0.0 110.279 179.592 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.3 pt -116.5 36.73 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.066 -1.022 . . . . 0.0 110.524 179.747 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.427 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -83.75 -44.3 0.8 Allowed Pre-proline 0 N--CA 1.509 2.507 0 O-C-N 121.119 -0.988 . . . . 0.0 113.161 -179.087 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.0 Cg_endo -75.97 -36.36 2.05 Favored 'Trans proline' 0 N--CA 1.486 1.069 0 O-C-N 122.606 0.792 . . . . 0.0 111.872 -178.016 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.411 HG21 ' CE2' ' A' ' 62' ' ' TYR . 89.9 m -59.51 -41.35 89.71 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 120.926 -1.109 . . . . 0.0 110.044 -179.691 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.9 mt -66.34 -40.85 90.11 Favored 'General case' 0 N--CA 1.508 2.428 0 C-N-CA 119.351 -0.94 . . . . 0.0 109.364 179.318 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.08 -34.9 70.64 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.214 -0.929 . . . . 0.0 110.221 179.4 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -56.84 -36.53 70.12 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 121.069 -1.019 . . . . 0.0 110.327 179.691 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.424 ' CE1' ' HG2' ' A' ' 59' ' ' ARG . 11.3 m-85 -57.84 -38.35 75.48 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.117 -0.989 . . . . 0.0 110.527 179.882 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -58.54 -34.7 71.3 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.156 -0.965 . . . . 0.0 110.648 -179.875 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.2 mp -70.14 -40.73 78.59 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.117 -0.989 . . . . 0.0 108.823 179.409 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 26.1 tp60 -69.06 -47.14 66.06 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.306 -0.958 . . . . 0.0 108.769 178.794 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.413 ' CD1' ' CG2' ' A' ' 52' ' ' ILE . 2.3 tp -60.52 -36.84 79.37 Favored 'General case' 0 N--CA 1.509 2.501 0 C-N-CA 119.401 -0.92 . . . . 0.0 109.525 178.759 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.1 -37.46 71.96 Favored 'General case' 0 N--CA 1.51 2.525 0 O-C-N 121.093 -1.004 . . . . 0.0 110.326 179.788 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -63.36 -50.36 70.23 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.194 -1.002 . . . . 0.0 109.662 -179.777 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.424 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -68.69 -40.36 80.11 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 119.058 -1.057 . . . . 0.0 109.057 178.944 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -60.94 -33.2 72.81 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.285 -0.884 . . . . 0.0 110.223 179.396 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.2 mmmt -93.83 -36.84 12.05 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.063 -1.023 . . . . 0.0 110.709 179.924 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.5 t70 . . . . . 0 N--CA 1.511 2.583 0 O-C-N 121.097 -1.002 . . . . 0.0 110.451 -179.945 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.494 1.762 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.3 m-80 -57.6 -40.0 78.11 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.239 -0.913 . . . . 0.0 109.752 179.611 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -60.81 -37.61 82.58 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.273 -0.892 . . . . 0.0 109.906 179.421 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 38.0 tp60 -60.15 -44.05 95.27 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 121.137 -0.977 . . . . 0.0 109.912 179.881 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 83.3 mt -60.19 -38.04 82.07 Favored 'General case' 0 N--CA 1.509 2.505 0 C-N-CA 119.368 -0.933 . . . . 0.0 109.98 179.731 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.456 ' CE3' ' CA ' ' A' ' 149' ' ' GLY . 39.6 m0 -58.98 -34.03 71.35 Favored 'General case' 0 N--CA 1.509 2.505 0 C-N-CA 119.338 -0.945 . . . . 0.0 109.469 179.548 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -66.6 -33.47 75.73 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 120.628 -1.295 . . . . 0.0 109.443 178.073 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.424 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 16.5 mt -70.47 -55.37 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.234 0 O-C-N 120.971 -1.081 . . . . 0.0 109.49 179.336 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.471 ' CE ' ' HB2' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -58.97 -32.2 69.43 Favored 'General case' 0 N--CA 1.509 2.475 0 C-N-CA 118.763 -1.175 . . . . 0.0 109.78 179.212 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -61.09 -40.39 93.55 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.886 -1.134 . . . . 0.0 109.267 178.96 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.42 HD23 ' CD1' ' A' ' 26' ' ' PHE . 30.4 mt -55.0 -31.95 61.41 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.206 -0.934 . . . . 0.0 110.117 179.084 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.434 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 23.6 t60 -58.04 -39.64 78.93 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 120.984 -1.073 . . . . 0.0 110.038 179.645 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.442 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 8.7 m170 -59.58 -47.12 86.8 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.066 -1.022 . . . . 0.0 109.224 179.329 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -62.77 -38.54 91.0 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.299 -0.876 . . . . 0.0 109.176 178.789 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.424 ' HG2' ' CE1' ' A' ' 26' ' ' PHE . 0.7 OUTLIER -62.07 -47.07 86.33 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.193 -0.942 . . . . 0.0 109.555 179.441 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 82.9 p -66.64 -40.31 88.65 Favored 'General case' 0 N--CA 1.501 2.125 0 C-N-CA 119.253 -0.979 . . . . 0.0 109.032 179.142 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.417 ' O ' ' OG1' ' A' ' 65' ' ' THR . 2.4 ttt180 -63.74 -37.65 88.16 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.261 -0.976 . . . . 0.0 109.427 178.883 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.411 ' CE2' HG21 ' A' ' 22' ' ' THR . 41.6 t80 -62.18 -52.37 64.07 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.093 -1.004 . . . . 0.0 109.372 179.522 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.423 HG23 HD13 ' A' ' 63' ' ' ILE . 81.1 mt -72.27 -38.64 62.41 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.38 0 C-N-CA 119.371 -0.932 . . . . 0.0 109.298 179.274 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.497 ' CD1' ' CD2' ' A' ' 68' ' ' TYR . 68.2 t80 -63.94 -37.49 87.6 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.257 -0.902 . . . . 0.0 109.645 179.001 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.417 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 80.0 m -72.06 -37.04 69.74 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 120.949 -1.094 . . . . 0.0 110.811 -179.74 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.6 pp -82.87 -31.03 28.17 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 120.894 -1.128 . . . . 0.0 112.144 -179.109 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.422 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 60.5 t80 -85.95 -33.97 21.0 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 120.674 -1.266 . . . . 0.0 111.663 -179.35 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.497 ' CD2' ' CD1' ' A' ' 64' ' ' TYR . 21.7 m-85 -95.97 -27.07 15.31 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.859 -1.151 . . . . 0.0 112.355 -178.77 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.2 mttt -111.92 -61.2 1.75 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.676 -1.265 . . . . 0.0 111.269 -179.626 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.11 -31.79 70.38 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 121.037 -1.04 . . . . 0.0 110.708 -179.532 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.5 mttt 56.63 41.6 28.2 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.803 -1.186 . . . . 0.0 110.177 -179.61 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.25 36.12 3.68 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.411 -0.806 . . . . 0.0 109.882 179.123 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.45 HD11 HG23 ' A' ' 73' ' ' ILE . 14.2 tt -153.77 162.74 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.932 0 O-C-N 121.254 -0.904 . . . . 0.0 109.889 -179.825 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 4.3 m -108.15 146.96 31.96 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.064 -1.022 . . . . 0.0 110.273 179.941 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -46.7 -32.37 3.52 Favored 'General case' 0 N--CA 1.515 2.798 0 O-C-N 121.34 -0.85 . . . . 0.0 111.457 -179.938 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -61.69 -50.19 73.45 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.034 -1.041 . . . . 0.0 109.285 179.488 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 31.7 tp -67.51 -43.64 80.37 Favored 'General case' 0 N--CA 1.504 2.253 0 C-N-CA 119.091 -1.044 . . . . 0.0 108.505 178.774 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.422 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 13.3 t80 -60.58 -38.24 83.96 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.3 -0.875 . . . . 0.0 109.501 179.201 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -76.17 -41.72 48.79 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.08 -1.013 . . . . 0.0 108.829 178.813 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.433 ' CE2' ' HG3' ' A' ' 84' ' ' GLU . 84.9 t90 -59.2 -38.99 81.23 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.202 -0.937 . . . . 0.0 109.226 178.795 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.447 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 16.5 mt -66.33 -55.56 15.37 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.198 -0.939 . . . . 0.0 109.147 179.04 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -56.2 -27.24 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.517 0 O-C-N 121.115 -0.99 . . . . 0.0 110.644 -179.788 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.9 mttt -89.08 -20.33 24.47 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 120.917 -1.115 . . . . 0.0 111.54 179.259 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.433 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 10.5 mm-40 -101.53 23.46 11.1 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 120.764 -1.21 . . . . 0.0 111.928 179.985 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.406 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 7.3 ttmm 76.05 70.79 0.08 Allowed 'General case' 0 N--CA 1.512 2.638 0 O-C-N 121.12 -0.987 . . . . 0.0 111.872 179.347 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.447 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 30.3 m-85 -133.33 -62.86 0.78 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.454 -0.779 . . . . 0.0 109.075 179.214 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -128.98 -177.0 4.03 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.496 -0.752 . . . . 0.0 109.216 179.356 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.434 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 5.5 t0 -130.91 108.61 9.95 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.055 -1.028 . . . . 0.0 110.608 -179.849 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -62.97 -38.09 89.72 Favored 'General case' 0 N--CA 1.508 2.425 0 C-N-CA 119.417 -0.913 . . . . 0.0 109.78 179.506 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.1 tp -58.57 -37.95 76.84 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.106 -0.996 . . . . 0.0 110.131 179.936 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 65.4 tp -71.66 -49.08 43.15 Favored 'General case' 0 N--CA 1.506 2.349 0 C-N-CA 119.148 -1.021 . . . . 0.0 108.651 179.043 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.413 HD12 ' CD1' ' A' ' 64' ' ' TYR . 61.5 mt -60.33 -36.15 67.06 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.435 0 C-N-CA 119.389 -0.924 . . . . 0.0 108.764 178.323 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.12 -38.89 75.71 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.084 -1.01 . . . . 0.0 109.01 178.283 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.4 ' HB3' ' CD2' ' A' ' 103' ' ' LEU . 6.0 mmtt -57.44 -41.75 81.07 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.079 -1.013 . . . . 0.0 109.535 179.272 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.5 m0 -68.63 -32.55 72.49 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.248 -0.907 . . . . 0.0 110.54 179.853 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . 0.457 ' NE ' ' OH ' ' A' ' 64' ' ' TYR . 0.1 OUTLIER -82.62 -30.31 29.54 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.952 -1.092 . . . . 0.0 110.611 179.226 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.7 mmtp -54.16 -176.55 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.613 0 O-C-N 120.991 -1.068 . . . . 0.0 110.552 179.798 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -105.44 134.0 49.26 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.203 -0.935 . . . . 0.0 109.736 179.314 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.12 5.5 56.17 Favored Glycine 0 N--CA 1.493 2.456 0 C-N-CA 120.113 -1.041 . . . . 0.0 111.28 -179.54 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -112.83 49.86 0.91 Allowed 'General case' 0 N--CA 1.497 1.922 0 CA-C-N 119.594 1.697 . . . . 0.0 110.036 179.752 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -65.15 -39.85 93.56 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.062 -1.023 . . . . 0.0 110.027 -179.962 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.56 108.44 15.98 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.172 -0.955 . . . . 0.0 110.131 179.942 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.4 ' CD2' ' HB3' ' A' ' 94' ' ' LYS . 14.1 tp -143.65 136.09 27.05 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.187 -0.946 . . . . 0.0 110.037 -179.699 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.442 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.6 p -110.53 -38.61 5.15 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.322 -0.861 . . . . 0.0 112.093 179.876 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.605 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 4.6 m -138.72 -171.6 3.11 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 120.333 -1.479 . . . . 0.0 109.405 178.817 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 12.5 mt -96.59 -35.51 11.04 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.982 -1.074 . . . . 0.0 110.586 179.401 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 12.0 ttt85 -102.51 33.59 3.1 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 120.899 -1.125 . . . . 0.0 109.19 177.919 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.605 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.303 1.7 t -128.98 17.74 6.15 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.283 -0.886 . . . . 0.0 109.256 -179.109 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.406 ' CG2' ' O ' ' A' ' 108' ' ' CYS . 1.2 pt -158.57 38.39 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 O-C-N 120.897 -1.127 . . . . 0.0 110.369 -178.905 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.435 ' O ' ' OG1' ' A' ' 119' ' ' THR . 19.9 mt-30 . . . . . 0 N--CA 1.508 2.464 0 O-C-N 120.835 -1.165 . . . . 0.0 110.718 -179.14 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.435 ' OG1' ' O ' ' A' ' 110' ' ' GLN . 2.9 m . . . . . 0 N--CA 1.497 1.887 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 . . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 46.7 t -100.8 155.16 18.08 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.301 -0.875 . . . . 0.0 109.365 179.151 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.454 HG23 HD11 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -73.03 -36.26 50.5 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.324 0 O-C-N 121.105 -0.997 . . . . 0.0 110.853 -179.539 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.454 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 5.1 p -54.72 -33.03 60.5 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 120.773 -1.204 . . . . 0.0 110.989 -178.928 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -60.13 -36.64 77.93 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 120.858 -1.151 . . . . 0.0 109.414 178.368 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 57.1 t -78.53 124.9 85.28 Favored Pre-proline 0 N--CA 1.504 2.233 0 O-C-N 121.213 -0.929 . . . . 0.0 109.702 179.612 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -64.98 175.06 4.08 Favored 'Trans proline' 0 N--CA 1.488 1.18 0 O-C-N 123.154 1.081 . . . . 0.0 110.712 179.623 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 11.1 tpp85 -75.07 -37.34 61.65 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.249 -0.907 . . . . 0.0 110.615 -179.679 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.05 -40.97 82.29 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 120.93 -1.106 . . . . 0.0 109.997 -179.704 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -68.79 -41.48 78.66 Favored 'General case' 0 N--CA 1.506 2.368 0 C-N-CA 119.325 -0.95 . . . . 0.0 109.259 179.252 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.8 mt -64.02 -39.18 93.53 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.295 -0.878 . . . . 0.0 109.633 179.233 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -60.98 -40.04 91.93 Favored 'General case' 0 N--CA 1.508 2.454 0 C-N-CA 119.408 -0.917 . . . . 0.0 109.929 179.765 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.93 -38.38 82.21 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.16 -0.962 . . . . 0.0 110.316 179.958 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -63.99 -43.39 95.84 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.123 -0.985 . . . . 0.0 109.981 179.937 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -64.03 -39.17 93.49 Favored 'General case' 0 N--CA 1.508 2.442 0 C-N-CA 119.373 -0.931 . . . . 0.0 109.943 179.846 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 3.8 ttt85 -68.03 -38.87 83.05 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.128 -0.982 . . . . 0.0 109.975 179.648 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 50.1 mmtt -70.9 -35.34 72.25 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.165 -0.959 . . . . 0.0 110.346 179.655 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 8.6 tttt -82.57 -17.2 45.72 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 120.994 -1.066 . . . . 0.0 111.726 179.714 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 91.5 31.22 9.71 Favored Glycine 0 N--CA 1.494 2.526 0 O-C-N 120.702 -1.249 . . . . 0.0 110.121 -179.744 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.6 t -140.94 -161.48 1.22 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.023 -1.28 . . . . 0.0 109.79 179.677 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -133.73 148.72 51.45 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.123 -0.985 . . . . 0.0 110.179 179.993 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.9 p -132.64 161.37 41.64 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.211 -0.931 . . . . 0.0 110.326 -179.879 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 31.2 t -166.62 87.87 0.33 Allowed 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.227 -0.921 . . . . 0.0 110.904 179.988 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.454 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 53.5 t80 -97.29 160.87 14.08 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.299 -0.875 . . . . 0.0 110.499 -179.823 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 4.5 m80 -137.61 -60.47 0.65 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.553 -0.717 . . . . 0.0 109.075 179.061 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -137.27 149.84 47.39 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.359 -0.838 . . . . 0.0 109.324 178.803 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 26.3 p -92.11 155.31 18.14 Favored 'General case' 0 N--CA 1.505 2.276 0 C-N-CA 119.219 -0.992 . . . . 0.0 110.929 -179.581 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.5 p -73.31 -26.01 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 O-C-N 121.368 -0.833 . . . . 0.0 111.539 -179.489 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -51.0 -45.84 61.31 Favored 'General case' 0 N--CA 1.516 2.849 0 O-C-N 120.784 -1.198 . . . . 0.0 109.736 179.895 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.471 ' HB2' ' CE ' ' A' ' 53' ' ' MET . 29.5 p -142.44 -179.52 6.33 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.341 -0.849 . . . . 0.0 110.766 179.733 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . 0.456 ' CA ' ' CE3' ' A' ' 50' ' ' TRP . . . -90.43 63.1 3.05 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 107.836 -2.106 . . . . 0.0 107.836 178.161 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 27.0 t -105.69 139.37 40.38 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.389 -1.065 . . . . 0.0 109.79 -178.986 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 20.4 mmt85 -92.37 56.9 2.87 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 121.165 -0.959 . . . . 0.0 109.556 179.344 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 60.51 95.22 0.01 OUTLIER Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 -179.852 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 p -103.27 126.88 50.67 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.305 -1.114 . . . . 0.0 110.33 179.693 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -142.19 141.67 32.6 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.153 -0.967 . . . . 0.0 109.919 -179.691 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.5 2.067 0 O-C-N 121.189 -0.944 . . . . 0.0 110.574 -179.952 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.431 ' HB3' ' CE3' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.503 2.188 0 N-CA-C 110.475 -0.195 . . . . 0.0 110.475 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.28 162.5 42.25 Favored 'Trans proline' 0 C--N 1.317 -1.109 0 O-C-N 123.225 1.118 . . . . 0.0 110.794 -179.794 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -48.87 -32.05 8.23 Favored 'General case' 0 N--CA 1.514 2.729 0 O-C-N 121.391 -0.818 . . . . 0.0 111.307 -179.784 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.83 -34.33 44.79 Favored Glycine 0 N--CA 1.499 2.88 0 O-C-N 120.994 -1.066 . . . . 0.0 110.53 179.84 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.422 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 18.0 t80 -55.06 -32.69 62.12 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 120.938 -1.33 . . . . 0.0 110.78 179.873 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -54.65 -37.84 66.19 Favored 'General case' 0 N--CA 1.513 2.69 0 O-C-N 120.933 -1.104 . . . . 0.0 110.21 179.71 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.19 -35.65 71.93 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.29 -0.882 . . . . 0.0 110.252 179.49 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pt -115.7 36.05 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 121.068 -1.02 . . . . 0.0 110.563 179.65 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.435 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 3.5 tptm -82.64 -43.35 0.93 Allowed Pre-proline 0 N--CA 1.508 2.474 0 O-C-N 121.028 -1.045 . . . . 0.0 112.802 -179.506 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.435 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.4 Cg_endo -75.76 -37.66 1.59 Allowed 'Trans proline' 0 N--CA 1.486 1.039 0 O-C-N 122.479 0.726 . . . . 0.0 111.345 -178.393 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.416 HG22 ' CE2' ' A' ' 62' ' ' TYR . 72.4 m -61.39 -42.92 99.5 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.071 -1.018 . . . . 0.0 110.125 -179.788 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.423 HD22 ' CD2' ' A' ' 86' ' ' TYR . 3.1 mt -64.48 -41.2 96.62 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.192 -0.943 . . . . 0.0 109.747 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.11 -34.99 72.66 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.088 -1.008 . . . . 0.0 110.149 179.512 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -58.04 -35.46 71.35 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.067 -1.021 . . . . 0.0 110.22 179.505 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.491 ' CE2' HD13 ' A' ' 55' ' ' LEU . 6.7 m-85 -56.73 -44.17 81.39 Favored 'General case' 0 N--CA 1.513 2.687 0 O-C-N 120.972 -1.08 . . . . 0.0 109.999 179.297 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -57.56 -26.52 61.55 Favored 'General case' 0 N--CA 1.506 2.333 0 C-N-CA 119.317 -0.953 . . . . 0.0 110.527 179.419 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 16.6 mm -65.53 -48.61 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.314 0 O-C-N 120.954 -1.091 . . . . 0.0 109.119 179.426 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -67.39 -51.8 47.64 Favored 'General case' 0 N--CA 1.506 2.336 0 C-N-CA 119.251 -0.98 . . . . 0.0 108.72 179.027 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.57 -32.37 68.86 Favored 'General case' 0 N--CA 1.508 2.432 0 C-N-CA 119.439 -0.905 . . . . 0.0 109.608 178.65 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.0 mtt-85 -59.82 -43.25 94.62 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 120.967 -1.083 . . . . 0.0 110.077 179.791 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -61.14 -46.04 92.2 Favored 'General case' 0 N--CA 1.508 2.443 0 C-N-CA 119.281 -0.968 . . . . 0.0 109.735 -179.69 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.428 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -70.26 -42.37 72.23 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 119.311 -0.956 . . . . 0.0 108.994 178.984 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -61.05 -32.22 71.85 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.28 -0.888 . . . . 0.0 110.158 179.341 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.1 mmmt -91.8 -33.94 14.78 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 120.98 -1.075 . . . . 0.0 110.745 179.894 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.8 t0 . . . . . 0 N--CA 1.512 2.645 0 O-C-N 121.032 -1.042 . . . . 0.0 110.278 -179.997 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 N--CA 1.502 2.164 0 CA-C-O 120.439 0.162 . . . . 0.0 110.632 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -58.17 -40.53 81.7 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.041 -1.037 . . . . 0.0 109.961 179.926 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.41 ' HA ' ' CE3' ' A' ' 50' ' ' TRP . 23.0 mt-10 -67.39 -43.81 80.42 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.166 -0.959 . . . . 0.0 109.268 179.368 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 46.6 tp60 -67.43 -41.17 85.25 Favored 'General case' 0 N--CA 1.505 2.285 0 C-N-CA 119.328 -0.949 . . . . 0.0 109.113 179.095 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -60.22 -37.18 79.52 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.236 -0.915 . . . . 0.0 109.713 179.222 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.434 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 51.5 m0 -59.91 -36.03 76.14 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.116 -0.99 . . . . 0.0 109.898 179.474 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -62.25 -30.09 70.87 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.037 -1.04 . . . . 0.0 109.986 178.501 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.428 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 63.9 mt -72.25 -58.73 4.42 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.233 0 O-C-N 120.979 -1.076 . . . . 0.0 109.373 179.519 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.6 ptm -57.34 -26.67 61.32 Favored 'General case' 0 N--CA 1.512 2.662 0 C-N-CA 118.298 -1.361 . . . . 0.0 109.814 178.77 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.4 mm-40 -60.6 -36.82 79.51 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 120.753 -1.217 . . . . 0.0 109.314 177.915 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.491 HD13 ' CE2' ' A' ' 26' ' ' PHE . 0.6 OUTLIER -53.0 -34.5 56.53 Favored 'General case' 0 N--CA 1.514 2.771 0 O-C-N 120.981 -1.074 . . . . 0.0 109.522 178.84 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.446 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 33.2 t60 -51.23 -39.04 55.76 Favored 'General case' 0 N--CA 1.511 2.582 0 O-C-N 121.062 -1.024 . . . . 0.0 110.42 179.954 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.44 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.0 m170 -70.24 -53.21 17.95 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.114 -1.034 . . . . 0.0 109.181 178.945 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.434 ' HB3' ' CE2' ' A' ' 26' ' ' PHE . 35.1 tp60 -60.64 -29.92 69.56 Favored 'General case' 0 N--CA 1.504 2.24 0 C-N-CA 119.395 -0.922 . . . . 0.0 110.119 178.893 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.419 ' HD2' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -74.39 -46.65 38.99 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 120.99 -1.069 . . . . 0.0 109.009 179.163 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 86.8 p -67.05 -37.8 84.7 Favored 'General case' 0 N--CA 1.5 2.046 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.124 178.793 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 7.8 ttm-85 -64.27 -37.96 89.34 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 120.985 -1.072 . . . . 0.0 109.653 179.141 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.416 ' CE2' HG22 ' A' ' 22' ' ' THR . 60.9 t80 -63.4 -50.2 70.8 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.21 -0.931 . . . . 0.0 109.497 179.451 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 80.8 mt -72.82 -40.12 60.21 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.366 0 O-C-N 121.181 -0.949 . . . . 0.0 109.198 179.202 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.452 ' CE1' ' CG2' ' A' ' 92' ' ' ILE . 46.5 t80 -60.64 -31.19 70.41 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.233 -0.917 . . . . 0.0 109.989 178.878 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 48.6 m -80.87 -36.17 31.68 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.879 -1.138 . . . . 0.0 110.694 -179.904 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.404 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -82.92 -32.71 27.11 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 120.873 -1.142 . . . . 0.0 112.314 -179.078 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.431 ' CD1' ' HB2' ' A' ' 78' ' ' TYR . 77.4 t80 -86.5 -35.75 19.41 Favored 'General case' 0 N--CA 1.511 2.61 0 O-C-N 120.624 -1.297 . . . . 0.0 111.901 -179.281 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -98.36 -21.5 16.58 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.859 -1.15 . . . . 0.0 112.882 -178.324 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.411 ' HE2' ' CD2' ' A' ' 64' ' ' TYR . 0.7 OUTLIER -117.7 -57.99 2.07 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.571 -1.331 . . . . 0.0 111.408 -179.262 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -64.45 -30.81 71.84 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 121.005 -1.059 . . . . 0.0 110.71 -179.83 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp 58.45 43.6 19.34 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.769 -1.207 . . . . 0.0 110.127 -179.708 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.04 38.02 3.48 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.383 -0.823 . . . . 0.0 109.744 179.331 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.466 HG22 HD12 ' A' ' 73' ' ' ILE . 13.9 tt -156.47 162.7 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 O-C-N 121.22 -0.925 . . . . 0.0 110.227 -179.644 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 19.5 p -108.11 146.36 32.76 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.076 -1.015 . . . . 0.0 110.078 179.541 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.8 tttt -45.6 -32.82 2.5 Favored 'General case' 0 N--CA 1.516 2.831 0 O-C-N 121.33 -0.856 . . . . 0.0 111.661 -179.78 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -61.54 -49.98 74.49 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.002 -1.061 . . . . 0.0 109.31 179.535 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 36.6 tp -67.48 -43.09 81.83 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.19 -1.004 . . . . 0.0 108.538 178.765 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.431 ' HB2' ' CD1' ' A' ' 67' ' ' TYR . 17.8 t80 -60.98 -38.14 84.93 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.343 -0.848 . . . . 0.0 109.333 179.008 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -75.48 -41.05 56.45 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.076 -1.015 . . . . 0.0 108.963 178.75 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.431 ' CE3' ' HB3' ' A' ' 12' ' ' ALA . 88.2 t90 -60.21 -38.37 83.1 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.073 -1.017 . . . . 0.0 109.178 178.758 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.457 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 16.1 mt -66.37 -54.8 20.27 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.236 -0.915 . . . . 0.0 109.328 179.072 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -56.03 -27.21 22.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.47 0 O-C-N 121.114 -0.991 . . . . 0.0 110.71 -179.724 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.75 -20.64 24.51 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.96 -1.088 . . . . 0.0 111.533 179.447 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.42 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 68.0 mm-40 -101.48 23.73 10.68 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 120.678 -1.264 . . . . 0.0 111.886 179.936 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.41 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 3.9 ttmm 75.85 71.76 0.08 Allowed 'General case' 0 N--CA 1.511 2.621 0 O-C-N 121.134 -0.979 . . . . 0.0 111.843 179.324 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.457 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 31.9 m-85 -134.42 -62.78 0.74 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.418 -0.801 . . . . 0.0 109.2 179.305 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -131.42 173.54 10.98 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.427 -0.796 . . . . 0.0 109.46 179.478 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.446 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.0 t70 -127.6 127.55 44.03 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.028 -1.045 . . . . 0.0 110.711 -179.872 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -73.65 -35.73 65.3 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 121.338 -0.851 . . . . 0.0 110.018 179.43 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 12.9 tp -60.3 -39.32 86.51 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.09 -1.006 . . . . 0.0 110.157 179.981 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.42 HD23 ' CD2' ' A' ' 57' ' ' HIS . 56.3 tp -72.81 -49.78 28.3 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.018 -1.051 . . . . 0.0 108.526 179.039 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.452 ' CG2' ' CE1' ' A' ' 64' ' ' TYR . 52.2 mt -59.12 -34.91 54.81 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.425 0 C-N-CA 119.189 -1.004 . . . . 0.0 108.783 178.16 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.81 -37.95 76.44 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.01 -1.057 . . . . 0.0 108.885 177.951 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.424 ' HD2' ' CZ ' ' A' ' 100' ' ' TYR . 5.2 mmtt -56.74 -42.49 79.36 Favored 'General case' 0 N--CA 1.51 2.561 0 O-C-N 121.001 -1.062 . . . . 0.0 109.41 179.17 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.3 m0 -66.7 -37.47 84.78 Favored 'General case' 0 N--CA 1.507 2.383 0 C-N-CA 119.404 -0.918 . . . . 0.0 109.824 179.441 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.37 -35.52 71.14 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.167 -0.958 . . . . 0.0 110.233 179.266 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.1 mmtp -54.21 -176.44 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.693 0 O-C-N 121.117 -0.989 . . . . 0.0 110.536 179.919 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.45 139.34 39.53 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.206 -0.934 . . . . 0.0 109.715 179.158 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 93.68 8.8 60.52 Favored Glycine 0 N--CA 1.495 2.574 0 C-N-CA 120.172 -1.013 . . . . 0.0 111.138 -179.436 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.424 ' CZ ' ' HD2' ' A' ' 94' ' ' LYS . 45.0 m-85 -116.7 70.03 0.76 Allowed 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 119.486 1.643 . . . . 0.0 109.839 179.694 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -98.34 -35.83 10.19 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.163 -0.961 . . . . 0.0 111.091 -179.614 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.66 59.49 0.98 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.931 -1.106 . . . . 0.0 111.032 -179.448 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.2 pp -107.88 152.57 24.24 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.027 -1.046 . . . . 0.0 109.616 179.057 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.44 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.4 p -113.18 -27.04 8.14 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.113 -0.992 . . . . 0.0 113.628 -178.929 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.558 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 10.3 m -144.62 -167.71 2.72 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 120.137 -1.602 . . . . 0.0 109.877 179.18 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 12.5 mt -95.87 -39.87 9.6 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.091 -1.006 . . . . 0.0 109.915 178.88 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.9 ttm-85 -101.68 29.11 5.09 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.06 -1.025 . . . . 0.0 110.054 178.392 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.558 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.299 1.8 t -126.79 16.33 7.45 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.037 -1.039 . . . . 0.0 109.065 -179.661 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.402 ' CG2' ' O ' ' A' ' 108' ' ' CYS . 1.0 OUTLIER -159.31 39.31 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 O-C-N 120.969 -1.082 . . . . 0.0 110.184 -178.903 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.425 ' O ' ' OG1' ' A' ' 119' ' ' THR . 5.9 tt0 . . . . . 0 N--CA 1.503 2.2 0 O-C-N 120.918 -1.114 . . . . 0.0 111.19 -178.784 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.425 ' OG1' ' O ' ' A' ' 110' ' ' GLN . 1.4 m . . . . . 0 N--CA 1.494 1.773 0 CA-C-O 120.676 0.274 . . . . 0.0 110.279 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 47.2 t -100.73 155.44 17.9 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.348 -0.845 . . . . 0.0 108.988 178.635 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.449 HG22 ' CE1' ' A' ' 142' ' ' PHE . 14.4 tt -77.8 -29.56 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.441 0 O-C-N 121.078 -1.014 . . . . 0.0 112.099 -179.063 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.492 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 14.1 p -55.05 -34.87 63.92 Favored 'General case' 0 N--CA 1.513 2.688 0 O-C-N 120.586 -1.321 . . . . 0.0 110.382 -179.136 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -27.7 64.01 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.066 -1.021 . . . . 0.0 109.586 177.53 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 49.5 t -73.03 118.75 71.13 Favored Pre-proline 0 N--CA 1.508 2.431 0 O-C-N 120.975 -1.078 . . . . 0.0 110.397 179.845 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . 0.413 ' HB3' ' CB ' ' A' ' 154' ' ' ALA . 37.4 Cg_endo -64.57 171.88 7.59 Favored 'Trans proline' 0 N--CA 1.489 1.234 0 O-C-N 123.053 1.028 . . . . 0.0 110.591 178.646 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.11 -38.44 61.14 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.201 -0.937 . . . . 0.0 110.505 -179.85 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.41 -42.73 92.46 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.115 -0.99 . . . . 0.0 110.082 -179.789 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -64.15 -41.55 97.12 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.214 -0.929 . . . . 0.0 109.551 179.703 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 9.4 mt -61.0 -39.76 90.94 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.273 -0.892 . . . . 0.0 109.827 179.662 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -59.32 -39.43 83.08 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.174 -0.954 . . . . 0.0 110.144 -179.929 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.97 -39.02 84.22 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.216 -0.927 . . . . 0.0 110.293 -179.975 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -64.51 -40.41 95.59 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.295 -0.878 . . . . 0.0 110.015 -179.935 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -67.12 -40.25 86.79 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.128 -0.982 . . . . 0.0 109.914 179.762 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 13.0 ttp85 -67.27 -33.56 75.57 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.166 -0.959 . . . . 0.0 110.403 179.526 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 18.6 mmtp -75.35 -31.6 60.61 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.025 -1.047 . . . . 0.0 111.04 -179.986 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -101.79 23.07 11.87 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 120.896 -1.127 . . . . 0.0 111.845 -179.917 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.84 47.0 48.47 Favored Glycine 0 N--CA 1.5 2.911 0 O-C-N 120.72 -1.238 . . . . 0.0 110.913 179.238 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 10.1 t -146.07 -162.31 1.49 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.137 -1.214 . . . . 0.0 110.254 179.884 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -132.79 160.61 36.36 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.039 -1.038 . . . . 0.0 110.177 -179.925 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 8.8 p -147.56 161.21 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 O-C-N 121.16 -0.962 . . . . 0.0 110.473 -179.794 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 36.1 t -171.62 108.38 0.25 Allowed 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.126 -0.983 . . . . 0.0 111.039 179.727 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.492 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 87.0 t80 -104.15 157.07 17.37 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.106 -0.996 . . . . 0.0 110.649 179.906 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.09 -61.9 0.65 Allowed 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 178.662 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -146.43 148.68 32.54 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.54 -0.725 . . . . 0.0 109.164 178.676 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . 0.444 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.4 p -91.68 154.89 18.7 Favored 'General case' 0 N--CA 1.508 2.435 0 C-N-CA 119.011 -1.076 . . . . 0.0 110.983 -179.405 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.4 m -72.6 -25.28 22.48 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.5 0 O-C-N 121.367 -0.833 . . . . 0.0 111.735 -179.362 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -49.74 -59.0 4.22 Favored 'General case' 0 N--CA 1.517 2.88 0 O-C-N 120.879 -1.138 . . . . 0.0 110.219 -179.756 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.434 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.3 p -128.0 -163.91 1.32 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.218 -0.926 . . . . 0.0 110.319 179.356 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . 0.407 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -101.87 64.26 0.48 Allowed Glycine 0 N--CA 1.491 2.307 0 N-CA-C 107.784 -2.126 . . . . 0.0 107.784 178.278 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 27.6 t -98.95 143.9 28.73 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.36 -1.083 . . . . 0.0 109.724 -179.099 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -100.77 44.3 1.02 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.2 -0.937 . . . . 0.0 109.775 179.41 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 77.69 93.93 0.25 Allowed Glycine 0 N--CA 1.485 1.966 0 N-CA-C 109.872 -1.291 . . . . 0.0 109.872 179.897 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.1 p -108.18 129.01 55.2 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.191 -1.182 . . . . 0.0 110.069 179.67 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . 0.413 ' CB ' ' HB3' ' A' ' 125' ' ' PRO . . . -148.36 148.1 29.99 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.187 -0.946 . . . . 0.0 110.245 -179.316 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.495 1.807 0 O-C-N 121.199 -0.938 . . . . 0.0 110.37 179.994 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.43 ' HB1' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.513 2.721 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 . . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -71.91 163.25 39.42 Favored 'Trans proline' 0 C--N 1.318 -1.073 0 O-C-N 123.331 1.174 . . . . 0.0 110.719 -179.889 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -48.36 -32.13 7.09 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.465 -0.772 . . . . 0.0 111.399 -179.784 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.75 -33.35 42.17 Favored Glycine 0 N--CA 1.498 2.802 0 O-C-N 120.994 -1.067 . . . . 0.0 110.59 179.73 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -54.04 -32.43 54.43 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 120.884 -1.363 . . . . 0.0 110.723 179.783 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -54.03 -36.39 62.97 Favored 'General case' 0 N--CA 1.512 2.645 0 O-C-N 121.052 -1.03 . . . . 0.0 110.325 179.682 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.9 mtmt -57.12 -35.14 69.11 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.091 -1.005 . . . . 0.0 110.328 179.507 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 3.5 pt -118.21 37.16 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 O-C-N 121.072 -1.018 . . . . 0.0 110.57 179.606 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -82.63 -43.58 0.93 Allowed Pre-proline 0 N--CA 1.508 2.46 0 O-C-N 121.063 -1.023 . . . . 0.0 112.989 -179.545 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.8 Cg_endo -75.44 -38.68 1.32 Allowed 'Trans proline' 0 N--CA 1.486 1.048 0 O-C-N 122.577 0.777 . . . . 0.0 111.529 -178.266 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.419 HG23 ' CE2' ' A' ' 62' ' ' TYR . 89.9 m -58.83 -41.77 87.7 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.025 -1.047 . . . . 0.0 109.808 179.898 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.419 HD23 ' CE2' ' A' ' 86' ' ' TYR . 1.5 mt -65.24 -38.72 91.25 Favored 'General case' 0 N--CA 1.506 2.366 0 C-N-CA 119.466 -0.894 . . . . 0.0 109.508 179.216 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.2 m -58.3 -35.71 72.26 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.046 -1.034 . . . . 0.0 110.082 179.314 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -56.55 -34.57 67.22 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.098 -1.001 . . . . 0.0 110.427 179.563 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.503 ' CE2' HD12 ' A' ' 55' ' ' LEU . 8.8 m-85 -57.71 -36.18 71.64 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.088 -1.007 . . . . 0.0 110.432 179.829 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -56.64 -35.61 68.55 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.163 -0.961 . . . . 0.0 110.656 -179.638 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.1 mp -63.84 -42.17 94.98 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.423 0 O-C-N 120.969 -1.082 . . . . 0.0 108.716 179.372 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -67.69 -57.19 6.81 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 119.133 -1.027 . . . . 0.0 108.298 178.521 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.2 tp -54.74 -33.0 60.58 Favored 'General case' 0 N--CA 1.512 2.632 0 C-N-CA 119.363 -0.935 . . . . 0.0 109.75 178.318 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.05 -36.12 70.13 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.09 -1.006 . . . . 0.0 110.404 179.657 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.68 -52.77 61.99 Favored 'General case' 0 N--CA 1.507 2.381 0 C-N-CA 119.075 -1.05 . . . . 0.0 109.427 179.98 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.432 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -69.39 -42.13 75.54 Favored 'General case' 0 N--CA 1.504 2.236 0 C-N-CA 119.048 -1.061 . . . . 0.0 108.609 178.638 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -61.34 -33.65 73.97 Favored 'General case' 0 N--CA 1.503 2.22 0 C-N-CA 119.525 -0.87 . . . . 0.0 110.069 179.266 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 6.4 mtmt -87.79 -34.48 18.28 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.064 -1.022 . . . . 0.0 110.612 179.754 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 . . . . . 0 N--CA 1.511 2.609 0 O-C-N 120.938 -1.101 . . . . 0.0 110.262 179.692 . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.496 1.828 0 CA-C-O 120.694 0.283 . . . . 0.0 110.616 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.42 ' HB3' ' CZ2' ' A' ' 50' ' ' TRP . 74.1 m-80 -56.41 -39.38 72.92 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.124 -0.985 . . . . 0.0 110.014 179.853 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -60.81 -38.55 85.78 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.213 -0.929 . . . . 0.0 109.771 179.482 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -57.87 -40.98 81.5 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.077 -1.014 . . . . 0.0 109.894 179.827 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 54.0 mt -75.04 -33.11 61.7 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.256 -0.902 . . . . 0.0 110.502 179.844 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.434 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 45.9 m0 -58.66 -38.85 79.05 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 120.905 -1.122 . . . . 0.0 109.738 179.566 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -66.02 -32.39 73.83 Favored 'General case' 0 N--CA 1.502 2.136 0 C-N-CA 119.035 -1.066 . . . . 0.0 109.371 178.271 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.432 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 4.4 mt -72.44 -55.56 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.214 0 O-C-N 120.981 -1.075 . . . . 0.0 109.7 179.585 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.3 ptm -60.08 -24.36 64.53 Favored 'General case' 0 N--CA 1.509 2.492 0 C-N-CA 118.259 -1.376 . . . . 0.0 110.003 178.883 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -64.98 -35.41 81.08 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 120.756 -1.215 . . . . 0.0 109.76 178.369 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.503 HD12 ' CE2' ' A' ' 26' ' ' PHE . 0.8 OUTLIER -54.62 -35.8 63.8 Favored 'General case' 0 N--CA 1.514 2.73 0 O-C-N 120.846 -1.159 . . . . 0.0 109.834 179.387 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.437 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 26.2 t60 -52.22 -37.15 54.22 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 120.949 -1.095 . . . . 0.0 110.483 -179.746 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.451 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.4 m170 -67.95 -48.53 65.63 Favored 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 119.143 -1.023 . . . . 0.0 109.463 179.494 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -61.81 -37.04 82.93 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 119.286 -0.966 . . . . 0.0 109.594 179.154 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.417 ' HG3' ' CE2' ' A' ' 26' ' ' PHE . 3.0 mtt180 -66.27 -46.48 76.88 Favored 'General case' 0 N--CA 1.508 2.451 0 C-N-CA 119.29 -0.964 . . . . 0.0 109.641 179.364 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.5 p -62.25 -39.53 93.18 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.13 -0.981 . . . . 0.0 109.503 179.526 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.42 ' O ' ' OG1' ' A' ' 65' ' ' THR . 10.7 tpp85 -64.31 -42.61 96.26 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.103 -0.998 . . . . 0.0 109.101 179.307 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.419 ' CE2' HG23 ' A' ' 22' ' ' THR . 59.6 t80 -63.19 -49.04 75.81 Favored 'General case' 0 N--CA 1.507 2.389 0 C-N-CA 119.491 -0.884 . . . . 0.0 109.464 179.422 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.453 HG22 HD12 ' A' ' 63' ' ' ILE . 85.2 mt -69.31 -38.74 78.01 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.331 0 C-N-CA 119.305 -0.958 . . . . 0.0 109.238 179.538 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.412 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 9.0 t80 -66.57 -41.7 88.2 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.169 -0.957 . . . . 0.0 108.943 178.978 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.42 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 86.9 m -60.49 -41.28 93.92 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.126 -0.984 . . . . 0.0 110.366 -179.735 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.403 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -83.2 -34.8 25.83 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 118.825 -1.15 . . . . 0.0 112.528 -178.978 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 32.9 t80 -86.49 -32.59 20.7 Favored 'General case' 0 N--CA 1.513 2.706 0 O-C-N 120.628 -1.295 . . . . 0.0 112.066 -179.184 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.412 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 7.5 m-85 -98.43 -8.84 26.11 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 120.787 -1.196 . . . . 0.0 113.178 -178.524 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 5.1 mtpm? -127.8 -58.4 1.23 Allowed 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.373 -1.454 . . . . 0.0 110.69 179.693 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 -69.84 -28.82 66.01 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.119 -0.988 . . . . 0.0 110.741 -179.802 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.0 ttmt 58.92 43.5 17.91 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.768 -1.207 . . . . 0.0 109.932 -179.451 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.71 34.47 3.96 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.366 -0.834 . . . . 0.0 109.897 179.288 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.43 HD13 HG23 ' A' ' 73' ' ' ILE . 13.9 tt -153.21 162.34 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.144 -0.973 . . . . 0.0 109.856 -179.962 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.6 p -108.61 147.48 31.77 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.103 -0.998 . . . . 0.0 110.128 179.844 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 24.8 ttmt -46.36 -31.7 2.76 Favored 'General case' 0 N--CA 1.514 2.733 0 O-C-N 121.333 -0.854 . . . . 0.0 111.653 -179.978 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -62.2 -51.3 68.33 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.944 -1.097 . . . . 0.0 109.412 179.566 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 32.4 tp -65.97 -44.36 85.17 Favored 'General case' 0 N--CA 1.504 2.273 0 C-N-CA 119.168 -1.013 . . . . 0.0 108.538 178.902 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 17.0 t80 -60.77 -39.2 87.91 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.369 -0.832 . . . . 0.0 109.344 179.169 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -72.47 -42.04 65.38 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.141 -0.975 . . . . 0.0 108.876 178.771 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.435 ' CE2' ' HG3' ' A' ' 84' ' ' GLU . 88.8 t90 -56.28 -36.65 68.86 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 121.195 -0.941 . . . . 0.0 109.734 178.926 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.461 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 62.8 mt -70.14 -46.77 64.07 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.177 -0.952 . . . . 0.0 108.897 178.954 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 33.3 mm -55.68 -33.02 32.57 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.669 0 O-C-N 121.24 -0.913 . . . . 0.0 109.83 179.261 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.34 -15.11 34.14 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 120.99 -1.069 . . . . 0.0 112.261 -179.909 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.435 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 64.3 mm-40 -104.94 23.15 14.01 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 120.475 -1.391 . . . . 0.0 112.165 -179.609 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.4 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 7.5 tttt 75.99 68.42 0.07 Allowed 'General case' 0 N--CA 1.511 2.62 0 O-C-N 121.051 -1.031 . . . . 0.0 112.028 179.277 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.461 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 31.4 m-85 -131.87 -63.35 0.82 Allowed 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 178.784 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -137.41 162.07 34.62 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.482 -0.761 . . . . 0.0 109.07 178.914 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.437 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 21.8 t0 -113.71 117.07 30.5 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.084 -1.01 . . . . 0.0 110.403 -179.804 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 6.1 mtpt -58.51 -38.76 78.37 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.206 -0.934 . . . . 0.0 109.86 179.742 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 47.4 tp -59.65 -40.22 87.01 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.101 -0.999 . . . . 0.0 109.756 179.629 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 66.1 tp -67.09 -52.45 41.88 Favored 'General case' 0 N--CA 1.508 2.426 0 C-N-CA 119.271 -0.972 . . . . 0.0 108.643 179.227 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 54.6 mt -58.6 -32.53 46.29 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.396 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.103 178.409 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.48 -42.86 78.06 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.046 -1.034 . . . . 0.0 109.521 178.833 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.417 ' CD ' ' CD2' ' A' ' 106' ' ' LEU . 7.5 mttp -59.6 -41.22 89.82 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.119 -0.988 . . . . 0.0 110.14 179.465 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.3 m0 -65.1 -39.49 93.22 Favored 'General case' 0 N--CA 1.508 2.469 0 C-N-CA 119.125 -1.03 . . . . 0.0 109.836 179.569 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 3.2 mtp85 -75.95 -29.93 58.47 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.268 -0.895 . . . . 0.0 110.566 179.304 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.5 mmtm -54.18 -176.49 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.652 0 O-C-N 120.86 -1.15 . . . . 0.0 110.589 179.771 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 53.7 m -105.07 131.57 52.4 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.166 -0.959 . . . . 0.0 109.772 179.296 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.35 8.33 50.11 Favored Glycine 0 N--CA 1.493 2.489 0 C-N-CA 120.196 -1.002 . . . . 0.0 111.109 -179.449 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -114.75 68.17 0.7 Allowed 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 119.499 1.65 . . . . 0.0 109.946 179.672 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -84.54 -38.53 19.89 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.079 -1.013 . . . . 0.0 109.983 179.787 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.82 90.34 3.31 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.126 -0.984 . . . . 0.0 109.969 179.842 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 9.9 tp -126.99 134.68 50.31 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.279 -0.888 . . . . 0.0 109.664 -179.647 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.451 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.3 p -108.76 -37.93 5.76 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.201 -0.937 . . . . 0.0 112.356 -179.791 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.585 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.5 m -139.92 -167.93 2.4 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.22 -1.55 . . . . 0.0 109.877 178.905 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.417 ' CD2' ' CD ' ' A' ' 94' ' ' LYS . 17.3 mt -98.22 -37.76 9.56 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.132 -0.98 . . . . 0.0 110.674 179.493 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 30.8 ttm-85 -102.52 33.33 3.2 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.949 -1.095 . . . . 0.0 109.311 178.055 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.585 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.312 1.7 t -128.61 17.12 6.41 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.322 -0.861 . . . . 0.0 108.838 -179.06 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.405 ' CG2' ' O ' ' A' ' 108' ' ' CYS . 1.1 pt -159.1 38.54 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 120.814 -1.179 . . . . 0.0 110.434 -178.904 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.409 ' O ' ' OG1' ' A' ' 119' ' ' THR . 12.7 mm-40 . . . . . 0 N--CA 1.503 2.194 0 O-C-N 120.74 -1.225 . . . . 0.0 110.913 -178.769 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.409 ' OG1' ' O ' ' A' ' 110' ' ' GLN . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.731 0 CA-C-O 120.883 0.373 . . . . 0.0 110.527 . . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 43.3 t -108.02 155.31 20.5 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.436 -0.79 . . . . 0.0 108.922 178.727 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.45 ' CG2' ' CE1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -70.62 -37.15 68.48 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.425 0 O-C-N 121.027 -1.045 . . . . 0.0 110.633 -179.404 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.477 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 6.7 p -55.36 -33.6 63.56 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 120.818 -1.176 . . . . 0.0 110.752 -179.29 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.92 -33.46 70.59 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 120.924 -1.11 . . . . 0.0 109.71 178.325 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 62.0 t -81.17 125.22 79.96 Favored Pre-proline 0 N--CA 1.504 2.269 0 O-C-N 121.163 -0.961 . . . . 0.0 109.725 179.688 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -65.73 170.26 11.63 Favored 'Trans proline' 0 N--CA 1.487 1.111 0 O-C-N 123.119 1.062 . . . . 0.0 110.659 179.582 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 5.9 tpt180 -75.12 -36.42 61.64 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.303 -0.873 . . . . 0.0 110.721 -179.753 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.76 -41.4 81.87 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 120.963 -1.085 . . . . 0.0 110.093 -179.8 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -68.33 -41.34 80.94 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.215 -0.928 . . . . 0.0 109.232 179.275 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.7 mt -63.63 -39.28 93.95 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.249 -0.907 . . . . 0.0 109.676 179.308 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -59.31 -39.66 83.76 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.13 -0.981 . . . . 0.0 109.924 179.716 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -59.88 -37.9 80.68 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.1 -1.0 . . . . 0.0 110.127 179.724 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -61.81 -46.43 89.55 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.178 -0.952 . . . . 0.0 109.869 179.904 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.07 -40.98 95.73 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.218 -0.926 . . . . 0.0 109.906 -179.998 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 19.9 ttt85 -64.98 -30.96 71.99 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.185 -0.947 . . . . 0.0 110.689 179.798 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.43 -29.03 23.16 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 120.95 -1.094 . . . . 0.0 111.361 -179.811 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 23.6 mttt -98.6 24.12 7.84 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 120.783 -1.198 . . . . 0.0 111.724 -179.909 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.16 46.74 42.73 Favored Glycine 0 N--CA 1.5 2.952 0 O-C-N 120.771 -1.205 . . . . 0.0 111.077 179.26 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.7 t -148.93 -164.18 1.96 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.069 -1.253 . . . . 0.0 110.533 179.846 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -139.52 149.7 44.24 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.224 -0.923 . . . . 0.0 110.302 -179.867 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.4 p -132.66 161.0 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 O-C-N 121.221 -0.924 . . . . 0.0 110.2 -179.979 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 41.0 t -168.19 85.6 0.2 Allowed 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.167 -0.958 . . . . 0.0 111.099 -179.963 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.477 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 50.5 t80 -99.38 160.48 14.25 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.261 -0.899 . . . . 0.0 110.486 -179.926 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 -137.06 -61.29 0.66 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.509 -0.744 . . . . 0.0 109.02 178.967 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -134.69 152.04 51.47 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.428 -0.795 . . . . 0.0 108.95 178.669 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 31.5 p -92.85 152.77 19.23 Favored 'General case' 0 N--CA 1.504 2.267 0 C-N-CA 119.028 -1.069 . . . . 0.0 111.085 -179.552 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.9 m -70.61 -26.38 28.35 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.407 0 O-C-N 121.427 -0.795 . . . . 0.0 111.307 -179.522 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -50.49 -58.49 5.65 Favored 'General case' 0 N--CA 1.516 2.841 0 O-C-N 120.855 -1.153 . . . . 0.0 110.213 -179.993 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.434 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 26.0 p -127.59 -166.71 1.64 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.261 -0.899 . . . . 0.0 110.566 179.656 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . 0.419 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.06 57.66 0.8 Allowed Glycine 0 N--CA 1.493 2.442 0 N-CA-C 107.958 -2.057 . . . . 0.0 107.958 178.405 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 19.3 t -101.67 142.61 32.75 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.318 -1.107 . . . . 0.0 109.784 -179.305 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 57.5 mtp85 -95.9 52.45 1.32 Allowed 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.273 -0.892 . . . . 0.0 109.736 179.353 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.89 98.41 0.03 OUTLIER Glycine 0 N--CA 1.488 2.123 0 N-CA-C 109.866 -1.293 . . . . 0.0 109.866 179.956 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 22.6 p -110.44 131.08 55.36 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.266 -1.138 . . . . 0.0 110.356 179.552 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -142.32 141.38 32.37 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.096 -1.003 . . . . 0.0 110.038 -179.802 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.498 1.934 0 O-C-N 121.258 -0.901 . . . . 0.0 110.223 179.972 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.441 ' HB3' ' CE3' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.498 1.966 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 . . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -69.67 164.79 33.12 Favored 'Trans proline' 0 C--N 1.316 -1.134 0 O-C-N 123.377 1.199 . . . . 0.0 110.869 -179.682 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -47.66 -32.48 5.71 Favored 'General case' 0 N--CA 1.516 2.844 0 O-C-N 121.435 -0.791 . . . . 0.0 111.493 -179.743 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.61 -35.39 51.78 Favored Glycine 0 N--CA 1.498 2.812 0 N-CA-C 110.373 -1.091 . . . . 0.0 110.373 179.771 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -55.75 -33.58 64.42 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 120.948 -1.324 . . . . 0.0 110.681 179.713 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -54.99 -38.45 67.87 Favored 'General case' 0 N--CA 1.513 2.676 0 O-C-N 120.993 -1.067 . . . . 0.0 110.106 179.807 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.2 mmtm -58.81 -35.52 73.0 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.359 -0.838 . . . . 0.0 110.192 179.44 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 3.2 pt -116.73 36.13 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.135 -0.978 . . . . 0.0 110.616 179.732 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 3.5 tmtt? -82.53 -43.38 0.95 Allowed Pre-proline 0 N--CA 1.509 2.484 0 O-C-N 121.003 -1.06 . . . . 0.0 112.941 -179.43 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 48.8 Cg_endo -76.95 -36.58 1.4 Allowed 'Trans proline' 0 N--CA 1.486 1.08 0 O-C-N 122.639 0.81 . . . . 0.0 111.527 -178.561 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.453 ' CG2' ' CE2' ' A' ' 62' ' ' TYR . 91.1 m -59.37 -43.45 92.87 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 120.932 -1.105 . . . . 0.0 110.083 -179.664 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.415 HD23 ' CE2' ' A' ' 86' ' ' TYR . 1.0 OUTLIER -61.26 -36.33 79.7 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.263 -0.898 . . . . 0.0 110.021 179.642 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.45 -36.52 73.81 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 120.92 -1.112 . . . . 0.0 110.176 179.472 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -58.1 -34.31 70.06 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.049 -1.032 . . . . 0.0 110.379 179.601 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.497 ' CE2' HD13 ' A' ' 55' ' ' LEU . 8.8 m-85 -56.65 -42.49 79.01 Favored 'General case' 0 N--CA 1.512 2.65 0 O-C-N 120.911 -1.118 . . . . 0.0 110.008 179.54 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -57.81 -26.53 62.11 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.367 -0.933 . . . . 0.0 110.453 179.274 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 13.1 mm -67.12 -51.08 57.62 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.291 0 O-C-N 120.945 -1.097 . . . . 0.0 108.485 179.225 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.4 tp60 -64.23 -52.02 60.8 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.227 -0.92 . . . . 0.0 108.546 178.852 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.1 tp -57.03 -36.89 71.0 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.24 -0.913 . . . . 0.0 109.64 178.905 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -57.38 -37.62 72.95 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.084 -1.01 . . . . 0.0 110.123 179.784 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.61 -50.14 72.45 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.11 -0.993 . . . . 0.0 109.517 179.803 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.421 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -68.14 -42.86 79.49 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 119.016 -1.074 . . . . 0.0 108.89 178.96 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -61.3 -32.11 71.96 Favored 'General case' 0 N--CA 1.504 2.266 0 C-N-CA 119.576 -0.849 . . . . 0.0 110.213 179.374 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.5 mmpt? -96.28 -20.46 18.51 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 120.975 -1.078 . . . . 0.0 111.71 -179.96 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 20.4 t0 . . . . . 0 N--CA 1.513 2.681 0 O-C-N 120.672 -1.268 . . . . 0.0 110.534 -179.966 . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 63.2 m . . . . . 0 N--CA 1.498 1.931 0 CA-C-O 120.629 0.252 . . . . 0.0 110.482 . . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.408 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 18.0 m120 -57.29 -40.96 78.87 Favored 'General case' 0 N--CA 1.51 2.561 0 O-C-N 121.205 -0.934 . . . . 0.0 109.844 179.838 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -59.94 -38.67 83.09 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.219 -0.926 . . . . 0.0 109.941 179.62 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.405 ' HG2' ' CA ' ' A' ' 33' ' ' ALA . 0.5 OUTLIER -59.47 -40.23 86.25 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.17 -0.956 . . . . 0.0 110.265 179.985 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 91.4 mt -74.8 -31.69 61.79 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.227 -0.921 . . . . 0.0 110.716 -179.929 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.418 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 40.2 m0 -57.98 -39.69 78.81 Favored 'General case' 0 N--CA 1.512 2.67 0 O-C-N 120.842 -1.161 . . . . 0.0 109.245 179.134 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.0 -34.74 78.4 Favored 'General case' 0 N--CA 1.499 1.985 0 C-N-CA 119.046 -1.062 . . . . 0.0 108.807 177.626 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.421 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 5.1 mt -71.74 -56.75 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.175 0 O-C-N 121.114 -0.991 . . . . 0.0 109.358 179.106 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -58.22 -25.88 62.18 Favored 'General case' 0 N--CA 1.512 2.633 0 C-N-CA 118.208 -1.397 . . . . 0.0 109.884 178.72 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.5 mt-30 -62.17 -37.14 84.11 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.874 -1.141 . . . . 0.0 109.376 178.165 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.497 HD13 ' CE2' ' A' ' 26' ' ' PHE . 1.0 OUTLIER -53.76 -35.67 61.52 Favored 'General case' 0 N--CA 1.513 2.683 0 O-C-N 120.933 -1.105 . . . . 0.0 109.73 179.099 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.441 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 33.5 t60 -51.51 -36.86 46.49 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.039 -1.038 . . . . 0.0 110.449 179.975 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.453 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 15.3 m170 -71.2 -46.77 60.54 Favored 'General case' 0 N--CA 1.505 2.29 0 C-N-CA 119.225 -0.99 . . . . 0.0 109.088 179.222 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.425 ' HB3' ' CE2' ' A' ' 26' ' ' PHE . 5.6 tt0 -63.2 -35.4 80.18 Favored 'General case' 0 N--CA 1.505 2.284 0 C-N-CA 119.249 -0.98 . . . . 0.0 109.41 178.696 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.447 ' CD ' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -68.26 -48.91 63.79 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.138 -0.976 . . . . 0.0 109.292 179.259 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.4 p -63.86 -38.53 91.43 Favored 'General case' 0 N--CA 1.503 2.198 0 C-N-CA 119.356 -0.938 . . . . 0.0 109.231 179.161 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.416 ' O ' ' OG1' ' A' ' 65' ' ' THR . 5.1 ttt-85 -65.73 -42.04 91.52 Favored 'General case' 0 N--CA 1.504 2.275 0 C-N-CA 119.246 -0.982 . . . . 0.0 109.106 179.125 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.453 ' CE2' ' CG2' ' A' ' 22' ' ' THR . 54.4 t80 -62.8 -48.75 77.75 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.189 -0.944 . . . . 0.0 109.357 179.377 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.434 HG22 HD12 ' A' ' 63' ' ' ILE . 89.6 mt -71.02 -39.94 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.328 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.245 179.574 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 10.3 t80 -65.3 -42.12 93.37 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.245 -0.91 . . . . 0.0 108.839 179.027 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.416 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 92.0 m -61.27 -41.83 97.6 Favored 'General case' 0 N--CA 1.502 2.135 0 C-N-CA 119.283 -0.967 . . . . 0.0 110.54 -179.614 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.4 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.6 pp -83.09 -32.35 26.82 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 118.811 -1.156 . . . . 0.0 112.323 -178.944 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -86.44 -32.53 20.81 Favored 'General case' 0 N--CA 1.511 2.591 0 O-C-N 120.708 -1.245 . . . . 0.0 111.781 -179.454 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -98.42 -25.38 14.82 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 120.716 -1.24 . . . . 0.0 112.525 -178.661 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 63.3 mttt -108.55 -57.52 2.12 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.596 -1.315 . . . . 0.0 110.717 179.968 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 28.4 ttt-85 -72.92 -30.22 63.73 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.242 -0.911 . . . . 0.0 111.009 -179.388 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.5 mttp 56.62 42.39 27.14 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.743 -1.223 . . . . 0.0 110.041 -179.468 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -108.84 34.18 3.83 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.423 -0.798 . . . . 0.0 109.845 179.119 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.489 HG23 HD12 ' A' ' 73' ' ' ILE . 13.9 tt -149.21 162.84 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.17 -0.956 . . . . 0.0 109.58 -179.938 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 62.0 m -107.44 144.24 34.64 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.013 -1.054 . . . . 0.0 110.378 179.972 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -45.24 -32.71 2.03 Favored 'General case' 0 N--CA 1.515 2.805 0 O-C-N 121.353 -0.842 . . . . 0.0 111.562 179.988 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -61.82 -51.09 69.66 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 120.908 -1.12 . . . . 0.0 109.19 179.329 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 37.2 tp -66.13 -43.85 85.91 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.186 -1.006 . . . . 0.0 108.322 178.637 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.421 ' CE1' HD13 ' A' ' 82' ' ' ILE . 15.5 t80 -58.98 -41.45 87.58 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.359 -0.838 . . . . 0.0 109.173 178.956 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -72.32 -42.3 65.59 Favored 'General case' 0 N--CA 1.504 2.271 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 178.222 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.441 ' CE3' ' HB3' ' A' ' 12' ' ' ALA . 86.5 t90 -56.12 -36.78 68.6 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.231 -0.918 . . . . 0.0 109.359 178.464 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.446 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 11.1 mt -66.59 -59.56 3.51 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.232 -0.917 . . . . 0.0 108.769 178.927 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.421 HD13 ' CE1' ' A' ' 78' ' ' TYR . 2.5 mt -56.27 -27.73 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.584 0 O-C-N 120.907 -1.12 . . . . 0.0 109.927 179.352 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 56.1 tttt -81.5 -21.02 38.91 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.896 -1.127 . . . . 0.0 110.971 178.579 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.422 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 20.3 mm-40 -105.44 22.72 14.96 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.809 -1.182 . . . . 0.0 111.979 179.91 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.416 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 4.2 tmtt? 77.3 67.73 0.05 OUTLIER 'General case' 0 N--CA 1.515 2.811 0 O-C-N 121.207 -0.933 . . . . 0.0 112.075 179.167 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.446 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 20.8 m-85 -130.28 -62.59 0.93 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.409 -0.807 . . . . 0.0 108.938 178.839 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -131.26 167.62 18.9 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.406 -0.809 . . . . 0.0 109.581 179.463 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.441 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 13.3 t0 -120.13 114.6 22.2 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.187 -0.945 . . . . 0.0 110.338 179.897 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -58.1 -38.16 75.93 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.24 -0.912 . . . . 0.0 110.028 179.803 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.5 tp -58.69 -38.19 77.72 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.211 -0.931 . . . . 0.0 110.144 179.842 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.419 ' HG ' ' CZ3' ' A' ' 95' ' ' TRP . 62.8 tp -69.42 -52.34 27.83 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.007 -1.058 . . . . 0.0 108.854 179.41 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.429 HG23 HD12 ' A' ' 92' ' ' ILE . 69.0 mt -60.33 -32.7 51.57 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 C-N-CA 119.249 -0.98 . . . . 0.0 108.978 178.33 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.42 -49.27 67.32 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 120.989 -1.069 . . . . 0.0 109.267 178.826 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.4 ' CD ' ' CD2' ' A' ' 106' ' ' LEU . 11.2 mttp -56.55 -42.11 77.97 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.004 -1.06 . . . . 0.0 109.618 179.243 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.419 ' CZ3' ' HG ' ' A' ' 91' ' ' LEU . 3.8 m0 -62.17 -30.99 71.44 Favored 'General case' 0 N--CA 1.504 2.273 0 C-N-CA 119.142 -1.023 . . . . 0.0 109.634 178.682 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.15 22.58 10.23 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 120.953 -1.092 . . . . 0.0 111.117 179.048 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.428 ' HB2' ' CD2' ' A' ' 100' ' ' TYR . 8.0 mmtp -102.17 -174.06 2.49 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 120.686 -1.259 . . . . 0.0 109.628 179.052 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 56.5 m -102.57 127.43 49.65 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.112 -0.992 . . . . 0.0 109.678 179.244 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.69 9.22 50.37 Favored Glycine 0 N--CA 1.493 2.454 0 C-N-CA 120.187 -1.006 . . . . 0.0 111.038 -179.218 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.428 ' CD2' ' HB2' ' A' ' 97' ' ' LYS . 44.6 m-85 -111.15 48.87 0.91 Allowed 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 119.598 1.699 . . . . 0.0 110.219 179.744 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -59.52 -38.48 81.1 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.112 -0.992 . . . . 0.0 109.988 179.862 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -122.06 121.25 36.56 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.18 -0.95 . . . . 0.0 110.202 -179.966 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 9.7 tp -153.74 131.3 11.42 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.185 -0.947 . . . . 0.0 110.259 -179.674 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.453 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.4 p -108.98 -37.06 5.93 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.228 -0.92 . . . . 0.0 112.227 179.988 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.587 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.3 m -140.97 -168.62 2.64 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.216 -1.552 . . . . 0.0 110.118 178.943 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.4 ' CD2' ' CD ' ' A' ' 94' ' ' LYS . 15.8 mt -97.18 -38.44 9.71 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.97 -1.082 . . . . 0.0 110.368 179.298 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 1.1 ttt85 -101.71 31.57 3.77 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.954 -1.091 . . . . 0.0 109.612 178.195 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.587 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.305 1.7 t -127.72 16.13 6.94 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.123 -0.986 . . . . 0.0 109.021 -179.344 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.403 ' CG2' ' O ' ' A' ' 108' ' ' CYS . 1.1 pt -158.88 38.41 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.369 0 O-C-N 120.937 -1.102 . . . . 0.0 110.423 -178.953 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.426 ' O ' ' OG1' ' A' ' 119' ' ' THR . 4.2 tt0 . . . . . 0 N--CA 1.502 2.164 0 O-C-N 120.838 -1.164 . . . . 0.0 111.314 -178.625 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.426 ' OG1' ' O ' ' A' ' 110' ' ' GLN . 1.1 m . . . . . 0 N--CA 1.494 1.769 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 . . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 47.2 t -103.93 155.05 18.95 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.361 -0.837 . . . . 0.0 109.113 178.889 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.465 HG21 HD12 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -71.72 -36.19 58.16 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.372 0 O-C-N 121.056 -1.027 . . . . 0.0 110.77 -179.344 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.473 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.4 p -54.58 -32.55 58.79 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 120.772 -1.205 . . . . 0.0 110.9 -179.108 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 6.7 ttt-85 -58.75 -35.02 72.07 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 120.974 -1.079 . . . . 0.0 109.409 178.123 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 47.3 t -81.39 125.5 78.71 Favored Pre-proline 0 N--CA 1.504 2.253 0 O-C-N 121.282 -0.886 . . . . 0.0 109.669 179.539 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.01 177.93 2.71 Favored 'Trans proline' 0 N--CA 1.489 1.242 0 O-C-N 123.126 1.067 . . . . 0.0 110.698 179.807 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -75.18 -37.78 61.09 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.23 -0.919 . . . . 0.0 110.548 -179.766 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.51 -41.72 86.06 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.062 -1.024 . . . . 0.0 109.967 -179.804 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -68.6 -41.36 79.71 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.22 -0.925 . . . . 0.0 109.209 179.307 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 3.5 mt -64.29 -38.78 92.24 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.265 -0.897 . . . . 0.0 109.651 179.278 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -61.65 -40.56 95.35 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.123 -0.986 . . . . 0.0 109.721 179.802 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -60.42 -39.13 86.33 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.214 -0.929 . . . . 0.0 110.099 179.848 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -59.9 -41.07 90.84 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.232 -0.917 . . . . 0.0 110.038 -179.985 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.0 -45.17 94.8 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.186 -0.946 . . . . 0.0 109.91 179.911 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 3.5 ttt85 -59.33 -38.49 80.46 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.131 -0.98 . . . . 0.0 109.867 179.46 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -58.54 -35.62 72.6 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.223 -0.923 . . . . 0.0 110.509 179.859 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 13.9 mttp -105.37 18.24 22.6 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 120.98 -1.075 . . . . 0.0 111.908 -179.959 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 56.17 44.95 88.77 Favored Glycine 0 N--CA 1.498 2.775 0 O-C-N 120.601 -1.312 . . . . 0.0 110.312 179.374 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.2 t -136.89 -163.0 1.35 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.131 -1.217 . . . . 0.0 109.967 179.848 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -137.12 146.09 44.64 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.075 -1.015 . . . . 0.0 110.276 -179.957 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.7 p -132.79 161.38 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.226 -0.921 . . . . 0.0 110.117 -179.954 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 42.2 t -167.36 82.1 0.21 Allowed 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.212 -0.93 . . . . 0.0 111.041 179.943 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.473 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 44.7 t80 -94.42 161.45 14.23 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.253 -0.904 . . . . 0.0 110.337 179.997 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 -140.67 -60.71 0.51 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.534 -0.728 . . . . 0.0 109.098 179.124 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -131.15 151.56 51.32 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.427 -0.796 . . . . 0.0 109.055 178.871 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 28.1 p -96.73 154.79 17.08 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 121.052 -1.03 . . . . 0.0 110.957 -179.698 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.1 m -73.89 -25.68 20.61 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.464 0 O-C-N 121.382 -0.824 . . . . 0.0 111.813 -179.218 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -49.99 -51.66 39.97 Favored 'General case' 0 N--CA 1.516 2.829 0 O-C-N 120.839 -1.163 . . . . 0.0 110.268 -179.768 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.418 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 28.1 p -134.87 -165.53 1.68 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.198 -0.938 . . . . 0.0 110.606 179.832 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -99.17 58.08 0.87 Allowed Glycine 0 N--CA 1.493 2.441 0 N-CA-C 108.013 -2.035 . . . . 0.0 108.013 178.492 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 27.8 t -103.06 144.05 31.79 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.339 -1.095 . . . . 0.0 109.988 -179.196 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 74.7 mtt85 -99.06 49.02 0.95 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.331 -0.855 . . . . 0.0 109.629 179.298 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.94 98.58 0.05 OUTLIER Glycine 0 N--CA 1.488 2.133 0 N-CA-C 109.866 -1.294 . . . . 0.0 109.866 179.938 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.5 p -111.98 128.01 56.04 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.302 -1.116 . . . . 0.0 110.237 179.652 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -141.87 146.12 35.41 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.014 -1.054 . . . . 0.0 110.005 -179.626 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.496 1.847 0 O-C-N 121.269 -0.894 . . . . 0.0 110.203 -179.901 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.444 ' HB3' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.507 2.4 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 . . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -76.22 79.14 3.02 Favored 'Trans proline' 0 N--CA 1.487 1.089 0 O-C-N 123.251 1.132 . . . . 0.0 112.168 -178.299 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.9 t70 48.04 90.05 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.332 -0.855 . . . . 0.0 111.826 178.397 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 164.23 -42.19 0.31 Allowed Glycine 0 N--CA 1.501 2.969 0 C-N-CA 119.782 -1.199 . . . . 0.0 110.641 179.58 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -55.07 -29.4 57.45 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.183 -1.186 . . . . 0.0 110.801 179.872 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -54.52 -37.81 65.79 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 120.92 -1.113 . . . . 0.0 110.18 179.596 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.08 -35.04 70.82 Favored 'General case' 0 N--CA 1.511 2.585 0 O-C-N 121.231 -0.918 . . . . 0.0 110.376 179.425 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.1 pt -124.4 36.82 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 121.173 -0.954 . . . . 0.0 110.325 179.835 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -83.81 -42.69 0.79 Allowed Pre-proline 0 N--CA 1.509 2.507 0 O-C-N 121.128 -0.982 . . . . 0.0 113.474 -179.168 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.0 Cg_endo -74.41 -33.8 5.14 Favored 'Trans proline' 0 N--CA 1.488 1.166 0 O-C-N 122.623 0.802 . . . . 0.0 112.04 -177.978 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 93.2 m -58.73 -41.46 86.45 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.791 -1.193 . . . . 0.0 110.044 -179.814 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.429 HD21 ' CE2' ' A' ' 86' ' ' TYR . 0.3 OUTLIER -62.22 -37.27 84.7 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.26 -0.9 . . . . 0.0 110.109 179.636 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -57.43 -37.06 72.18 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 120.964 -1.085 . . . . 0.0 110.22 179.809 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -59.91 -35.38 74.74 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.105 -0.997 . . . . 0.0 110.198 179.592 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.492 ' CE2' HD12 ' A' ' 55' ' ' LEU . 6.9 m-85 -57.37 -43.53 83.64 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 120.987 -1.07 . . . . 0.0 110.071 179.355 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -57.49 -26.55 61.46 Favored 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 119.264 -0.974 . . . . 0.0 110.45 179.259 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.6 mm -65.15 -49.63 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.325 0 O-C-N 120.987 -1.07 . . . . 0.0 109.05 179.402 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -66.96 -52.01 48.12 Favored 'General case' 0 N--CA 1.505 2.323 0 C-N-CA 119.201 -1.0 . . . . 0.0 108.61 179.042 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.403 ' CD2' ' CG2' ' A' ' 52' ' ' ILE . 0.1 OUTLIER -57.84 -33.25 68.44 Favored 'General case' 0 N--CA 1.51 2.552 0 C-N-CA 119.331 -0.948 . . . . 0.0 109.738 178.802 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.27 -44.9 96.47 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 120.877 -1.139 . . . . 0.0 110.0 179.875 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.34 -43.33 96.56 Favored 'General case' 0 N--CA 1.508 2.468 0 C-N-CA 119.218 -0.993 . . . . 0.0 109.884 -179.629 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.421 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -71.79 -41.69 68.0 Favored 'General case' 0 N--CA 1.503 2.218 0 C-N-CA 119.247 -0.981 . . . . 0.0 109.093 178.954 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -62.48 -32.72 73.66 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.288 -0.883 . . . . 0.0 110.28 179.474 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.4 mmtt -94.96 -38.37 10.72 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 120.896 -1.128 . . . . 0.0 110.723 179.906 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.5 t70 . . . . . 0 N--CA 1.511 2.614 0 O-C-N 121.055 -1.028 . . . . 0.0 109.984 179.836 . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.1 m . . . . . 0 N--CA 1.499 2.014 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 . . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.403 ' O ' ' CG ' ' A' ' 50' ' ' TRP . 68.5 m-20 -58.51 -39.02 78.93 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.206 -0.934 . . . . 0.0 109.856 179.483 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -66.32 -45.64 79.57 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.164 -0.96 . . . . 0.0 109.333 179.344 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 49.2 tp60 -66.78 -41.66 87.29 Favored 'General case' 0 N--CA 1.505 2.296 0 C-N-CA 119.341 -0.943 . . . . 0.0 109.015 179.048 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -61.0 -37.33 82.15 Favored 'General case' 0 N--CA 1.506 2.332 0 C-N-CA 119.506 -0.878 . . . . 0.0 109.78 179.318 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.426 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.4 m0 -58.6 -35.95 73.24 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.947 -1.096 . . . . 0.0 110.259 179.712 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -63.92 -29.49 70.66 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.022 -1.049 . . . . 0.0 109.87 178.513 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.421 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 68.1 mt -71.88 -57.9 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.279 0 O-C-N 120.92 -1.112 . . . . 0.0 109.564 179.542 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 ptm -57.93 -26.65 62.52 Favored 'General case' 0 N--CA 1.511 2.602 0 C-N-CA 118.284 -1.366 . . . . 0.0 109.796 178.769 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -62.39 -35.97 80.85 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 120.812 -1.18 . . . . 0.0 109.503 178.19 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.492 HD12 ' CE2' ' A' ' 26' ' ' PHE . 0.5 OUTLIER -53.64 -36.51 62.15 Favored 'General case' 0 N--CA 1.513 2.695 0 O-C-N 120.868 -1.145 . . . . 0.0 109.869 179.378 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.43 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 22.4 t60 -53.14 -38.42 62.69 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.917 -1.114 . . . . 0.0 110.427 -179.684 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.44 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 5.5 m170 -67.48 -54.79 17.14 Favored 'General case' 0 N--CA 1.506 2.338 0 C-N-CA 119.207 -0.997 . . . . 0.0 109.318 179.369 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.432 ' HB3' ' CE2' ' A' ' 26' ' ' PHE . 13.7 tt0 -56.76 -32.93 66.1 Favored 'General case' 0 N--CA 1.507 2.381 0 C-N-CA 119.404 -0.918 . . . . 0.0 109.726 178.975 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.409 ' HG3' ' CE2' ' A' ' 26' ' ' PHE . 0.4 OUTLIER -67.18 -52.42 41.54 Favored 'General case' 0 N--CA 1.509 2.475 0 O-C-N 120.965 -1.084 . . . . 0.0 109.184 178.834 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.8 p -63.31 -37.63 88.0 Favored 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 119.253 -0.979 . . . . 0.0 109.318 178.997 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.422 ' O ' ' OG1' ' A' ' 65' ' ' THR . 48.6 ttt85 -65.06 -39.33 93.12 Favored 'General case' 0 N--CA 1.505 2.289 0 C-N-CA 119.251 -0.98 . . . . 0.0 109.355 179.053 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 35.7 t80 -62.27 -50.51 71.41 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.013 -1.054 . . . . 0.0 109.375 179.441 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.43 HG21 HD12 ' A' ' 63' ' ' ILE . 86.8 mt -71.8 -40.33 69.2 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.34 0 O-C-N 121.188 -0.945 . . . . 0.0 109.232 179.28 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -64.08 -42.59 96.9 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.157 -0.964 . . . . 0.0 109.123 179.272 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.422 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 94.0 m -61.67 -42.28 98.7 Favored 'General case' 0 N--CA 1.501 2.116 0 C-N-CA 119.3 -0.96 . . . . 0.0 110.297 -179.642 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.404 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.6 pp -83.25 -31.85 26.76 Favored 'General case' 0 N--CA 1.504 2.267 0 C-N-CA 118.828 -1.149 . . . . 0.0 112.485 -179.022 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 66.8 t80 -86.24 -33.16 20.8 Favored 'General case' 0 N--CA 1.514 2.732 0 O-C-N 120.659 -1.275 . . . . 0.0 111.71 -179.508 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -98.37 -18.95 18.03 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 120.813 -1.179 . . . . 0.0 112.726 -178.662 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 5.6 mttt -120.97 -59.32 1.74 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 120.439 -1.413 . . . . 0.0 110.944 179.844 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.1 -30.76 71.85 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.124 -0.985 . . . . 0.0 110.763 -179.648 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 42.0 tttt 57.68 42.35 23.95 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 120.751 -1.218 . . . . 0.0 110.062 -179.554 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -111.9 35.12 3.83 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.406 -0.809 . . . . 0.0 109.879 179.285 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.404 ' CG2' ' CD1' ' A' ' 66' ' ' LEU . 14.0 tt -154.17 162.48 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 O-C-N 121.234 -0.916 . . . . 0.0 109.895 179.969 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 43.5 m -107.6 145.08 33.75 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.137 -0.977 . . . . 0.0 110.301 179.863 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -46.71 -30.6 2.46 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.293 -0.879 . . . . 0.0 111.772 179.95 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.44 -50.46 73.5 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.781 -1.199 . . . . 0.0 109.462 179.677 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 24.5 tp -69.26 -44.02 72.76 Favored 'General case' 0 N--CA 1.505 2.277 0 C-N-CA 118.918 -1.113 . . . . 0.0 108.232 178.637 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -57.41 -38.6 74.59 Favored 'General case' 0 N--CA 1.509 2.475 0 C-N-CA 119.547 -0.861 . . . . 0.0 109.228 178.662 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -74.99 -42.45 57.51 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 177.925 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.444 ' CH2' ' HB3' ' A' ' 12' ' ' ALA . 81.4 t90 -55.44 -37.86 68.27 Favored 'General case' 0 N--CA 1.511 2.596 0 O-C-N 121.27 -0.894 . . . . 0.0 109.361 178.444 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.458 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 9.2 mt -68.32 -50.2 55.02 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.17 -0.956 . . . . 0.0 108.828 178.917 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.404 HG23 HD13 ' A' ' 82' ' ' ILE . 36.5 mm -56.4 -30.72 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.647 0 O-C-N 121.271 -0.893 . . . . 0.0 110.115 179.36 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 54.1 mttt -89.09 -22.17 23.03 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.932 -1.105 . . . . 0.0 111.753 -179.999 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.418 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 60.2 mm-40 -98.46 21.58 10.95 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 120.618 -1.301 . . . . 0.0 111.941 -179.97 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.6 tttm 74.39 74.1 0.11 Allowed 'General case' 0 N--CA 1.511 2.624 0 O-C-N 121.062 -1.024 . . . . 0.0 111.765 179.258 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.458 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 29.7 m-85 -133.22 -62.4 0.79 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.488 -0.757 . . . . 0.0 109.342 179.603 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -127.65 161.81 28.01 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.423 -0.798 . . . . 0.0 109.402 179.219 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.43 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 8.5 t0 -108.33 111.39 23.3 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.125 -0.984 . . . . 0.0 110.445 -179.853 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.0 mmtp -58.23 -36.81 73.73 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.313 -0.867 . . . . 0.0 110.109 179.707 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.1 tp -58.2 -38.64 77.14 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.075 -1.016 . . . . 0.0 110.131 179.707 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.403 HD21 ' CD2' ' A' ' 57' ' ' HIS . 64.1 tp -70.24 -53.22 17.89 Favored 'General case' 0 N--CA 1.505 2.311 0 C-N-CA 119.196 -1.002 . . . . 0.0 108.751 179.284 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.412 HD13 HG21 ' A' ' 92' ' ' ILE . 54.8 mt -59.38 -31.33 46.19 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.47 0 C-N-CA 119.225 -0.99 . . . . 0.0 109.299 178.469 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.5 -45.57 83.03 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 120.962 -1.086 . . . . 0.0 109.733 179.219 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.415 ' CD ' ' CD2' ' A' ' 106' ' ' LEU . 7.2 mttp -60.89 -45.03 96.2 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.088 -1.007 . . . . 0.0 109.882 179.376 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.7 m0 -58.31 -37.6 75.4 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.987 -1.071 . . . . 0.0 109.843 179.366 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.09 -36.75 55.48 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.204 -0.935 . . . . 0.0 109.743 178.864 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 31.1 mmtt -54.36 -177.12 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.641 0 O-C-N 121.075 -1.016 . . . . 0.0 110.226 179.588 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 33.1 m -108.57 141.03 41.08 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.247 -0.908 . . . . 0.0 109.341 178.807 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 106.5 -29.72 10.57 Favored Glycine 0 N--CA 1.492 2.42 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 -178.987 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 51.9 m-85 -92.64 56.83 2.77 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 120.895 -1.356 . . . . 0.0 110.061 179.747 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -69.44 -39.42 77.82 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 120.939 -1.101 . . . . 0.0 109.707 179.649 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.56 81.54 1.74 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.234 -0.916 . . . . 0.0 110.094 179.923 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.2 tt -113.99 137.14 52.09 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.107 -0.996 . . . . 0.0 110.212 -179.983 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.44 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.0 p -105.56 -30.07 9.75 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.394 -0.816 . . . . 0.0 111.871 179.259 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.588 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 13.1 m -145.28 -168.03 2.84 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 120.323 -1.486 . . . . 0.0 109.444 178.813 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.415 ' CD2' ' CD ' ' A' ' 94' ' ' LYS . 15.1 mt -99.13 -37.03 9.49 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.119 -0.988 . . . . 0.0 110.492 178.898 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 1.8 ttt-85 -103.95 34.98 2.81 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.851 -1.156 . . . . 0.0 109.417 178.456 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.588 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.309 1.7 t -129.46 21.17 5.62 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -179.39 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.6 pt -156.73 37.08 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.282 0 O-C-N 120.953 -1.092 . . . . 0.0 110.634 -178.626 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.433 ' O ' ' OG1' ' A' ' 119' ' ' THR . 1.7 mt-30 . . . . . 0 N--CA 1.514 2.745 0 O-C-N 120.858 -1.151 . . . . 0.0 110.833 -178.864 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 119' ' ' THR . . . . . 0.433 ' OG1' ' O ' ' A' ' 110' ' ' GLN . 4.0 m . . . . . 0 N--CA 1.494 1.765 0 CA-C-O 120.659 0.266 . . . . 0.0 110.372 . . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 49.5 t -89.32 153.75 20.63 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.242 -0.911 . . . . 0.0 109.183 178.99 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.448 ' CG2' ' CE1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -74.12 -35.63 41.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 121.048 -1.032 . . . . 0.0 111.184 -178.898 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.486 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.7 p -56.05 -35.84 67.37 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.886 -1.134 . . . . 0.0 111.058 -178.613 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.82 -33.96 70.97 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.004 -1.06 . . . . 0.0 109.959 178.662 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 47.2 t -76.51 125.36 87.55 Favored Pre-proline 0 N--CA 1.505 2.28 0 O-C-N 121.065 -1.022 . . . . 0.0 110.077 179.957 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . 0.409 ' HB3' ' CB ' ' A' ' 154' ' ' ALA . 37.9 Cg_endo -65.04 175.64 3.69 Favored 'Trans proline' 0 N--CA 1.488 1.204 0 O-C-N 123.236 1.124 . . . . 0.0 110.801 179.428 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -75.02 -36.66 61.91 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.274 -0.891 . . . . 0.0 110.542 -179.977 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.29 -40.36 77.63 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.035 -1.04 . . . . 0.0 109.989 -179.935 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.21 -42.43 75.77 Favored 'General case' 0 N--CA 1.506 2.356 0 C-N-CA 119.358 -0.937 . . . . 0.0 109.169 179.313 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 3.5 mt -66.94 -39.68 87.38 Favored 'General case' 0 N--CA 1.505 2.279 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.342 178.989 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -60.51 -38.02 82.99 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.237 -0.915 . . . . 0.0 109.82 179.404 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -57.74 -37.0 72.83 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.17 -0.956 . . . . 0.0 110.372 179.787 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -63.57 -50.38 69.69 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.131 -0.981 . . . . 0.0 109.673 179.862 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.53 -38.35 87.1 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.186 -0.946 . . . . 0.0 109.991 179.745 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 5.1 ttt85 -68.96 -36.53 78.0 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 121.057 -1.027 . . . . 0.0 110.265 179.61 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -79.03 -33.83 44.43 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.01 -1.056 . . . . 0.0 110.587 179.861 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 23.1 mttt -83.97 -19.28 34.88 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.054 -1.029 . . . . 0.0 111.765 179.758 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.37 32.73 10.07 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 -179.502 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 7.8 t -135.88 -160.88 1.1 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.031 -1.276 . . . . 0.0 109.738 179.883 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -132.72 142.21 48.93 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.063 -1.023 . . . . 0.0 110.232 179.905 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.7 p -125.6 160.54 31.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 O-C-N 121.246 -0.909 . . . . 0.0 110.027 179.738 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 32.4 t -167.71 83.14 0.2 Allowed 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.223 -0.923 . . . . 0.0 111.277 -179.828 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.486 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 46.6 t80 -92.72 159.61 15.35 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.175 -0.953 . . . . 0.0 109.981 179.601 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 20.7 m170 -136.97 -61.31 0.67 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.434 -0.791 . . . . 0.0 109.136 179.245 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -135.63 151.65 50.46 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.48 -0.762 . . . . 0.0 109.227 178.988 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 29.8 p -92.85 154.05 18.47 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.107 -0.996 . . . . 0.0 110.877 -179.761 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 26.8 m -72.05 -25.63 24.02 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.533 0 O-C-N 121.422 -0.799 . . . . 0.0 111.481 -179.487 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -51.32 -55.14 19.98 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 120.811 -1.18 . . . . 0.0 109.94 -179.958 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.426 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 28.4 p -131.39 -170.15 2.32 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.235 -0.915 . . . . 0.0 110.583 179.571 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -97.7 58.44 1.09 Allowed Glycine 0 N--CA 1.492 2.425 0 N-CA-C 107.937 -2.065 . . . . 0.0 107.937 178.421 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 13.0 t -97.71 146.21 25.58 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.369 -1.077 . . . . 0.0 109.797 -179.157 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 14.9 mmt85 -98.16 50.29 1.01 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.287 -0.883 . . . . 0.0 109.503 179.123 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.95 98.0 0.03 OUTLIER Glycine 0 N--CA 1.486 2.008 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 -179.877 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.0 p -110.48 129.35 55.8 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.298 -1.119 . . . . 0.0 110.336 179.699 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . 0.409 ' CB ' ' HB3' ' A' ' 125' ' ' PRO . . . -143.08 145.75 33.16 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.05 -1.031 . . . . 0.0 110.046 -179.789 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.499 1.99 0 O-C-N 121.159 -0.963 . . . . 0.0 110.62 -179.752 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.435 ' HB3' ' CE3' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.511 2.579 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 . . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -83.12 83.08 1.99 Allowed 'Trans proline' 0 C--N 1.318 -1.057 0 O-C-N 123.186 1.098 . . . . 0.0 112.434 -178.131 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 48.81 92.07 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.322 -0.862 . . . . 0.0 111.676 178.473 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.06 -39.58 0.46 Allowed Glycine 0 N--CA 1.5 2.95 0 C-N-CA 119.658 -1.258 . . . . 0.0 110.579 179.554 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -58.03 -31.47 67.02 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.073 -1.251 . . . . 0.0 110.509 179.812 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -52.69 -33.81 49.21 Favored 'General case' 0 N--CA 1.512 2.671 0 O-C-N 120.968 -1.083 . . . . 0.0 110.218 179.247 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 42.8 mmtt -58.4 -38.2 76.87 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.147 -0.971 . . . . 0.0 110.111 179.525 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 3.8 pt -116.65 36.94 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.213 -0.929 . . . . 0.0 110.499 179.727 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 1.4 tmtt? -84.1 -42.64 0.76 Allowed Pre-proline 0 N--CA 1.508 2.447 0 O-C-N 121.173 -0.954 . . . . 0.0 113.523 -178.941 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.6 Cg_endo -74.58 -36.88 2.63 Favored 'Trans proline' 0 N--CA 1.486 1.054 0 O-C-N 122.518 0.746 . . . . 0.0 111.967 -177.971 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.449 ' CG2' ' CE2' ' A' ' 62' ' ' TYR . 70.4 m -62.22 -48.0 81.91 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 120.96 -1.088 . . . . 0.0 109.786 -179.97 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.2 mt -60.09 -35.42 75.16 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.252 -0.905 . . . . 0.0 109.825 179.196 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 25.2 m -55.76 -36.91 67.84 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.026 -1.046 . . . . 0.0 110.11 179.324 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -57.47 -38.42 74.48 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.184 -0.948 . . . . 0.0 109.946 179.554 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.422 ' CE2' ' HG3' ' A' ' 59' ' ' ARG . 20.5 m-85 -59.34 -40.66 87.08 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.15 -0.969 . . . . 0.0 109.887 179.616 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -58.63 -25.27 62.52 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.299 -0.875 . . . . 0.0 111.321 -179.874 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 2.6 mp -79.0 -34.61 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.442 0 O-C-N 120.889 -1.132 . . . . 0.0 109.833 179.705 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -81.85 -36.72 27.95 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.007 -1.058 . . . . 0.0 109.109 178.554 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.9 -31.98 63.37 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.163 -0.96 . . . . 0.0 110.109 178.81 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.1 ptm180 -69.57 -36.49 76.34 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 120.799 -1.188 . . . . 0.0 109.753 179.354 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.49 -42.19 99.33 Favored 'General case' 0 N--CA 1.508 2.435 0 C-N-CA 119.043 -1.063 . . . . 0.0 109.123 179.316 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.413 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -69.7 -42.4 74.14 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.373 -0.931 . . . . 0.0 108.839 178.775 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 34.3 mm-40 -58.98 -35.02 72.51 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.308 -0.87 . . . . 0.0 110.138 179.436 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -90.04 -39.45 12.93 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 120.976 -1.077 . . . . 0.0 110.133 179.653 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.6 t70 . . . . . 0 N--CA 1.51 2.544 0 O-C-N 121.2 -0.937 . . . . 0.0 110.308 179.639 . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 28.3 t . . . . . 0 N--CA 1.502 2.168 0 CA-C-O 120.396 0.141 . . . . 0.0 110.733 . . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.403 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 15.1 m-80 -57.51 -40.62 79.09 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.073 -1.017 . . . . 0.0 109.954 179.918 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -61.23 -40.0 92.37 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.229 -0.92 . . . . 0.0 109.878 179.667 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 25.4 tp60 -68.13 -38.96 82.78 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.123 -0.986 . . . . 0.0 109.858 179.574 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 63.4 mt -70.19 -33.51 71.81 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.193 -0.942 . . . . 0.0 110.599 179.91 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.425 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.1 m0 -57.43 -40.89 79.37 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 120.865 -1.147 . . . . 0.0 109.85 179.824 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -63.18 -33.83 76.33 Favored 'General case' 0 N--CA 1.504 2.24 0 C-N-CA 119.177 -1.009 . . . . 0.0 109.481 178.413 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.413 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 76.1 mt -71.28 -56.04 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.217 0 O-C-N 121.059 -1.025 . . . . 0.0 109.218 179.323 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.3 ptm -63.21 -30.19 71.39 Favored 'General case' 0 N--CA 1.506 2.374 0 C-N-CA 118.547 -1.261 . . . . 0.0 109.883 178.816 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -66.6 -38.97 88.12 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 120.817 -1.177 . . . . 0.0 108.907 178.227 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.417 HD23 ' CE2' ' A' ' 26' ' ' PHE . 11.5 mt -53.63 -33.13 54.01 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 121.105 -0.997 . . . . 0.0 110.117 178.93 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.449 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 69.6 t60 -54.73 -37.9 66.46 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.048 -1.032 . . . . 0.0 109.973 179.668 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.434 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.0 m170 -60.89 -49.38 77.68 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.2 -0.938 . . . . 0.0 109.257 179.437 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.57 -36.21 77.93 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.386 -0.925 . . . . 0.0 109.374 178.74 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.422 ' HG3' ' CE2' ' A' ' 26' ' ' PHE . 0.5 OUTLIER -62.6 -49.76 73.96 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.139 -0.976 . . . . 0.0 109.299 179.229 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 92.3 p -64.65 -39.97 94.63 Favored 'General case' 0 N--CA 1.503 2.199 0 C-N-CA 119.222 -0.991 . . . . 0.0 108.982 179.175 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.428 ' O ' ' OG1' ' A' ' 65' ' ' THR . 2.1 ttp85 -63.18 -40.25 96.97 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.135 -0.978 . . . . 0.0 109.091 178.927 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.449 ' CE2' ' CG2' ' A' ' 22' ' ' THR . 43.6 t80 -64.15 -53.76 44.35 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.202 -0.937 . . . . 0.0 109.187 179.293 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.45 HG22 HD13 ' A' ' 63' ' ' ILE . 78.6 mt -66.28 -34.71 72.0 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 C-N-CA 119.163 -1.015 . . . . 0.0 109.36 179.292 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.436 ' CE2' ' CD2' ' A' ' 68' ' ' TYR . 12.4 t80 -68.87 -42.57 76.82 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.993 -1.067 . . . . 0.0 108.797 178.789 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.428 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 85.4 m -59.45 -39.28 83.08 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.219 -0.926 . . . . 0.0 110.615 -179.608 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.401 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.6 pp -83.02 -34.42 26.29 Favored 'General case' 0 N--CA 1.503 2.224 0 C-N-CA 118.596 -1.241 . . . . 0.0 112.114 -179.08 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.406 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 36.5 t80 -86.52 -32.09 20.92 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 120.705 -1.247 . . . . 0.0 111.948 -179.395 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.436 ' CD2' ' CE2' ' A' ' 64' ' ' TYR . 9.4 m-85 -98.39 -17.9 18.58 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.764 -1.21 . . . . 0.0 112.943 -178.495 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 21.0 mtpt -118.29 -57.16 2.1 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.433 -1.417 . . . . 0.0 110.846 -179.962 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 46.4 mtp180 -68.8 -29.25 67.57 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.177 -0.952 . . . . 0.0 110.964 -179.581 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.21 42.02 22.66 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 120.881 -1.137 . . . . 0.0 109.896 -179.425 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.86 35.25 3.97 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.453 -0.779 . . . . 0.0 109.927 179.286 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.442 HG22 HD13 ' A' ' 73' ' ' ILE . 13.4 tt -152.91 162.05 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.2 -0.937 . . . . 0.0 109.775 179.933 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -108.33 149.57 28.5 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.155 -0.966 . . . . 0.0 110.204 -179.916 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.2 ttpt -46.84 -32.23 3.59 Favored 'General case' 0 N--CA 1.514 2.763 0 O-C-N 121.314 -0.866 . . . . 0.0 111.426 179.992 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -64.24 -47.82 78.18 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 120.846 -1.159 . . . . 0.0 109.319 179.349 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.39 -41.01 85.67 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.186 -0.946 . . . . 0.0 108.749 178.869 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.426 ' CE1' ' CD1' ' A' ' 82' ' ' ILE . 13.2 t80 -66.33 -41.34 89.77 Favored 'General case' 0 N--CA 1.505 2.298 0 C-N-CA 119.565 -0.854 . . . . 0.0 109.263 179.027 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -72.9 -41.78 64.24 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.136 -0.978 . . . . 0.0 108.788 178.78 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.435 ' CE3' ' HB3' ' A' ' 12' ' ' ALA . 87.8 t90 -55.8 -37.37 68.53 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.158 -0.964 . . . . 0.0 109.31 178.803 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.451 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 17.2 mt -67.81 -59.76 3.05 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.136 -0.978 . . . . 0.0 108.627 178.869 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.426 ' CD1' ' CE1' ' A' ' 78' ' ' TYR . 3.8 mt -57.18 -26.91 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 O-C-N 120.924 -1.11 . . . . 0.0 110.026 179.306 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.2 tptm -80.19 -18.74 48.77 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 120.873 -1.142 . . . . 0.0 110.946 178.549 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.418 ' O ' ' CB ' ' A' ' 85' ' ' LYS . 11.0 mm-40 -109.24 23.89 13.87 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.66 -1.275 . . . . 0.0 112.0 179.982 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.418 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 15.0 tttm 77.17 68.35 0.05 Allowed 'General case' 0 N--CA 1.515 2.775 0 O-C-N 121.212 -0.93 . . . . 0.0 112.133 179.243 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.451 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 21.6 m-85 -130.53 -62.4 0.92 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.404 -0.81 . . . . 0.0 109.186 179.196 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -128.6 173.32 10.38 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.447 -0.783 . . . . 0.0 109.602 179.596 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.449 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 13.7 t0 -120.29 108.54 14.3 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.035 -1.041 . . . . 0.0 110.453 179.965 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 20.8 mtmt -58.84 -39.17 80.46 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.195 -0.941 . . . . 0.0 110.1 179.863 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 16.5 tp -59.61 -38.58 81.66 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.108 -0.995 . . . . 0.0 110.258 -179.831 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.42 HD23 ' CD2' ' A' ' 57' ' ' HIS . 53.6 tp -68.18 -48.76 64.41 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.191 -1.004 . . . . 0.0 109.184 179.482 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.404 HD12 HG21 ' A' ' 92' ' ' ILE . 70.8 mt -59.59 -37.91 72.89 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.495 0 O-C-N 121.126 -0.984 . . . . 0.0 108.838 178.658 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.76 -38.98 87.67 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.12 -0.988 . . . . 0.0 109.059 178.442 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.42 ' HE3' ' CZ ' ' A' ' 100' ' ' TYR . 9.6 mmtm -57.17 -42.97 82.12 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.116 -0.99 . . . . 0.0 109.493 179.34 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 2.4 m0 -63.52 -33.43 75.57 Favored 'General case' 0 N--CA 1.507 2.418 0 C-N-CA 119.583 -0.847 . . . . 0.0 110.316 179.576 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.8 -33.25 25.0 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.024 -1.048 . . . . 0.0 110.655 179.611 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.8 mmmt -51.31 176.93 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.761 0 O-C-N 120.857 -1.152 . . . . 0.0 110.831 179.907 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -103.5 140.81 37.01 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.196 -0.94 . . . . 0.0 109.321 179.163 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 102.48 -26.91 22.53 Favored Glycine 0 N--CA 1.493 2.451 0 C-N-CA 119.755 -1.212 . . . . 0.0 110.106 -179.099 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.42 ' CZ ' ' HE3' ' A' ' 94' ' ' LYS . 67.6 m-85 -92.29 57.85 3.12 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 120.83 -1.394 . . . . 0.0 110.132 179.815 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -68.66 -36.87 79.13 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 120.936 -1.102 . . . . 0.0 110.009 179.637 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.31 81.75 2.0 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.064 -1.022 . . . . 0.0 110.481 -179.88 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.0 pp -116.4 140.23 49.57 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.084 -1.01 . . . . 0.0 110.1 179.703 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.434 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.1 p -107.4 -30.21 8.81 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.241 -0.912 . . . . 0.0 112.575 -179.722 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.618 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 10.9 m -146.41 -170.3 3.47 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 120.329 -1.482 . . . . 0.0 109.994 179.23 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 18.0 mt -99.61 -34.98 10.0 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.337 -0.852 . . . . 0.0 110.445 178.688 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 3.9 ttm180 -104.57 36.05 2.54 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.8 -1.188 . . . . 0.0 109.205 178.275 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.618 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.281 1.6 t -127.68 -59.55 1.2 Allowed 'General case' 0 N--CA 1.497 1.905 0 N-CA-C 105.901 -1.889 . . . . 0.0 105.901 -179.426 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 9.4 pt -67.81 -23.71 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.699 0 O-C-N 120.925 -1.109 . . . . 0.0 111.052 177.084 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 . . . . . 0 N--CA 1.492 1.661 0 O-C-N 120.836 -1.165 . . . . 0.0 110.024 -179.321 . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 1.6 m . . . . . 0 N--CA 1.496 1.868 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 . . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 27.4 t -57.97 154.59 12.2 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.134 -0.979 . . . . 0.0 109.952 179.821 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.472 HG22 HD11 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -75.15 -34.92 32.79 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.471 0 O-C-N 121.14 -0.975 . . . . 0.0 111.239 -179.269 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.494 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 12.1 p -54.42 -33.6 59.74 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.763 -1.21 . . . . 0.0 111.251 -178.485 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.5 -34.99 73.29 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 120.916 -1.115 . . . . 0.0 109.615 178.471 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 47.7 t -79.91 124.87 82.97 Favored Pre-proline 0 N--CA 1.504 2.254 0 O-C-N 121.134 -0.979 . . . . 0.0 109.884 179.786 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -65.03 176.33 3.17 Favored 'Trans proline' 0 N--CA 1.489 1.233 0 O-C-N 123.113 1.059 . . . . 0.0 110.921 179.499 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -75.04 -37.21 61.77 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.296 -0.877 . . . . 0.0 110.481 -179.837 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.27 -40.75 78.36 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 120.954 -1.091 . . . . 0.0 109.926 179.946 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 9.9 tp60 -70.27 -41.61 73.19 Favored 'General case' 0 N--CA 1.505 2.305 0 C-N-CA 119.378 -0.929 . . . . 0.0 108.998 178.956 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.2 mt -65.09 -39.3 92.97 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.301 -0.875 . . . . 0.0 109.394 179.081 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -60.1 -39.51 86.44 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.134 -0.979 . . . . 0.0 109.905 179.639 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -58.72 -37.2 75.61 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.173 -0.955 . . . . 0.0 110.289 179.755 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -59.97 -43.46 95.05 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.159 -0.963 . . . . 0.0 109.957 179.925 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.12 -38.96 84.6 Favored 'General case' 0 N--CA 1.51 2.544 0 C-N-CA 119.374 -0.93 . . . . 0.0 109.993 179.879 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 20.9 mtt-85 -67.11 -40.27 86.84 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.142 -0.974 . . . . 0.0 109.822 179.803 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 26.6 mmtp -68.95 -35.99 77.42 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.206 -0.934 . . . . 0.0 110.34 179.714 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 2.4 tppt? -85.48 -21.7 28.55 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.045 -1.034 . . . . 0.0 111.446 179.781 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 91.61 31.47 9.44 Favored Glycine 0 N--CA 1.493 2.473 0 N-CA-C 110.069 -1.213 . . . . 0.0 110.069 -179.727 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.9 t -140.64 -161.66 1.24 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.961 -1.317 . . . . 0.0 109.835 179.682 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -123.2 171.54 9.27 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.124 -0.985 . . . . 0.0 110.266 179.997 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 10.1 p -155.18 160.45 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.203 -0.936 . . . . 0.0 110.702 179.801 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 44.2 t -168.51 89.28 0.24 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.288 -0.882 . . . . 0.0 111.086 -179.937 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.494 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 50.3 t80 -95.69 159.02 15.19 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.235 -0.915 . . . . 0.0 110.13 179.867 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 8.3 m80 -136.46 -61.4 0.69 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.47 -0.769 . . . . 0.0 109.08 179.179 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . 0.405 ' OE1' ' CZ3' ' A' ' 50' ' ' TRP . 11.5 pt20 -135.74 151.28 49.98 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 178.918 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . 0.417 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.3 p -90.13 153.09 20.79 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.155 -1.018 . . . . 0.0 111.008 -179.67 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.8 m -71.14 -26.73 27.71 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 C-N-CA 119.715 -0.794 . . . . 0.0 111.496 -179.436 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -51.69 -60.66 2.91 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 120.835 -1.166 . . . . 0.0 110.288 -179.856 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.425 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 24.3 p -125.29 -170.9 2.25 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.214 -0.929 . . . . 0.0 110.849 179.862 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -95.78 59.41 1.5 Allowed Glycine 0 N--CA 1.493 2.451 0 N-CA-C 108.297 -1.921 . . . . 0.0 108.297 178.752 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 19.3 t -100.91 140.38 35.29 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.372 -1.075 . . . . 0.0 109.849 -179.367 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.6 53.18 1.43 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.282 -0.886 . . . . 0.0 109.563 179.287 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.95 98.52 0.03 OUTLIER Glycine 0 N--CA 1.486 2.001 0 N-CA-C 109.81 -1.316 . . . . 0.0 109.81 -179.952 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.8 p -108.75 127.59 54.13 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.303 -1.116 . . . . 0.0 110.451 179.683 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -143.23 147.8 35.42 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.129 -0.982 . . . . 0.0 109.927 -179.68 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.498 1.954 0 O-C-N 121.218 -0.926 . . . . 0.0 110.624 -179.709 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.434 ' HB3' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.505 2.282 0 N-CA-C 109.765 -0.458 . . . . 0.0 109.765 . . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -71.21 163.74 38.11 Favored 'Trans proline' 0 C--N 1.316 -1.158 0 O-C-N 123.433 1.228 . . . . 0.0 110.89 -179.669 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -48.72 -31.67 7.25 Favored 'General case' 0 N--CA 1.513 2.715 0 O-C-N 121.416 -0.802 . . . . 0.0 111.463 -179.892 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.62 -34.88 36.5 Favored Glycine 0 N--CA 1.499 2.863 0 O-C-N 120.961 -1.087 . . . . 0.0 110.552 179.828 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -55.4 -32.79 62.95 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 121.008 -1.289 . . . . 0.0 110.614 179.692 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -54.3 -37.66 65.04 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 121.039 -1.038 . . . . 0.0 110.234 179.695 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 27.9 mttt -57.59 -36.74 72.14 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.303 -0.873 . . . . 0.0 110.177 179.452 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.424 HG22 ' OH ' ' A' ' 62' ' ' TYR . 2.1 pt -116.64 35.06 1.13 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.176 -0.952 . . . . 0.0 110.449 179.509 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.431 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 1.2 tmtt? -84.79 -43.04 0.69 Allowed Pre-proline 0 N--CA 1.509 2.511 0 O-C-N 121.122 -0.986 . . . . 0.0 113.172 -179.024 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.9 Cg_endo -76.22 -37.7 1.37 Allowed 'Trans proline' 0 N--CA 1.487 1.121 0 O-C-N 122.618 0.799 . . . . 0.0 111.571 -178.337 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 88.5 m -59.6 -41.62 90.74 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.031 -1.043 . . . . 0.0 109.959 -179.726 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.0 mt -65.19 -39.57 93.04 Favored 'General case' 0 N--CA 1.506 2.338 0 C-N-CA 119.484 -0.887 . . . . 0.0 109.461 179.238 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.15 -35.02 69.02 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.073 -1.017 . . . . 0.0 110.235 179.335 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -56.45 -35.82 68.33 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 121.118 -0.988 . . . . 0.0 110.407 179.82 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.507 ' CE2' HD11 ' A' ' 55' ' ' LEU . 15.8 m-85 -57.25 -36.84 71.45 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.074 -1.016 . . . . 0.0 110.673 -179.952 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -60.31 -37.96 82.2 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.149 -0.969 . . . . 0.0 110.893 -178.93 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 2.9 mp -63.28 -40.31 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.475 0 C-N-CA 118.992 -1.083 . . . . 0.0 108.961 179.783 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -70.08 -55.98 8.08 Favored 'General case' 0 N--CA 1.505 2.316 0 C-N-CA 119.115 -1.034 . . . . 0.0 108.468 178.63 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -56.67 -31.28 64.27 Favored 'General case' 0 N--CA 1.509 2.508 0 C-N-CA 119.242 -0.983 . . . . 0.0 109.738 178.382 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -57.75 -38.78 75.98 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 120.942 -1.099 . . . . 0.0 110.19 179.891 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -64.32 -50.29 68.4 Favored 'General case' 0 N--CA 1.506 2.351 0 C-N-CA 119.097 -1.041 . . . . 0.0 109.728 -179.902 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.426 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -70.61 -37.59 73.88 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.371 -0.932 . . . . 0.0 109.517 179.183 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 7.2 mm100 -71.55 -30.82 66.31 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 121.164 -0.96 . . . . 0.0 110.206 179.339 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.7 mtpp -91.79 -35.21 14.24 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.905 -1.122 . . . . 0.0 110.552 179.771 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 . . . . . 0 N--CA 1.506 2.361 0 O-C-N 121.109 -0.994 . . . . 0.0 109.356 179.377 . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 38.6 t . . . . . 0 N--CA 1.496 1.838 0 CA-C-O 120.599 0.238 . . . . 0.0 110.496 . . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 -55.87 -39.23 71.23 Favored 'General case' 0 N--CA 1.512 2.642 0 O-C-N 121.208 -0.932 . . . . 0.0 109.91 179.846 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -59.55 -36.79 76.86 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.269 -0.894 . . . . 0.0 110.028 179.524 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -62.08 -47.47 84.49 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.076 -1.015 . . . . 0.0 109.718 179.89 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -58.52 -38.04 76.89 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.187 -0.945 . . . . 0.0 110.127 179.908 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 48.1 m0 -59.23 -34.04 71.73 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.122 -0.986 . . . . 0.0 110.049 179.464 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.76 -31.09 71.98 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.077 -1.015 . . . . 0.0 109.947 178.646 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.426 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 5.7 mt -71.41 -58.89 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.263 0 O-C-N 120.921 -1.112 . . . . 0.0 109.324 179.547 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.52 -25.95 60.62 Favored 'General case' 0 N--CA 1.513 2.717 0 C-N-CA 118.312 -1.355 . . . . 0.0 110.076 178.829 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.6 mm100 -64.07 -40.07 95.46 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 120.742 -1.224 . . . . 0.0 109.405 178.522 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.507 HD11 ' CE2' ' A' ' 26' ' ' PHE . 0.3 OUTLIER -55.0 -33.93 62.99 Favored 'General case' 0 N--CA 1.513 2.702 0 O-C-N 120.942 -1.099 . . . . 0.0 109.873 179.074 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.452 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 16.3 t60 -55.54 -39.78 71.02 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 120.972 -1.08 . . . . 0.0 110.291 -179.672 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 57' ' ' HIS . . . . . 0.446 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.2 m170 -64.85 -50.96 64.59 Favored 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 119.208 -0.997 . . . . 0.0 109.61 179.45 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 54.1 tp60 -57.11 -34.87 68.78 Favored 'General case' 0 N--CA 1.507 2.423 0 C-N-CA 119.436 -0.905 . . . . 0.0 109.962 179.286 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.433 ' HD3' ' CG ' ' A' ' 26' ' ' PHE . 19.2 mmm-85 -65.16 -50.32 66.43 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.027 -1.046 . . . . 0.0 109.567 179.333 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 53.8 p -60.76 -39.91 90.52 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.375 -0.93 . . . . 0.0 109.695 179.769 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.423 ' O ' ' OG1' ' A' ' 65' ' ' THR . 6.2 tpt180 -63.97 -41.19 97.63 Favored 'General case' 0 N--CA 1.505 2.314 0 C-N-CA 119.174 -1.01 . . . . 0.0 109.186 179.204 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.424 ' OH ' HG22 ' A' ' 19' ' ' ILE . 36.7 t80 -63.23 -49.95 72.16 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.177 -0.952 . . . . 0.0 109.682 179.499 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.421 HG23 HD12 ' A' ' 63' ' ' ILE . 74.0 mt -71.61 -36.03 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 O-C-N 121.209 -0.932 . . . . 0.0 109.654 179.585 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.416 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 10.5 t80 -69.28 -41.64 76.57 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 120.974 -1.079 . . . . 0.0 108.871 178.848 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.423 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 87.8 m -61.19 -40.85 95.47 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.046 -1.034 . . . . 0.0 109.876 179.683 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.416 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.8 pp -83.23 -35.89 25.03 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 120.962 -1.086 . . . . 0.0 112.374 -179.241 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.426 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 63.9 t80 -86.58 -35.14 19.64 Favored 'General case' 0 N--CA 1.513 2.71 0 O-C-N 120.585 -1.322 . . . . 0.0 111.839 -179.499 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.416 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 7.6 m-85 -98.26 -3.58 37.03 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 120.837 -1.164 . . . . 0.0 113.17 -178.574 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.76 -58.86 0.61 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.354 -1.466 . . . . 0.0 110.819 179.555 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -63.11 -29.12 70.55 Favored 'General case' 0 N--CA 1.51 2.561 0 O-C-N 121.063 -1.023 . . . . 0.0 110.609 179.956 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt 57.83 43.34 21.85 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 120.855 -1.153 . . . . 0.0 110.163 -179.512 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -115.02 36.86 3.69 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.499 -0.751 . . . . 0.0 109.737 179.213 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.462 HG23 HD12 ' A' ' 73' ' ' ILE . 13.8 tt -156.43 162.39 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.21 -0.931 . . . . 0.0 110.174 -179.83 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 31.8 m -109.93 147.54 33.24 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.163 -0.961 . . . . 0.0 109.971 179.595 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.2 tttm -45.29 -32.61 2.05 Favored 'General case' 0 N--CA 1.516 2.829 0 O-C-N 121.406 -0.809 . . . . 0.0 111.675 -179.866 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -61.72 -50.35 72.79 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 120.95 -1.093 . . . . 0.0 109.324 179.496 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 25.4 tp -67.27 -43.7 81.16 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 119.15 -1.02 . . . . 0.0 108.582 178.831 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.426 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 16.1 t80 -60.66 -37.97 83.3 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.312 -0.868 . . . . 0.0 109.435 178.913 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -74.88 -41.38 59.9 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.099 -1.0 . . . . 0.0 108.968 178.786 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.434 ' CH2' ' HB3' ' A' ' 12' ' ' ALA . 82.6 t90 -59.21 -38.45 79.94 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.111 -0.993 . . . . 0.0 109.212 178.816 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.449 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 15.1 mt -65.95 -55.8 14.99 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.249 -0.907 . . . . 0.0 109.278 179.116 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -56.22 -27.11 23.24 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.429 0 O-C-N 121.16 -0.962 . . . . 0.0 110.852 -179.633 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.18 -18.71 26.57 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.95 -1.094 . . . . 0.0 111.674 179.598 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.428 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 10.4 mm-40 -103.75 25.19 10.11 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 120.601 -1.312 . . . . 0.0 111.809 179.97 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 7.8 mmpt? 75.25 69.97 0.08 Allowed 'General case' 0 N--CA 1.513 2.72 0 O-C-N 121.319 -0.863 . . . . 0.0 111.989 179.362 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.449 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 27.7 m-85 -131.9 -64.0 0.8 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.41 -0.806 . . . . 0.0 109.192 178.997 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -129.71 -178.68 4.8 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.339 -0.85 . . . . 0.0 109.734 179.44 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.452 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 6.4 t70 -131.12 124.24 30.31 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.093 -1.004 . . . . 0.0 110.615 -179.835 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -74.35 -36.75 63.62 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.264 -0.897 . . . . 0.0 109.899 179.349 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 16.0 tp -60.1 -43.35 95.62 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.022 -1.049 . . . . 0.0 109.763 179.867 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 67.8 tp -67.56 -48.54 66.63 Favored 'General case' 0 N--CA 1.506 2.364 0 C-N-CA 119.16 -1.016 . . . . 0.0 108.511 179.014 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.463 HG23 HD11 ' A' ' 92' ' ' ILE . 63.9 mt -58.52 -40.0 77.26 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.473 0 O-C-N 121.112 -0.993 . . . . 0.0 108.628 178.464 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.91 -39.23 91.3 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.18 -0.95 . . . . 0.0 109.459 178.803 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 5.8 mmtt -59.0 -45.4 90.77 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.051 -1.031 . . . . 0.0 109.423 179.523 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 8.2 m0 -64.53 -41.93 96.07 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.45 -0.9 . . . . 0.0 109.718 179.639 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 3.0 mtp85 -65.27 -31.73 73.03 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.319 -0.863 . . . . 0.0 110.595 179.58 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 3.1 mmtp -54.26 -177.17 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.668 0 O-C-N 121.018 -1.051 . . . . 0.0 110.524 179.934 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.71 133.3 52.32 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.181 -0.949 . . . . 0.0 109.838 179.405 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.23 4.16 55.3 Favored Glycine 0 N--CA 1.493 2.458 0 C-N-CA 120.149 -1.024 . . . . 0.0 111.184 -179.488 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -110.29 46.86 1.0 Allowed 'General case' 0 N--CA 1.497 1.924 0 CA-C-N 119.658 1.729 . . . . 0.0 110.048 179.696 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -60.85 -39.74 90.25 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.171 -0.956 . . . . 0.0 109.829 179.835 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -116.01 101.89 9.16 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.3 -0.875 . . . . 0.0 109.899 179.906 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.2 tp -137.98 139.82 39.89 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.247 -0.908 . . . . 0.0 109.452 -179.372 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.446 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 29.4 p -112.36 -37.76 4.89 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.148 -0.97 . . . . 0.0 112.765 -179.521 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 105' ' ' CYS . . . . . 0.573 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 6.4 m -142.57 -169.43 2.98 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 120.209 -1.557 . . . . 0.0 110.361 179.292 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 18.0 mt -96.69 -38.76 9.79 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.103 -0.998 . . . . 0.0 110.28 179.124 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 8.1 ttm180 -101.03 29.2 4.76 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 120.944 -1.098 . . . . 0.0 109.883 178.012 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.573 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.299 1.8 t -126.64 14.35 7.55 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.052 -1.03 . . . . 0.0 109.344 -179.429 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.417 ' CG2' ' O ' ' A' ' 108' ' ' CYS . 1.0 OUTLIER -160.07 37.88 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.386 0 O-C-N 120.826 -1.171 . . . . 0.0 110.648 -178.963 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 . . . . . 0 N--CA 1.499 1.993 0 O-C-N 120.678 -1.264 . . . . 0.0 111.552 -178.562 . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 1.7 m . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 120.779 0.323 . . . . 0.0 110.255 . . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 48.1 t -97.7 155.52 16.97 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.319 -0.863 . . . . 0.0 109.068 178.996 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.448 HG22 ' CE1' ' A' ' 142' ' ' PHE . 14.6 tt -77.49 -29.43 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.296 0 O-C-N 120.995 -1.066 . . . . 0.0 112.022 -179.257 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.478 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.3 p -54.76 -35.78 64.15 Favored 'General case' 0 N--CA 1.512 2.643 0 O-C-N 120.517 -1.365 . . . . 0.0 110.2 -179.278 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.86 -29.39 64.97 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.984 -1.072 . . . . 0.0 109.514 177.476 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 51.2 t -73.16 118.37 68.0 Favored Pre-proline 0 N--CA 1.507 2.403 0 O-C-N 121.1 -1.0 . . . . 0.0 110.221 179.764 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . 0.408 ' HB3' ' CB ' ' A' ' 154' ' ' ALA . 37.7 Cg_endo -64.91 168.44 13.66 Favored 'Trans proline' 0 N--CA 1.489 1.221 0 O-C-N 123.088 1.046 . . . . 0.0 110.678 178.736 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 -74.98 -38.9 61.53 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.199 -0.938 . . . . 0.0 110.335 179.983 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.66 -40.62 83.99 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.079 -1.013 . . . . 0.0 110.078 -179.779 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -66.08 -41.65 90.43 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.167 -0.958 . . . . 0.0 109.514 179.604 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 58.0 mt -64.15 -40.2 95.64 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.191 -0.943 . . . . 0.0 109.633 179.502 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -60.34 -39.15 86.09 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.211 -0.93 . . . . 0.0 110.126 179.955 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.75 -39.01 93.24 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.059 -1.025 . . . . 0.0 110.184 179.924 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -65.46 -40.42 93.16 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.176 -0.952 . . . . 0.0 109.881 179.879 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -66.54 -41.08 89.24 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.149 -0.969 . . . . 0.0 109.647 179.704 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.26 -33.44 73.55 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.134 -0.979 . . . . 0.0 110.185 179.493 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 22.2 mttt -79.26 -29.22 42.52 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.893 -1.129 . . . . 0.0 111.147 179.975 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 36.9 mttt -97.53 21.96 9.55 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 120.825 -1.172 . . . . 0.0 111.855 -179.941 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.18 46.42 56.72 Favored Glycine 0 N--CA 1.499 2.898 0 O-C-N 120.666 -1.271 . . . . 0.0 110.8 179.317 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 7.9 t -149.39 -164.68 2.08 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.203 -1.174 . . . . 0.0 110.404 179.987 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -134.34 162.77 31.29 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.106 -0.996 . . . . 0.0 110.346 -179.902 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.9 p -151.16 161.43 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.257 -0.902 . . . . 0.0 110.453 -179.85 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 46.5 t -170.38 110.3 0.38 Allowed 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.179 -0.951 . . . . 0.0 111.202 179.789 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 142' ' ' PHE . . . . . 0.478 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 86.0 t80 -105.78 158.78 16.49 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.224 -0.922 . . . . 0.0 110.601 179.741 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 21.9 t-160 -138.42 -60.07 0.62 Allowed 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.673 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -148.05 149.01 31.32 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.42 -0.8 . . . . 0.0 109.175 178.646 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . 0.437 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 25.0 p -93.46 156.1 16.96 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.007 -1.058 . . . . 0.0 111.105 -179.247 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.9 p -73.31 -25.85 21.83 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.447 0 O-C-N 121.43 -0.794 . . . . 0.0 111.679 -179.235 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -49.06 -52.5 25.18 Favored 'General case' 0 N--CA 1.516 2.853 0 O-C-N 120.816 -1.177 . . . . 0.0 110.412 -179.724 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 28.2 p -135.39 -165.02 1.62 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.227 -0.921 . . . . 0.0 110.404 179.72 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.34 61.78 0.65 Allowed Glycine 0 N--CA 1.492 2.376 0 N-CA-C 107.867 -2.093 . . . . 0.0 107.867 178.309 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.8 t -103.26 137.38 41.48 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.368 -1.077 . . . . 0.0 109.847 -179.007 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 19.1 mtp85 -96.03 52.8 1.32 Allowed 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.206 -0.934 . . . . 0.0 109.612 179.305 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.52 97.59 0.05 OUTLIER Glycine 0 N--CA 1.488 2.164 0 N-CA-C 109.947 -1.261 . . . . 0.0 109.947 179.924 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.6 p -107.9 126.0 52.15 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.246 -1.149 . . . . 0.0 110.049 179.463 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 154' ' ' ALA . . . . . 0.408 ' CB ' ' HB3' ' A' ' 125' ' ' PRO . . . -139.45 137.52 35.66 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.047 -1.033 . . . . 0.0 109.924 -179.374 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.497 1.916 0 O-C-N 121.124 -0.985 . . . . 0.0 110.485 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.328 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 137.9 -49.24 0.85 Allowed Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 53.1 p -120.09 151.86 53.55 Favored Pre-proline 0 N--CA 1.494 1.746 0 O-C-N 121.152 -1.205 . . . . 0.0 110.208 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.73 168.36 24.73 Favored 'Trans proline' 0 C--N 1.316 -1.132 0 O-C-N 123.384 1.202 . . . . 0.0 110.401 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.81 83.38 1.85 Allowed 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.181 -0.949 . . . . 0.0 110.247 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 5.9 tp -152.9 121.88 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.239 -0.913 . . . . 0.0 110.598 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.2 mttm -145.99 91.62 2.1 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.172 -0.955 . . . . 0.0 110.391 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.0 p -129.13 162.8 26.92 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.221 -0.925 . . . . 0.0 110.236 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.4 mtp85 -119.77 121.98 40.36 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.195 -0.94 . . . . 0.0 110.228 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -133.99 152.94 52.05 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.241 -0.912 . . . . 0.0 110.3 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.4 ' OG ' ' N ' ' A' ' 10' ' ' LYS . 54.6 p -116.88 -56.6 2.25 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.19 -0.943 . . . . 0.0 110.318 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.4 ' N ' ' OG ' ' A' ' 9' ' ' SER . 66.7 mttt -116.05 151.0 46.09 Favored Pre-proline 0 N--CA 1.495 1.787 0 O-C-N 121.257 -0.902 . . . . 0.0 110.339 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.34 158.72 48.04 Favored 'Trans proline' 0 C--N 1.317 -1.103 0 O-C-N 123.407 1.214 . . . . 0.0 110.678 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.432 ' HB1' ' CH2' ' A' ' 80' ' ' TRP . . . -100.68 147.52 33.74 Favored Pre-proline 0 N--CA 1.501 2.095 0 O-C-N 121.411 -0.806 . . . . 0.0 109.814 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -70.58 161.73 45.01 Favored 'Trans proline' 0 C--N 1.317 -1.108 0 O-C-N 123.382 1.201 . . . . 0.0 110.81 -179.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -48.95 -31.69 7.82 Favored 'General case' 0 N--CA 1.514 2.758 0 O-C-N 121.42 -0.8 . . . . 0.0 111.384 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.71 -33.81 35.2 Favored Glycine 0 N--CA 1.499 2.855 0 O-C-N 120.925 -1.109 . . . . 0.0 110.671 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -55.42 -33.51 63.6 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 120.929 -1.336 . . . . 0.0 110.623 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -54.13 -36.8 63.67 Favored 'General case' 0 N--CA 1.512 2.654 0 O-C-N 121.01 -1.056 . . . . 0.0 110.331 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.4 mtpp -58.13 -36.22 72.63 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.248 -0.908 . . . . 0.0 110.261 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.9 pt -116.33 35.8 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 O-C-N 121.192 -0.942 . . . . 0.0 110.602 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.425 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 3.9 tmtt? -83.59 -43.16 0.81 Allowed Pre-proline 0 N--CA 1.508 2.451 0 O-C-N 121.04 -1.038 . . . . 0.0 113.12 -179.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.425 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.6 Cg_endo -76.24 -35.69 2.2 Favored 'Trans proline' 0 N--CA 1.486 1.061 0 O-C-N 122.582 0.78 . . . . 0.0 111.725 -178.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.42 HG23 ' CE2' ' A' ' 62' ' ' TYR . 85.3 m -59.6 -43.8 93.59 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 120.921 -1.112 . . . . 0.0 109.973 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.2 mt -64.78 -39.88 94.33 Favored 'General case' 0 N--CA 1.506 2.349 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.472 179.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.8 m -58.23 -35.22 71.37 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.119 -0.988 . . . . 0.0 110.168 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -56.57 -35.88 68.69 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.037 -1.039 . . . . 0.0 110.383 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.427 ' CD2' ' HD3' ' A' ' 59' ' ' ARG . 11.7 m-85 -57.16 -38.27 73.32 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.085 -1.009 . . . . 0.0 110.578 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 55.2 mm-40 -58.64 -39.61 81.06 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.23 -0.919 . . . . 0.0 110.49 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.2 mp -65.75 -41.26 89.94 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.385 0 C-N-CA 119.187 -1.005 . . . . 0.0 108.77 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -69.18 -50.33 48.57 Favored 'General case' 0 N--CA 1.506 2.336 0 C-N-CA 119.244 -0.982 . . . . 0.0 108.534 178.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.1 tp -59.73 -35.29 74.25 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.254 -0.904 . . . . 0.0 109.453 178.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.63 -37.32 73.12 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.035 -1.041 . . . . 0.0 110.352 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -62.92 -51.61 66.28 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.201 -1.0 . . . . 0.0 109.588 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.408 ' HB2' ' CG1' ' A' ' 52' ' ' ILE . . . -69.76 -41.2 75.49 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 119.029 -1.069 . . . . 0.0 108.726 178.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -62.5 -34.85 77.69 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.242 -0.911 . . . . 0.0 109.868 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.8 mmtm -70.44 -38.68 74.56 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 120.984 -1.072 . . . . 0.0 110.183 179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.04 -38.96 77.23 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.16 -0.962 . . . . 0.0 110.107 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.28 -36.31 68.46 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.122 -0.986 . . . . 0.0 110.643 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 54.7 p -95.18 -38.27 10.66 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.063 -1.023 . . . . 0.0 110.495 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 82.7 p -113.13 143.02 45.07 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.106 -0.996 . . . . 0.0 110.227 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.2 mtpt 52.89 95.17 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.045 -1.035 . . . . 0.0 110.795 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -142.45 64.42 1.38 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.165 -0.959 . . . . 0.0 110.312 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -114.95 -56.0 2.42 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.141 -0.974 . . . . 0.0 110.224 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -115.55 159.54 21.13 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.193 -0.942 . . . . 0.0 110.175 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 29.6 mttt 52.87 74.79 0.27 Allowed 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.036 -1.04 . . . . 0.0 110.703 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -113.05 -54.48 2.62 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.171 -0.956 . . . . 0.0 110.423 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.413 ' HB3' ' CZ2' ' A' ' 50' ' ' TRP . 5.3 m-20 -56.65 -39.66 74.08 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.194 -0.941 . . . . 0.0 109.989 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -60.1 -38.08 81.88 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.26 -0.9 . . . . 0.0 109.922 179.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.408 ' HG2' ' CB ' ' A' ' 33' ' ' ALA . 0.3 OUTLIER -60.02 -45.87 91.36 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.086 -1.008 . . . . 0.0 109.656 179.727 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 30.3 mt -65.39 -36.72 84.84 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.391 -0.924 . . . . 0.0 110.146 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.444 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.0 m0 -59.1 -38.57 79.85 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.058 -1.026 . . . . 0.0 109.635 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -63.01 -31.95 73.2 Favored 'General case' 0 N--CA 1.503 2.221 0 C-N-CA 119.097 -1.041 . . . . 0.0 109.464 178.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.408 ' CG1' ' HB2' ' A' ' 33' ' ' ALA . 11.3 mt -71.61 -58.55 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.184 0 O-C-N 121.0 -1.062 . . . . 0.0 109.111 179.205 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.7 ptm -59.87 -28.33 67.44 Favored 'General case' 0 N--CA 1.509 2.484 0 C-N-CA 118.601 -1.239 . . . . 0.0 109.988 178.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -69.24 -37.93 78.21 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.826 -1.171 . . . . 0.0 109.153 178.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.419 HD22 ' CD1' ' A' ' 26' ' ' PHE . 11.0 mt -53.66 -33.28 54.71 Favored 'General case' 0 N--CA 1.512 2.654 0 O-C-N 120.956 -1.09 . . . . 0.0 110.098 179.059 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.437 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 13.7 t60 -54.87 -36.27 64.93 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.082 -1.011 . . . . 0.0 110.137 179.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.435 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 8.0 m170 -59.64 -49.33 78.17 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.029 -1.045 . . . . 0.0 109.381 179.303 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -58.48 -34.46 70.91 Favored 'General case' 0 N--CA 1.507 2.421 0 C-N-CA 119.526 -0.87 . . . . 0.0 109.729 179.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.427 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -64.18 -50.58 67.58 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.068 -1.02 . . . . 0.0 109.545 179.363 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 87.9 p -63.49 -39.67 95.06 Favored 'General case' 0 N--CA 1.504 2.237 0 C-N-CA 119.25 -0.98 . . . . 0.0 109.296 179.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.425 ' O ' ' OG1' ' A' ' 65' ' ' THR . 18.9 ttt85 -63.99 -39.24 93.67 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 119.255 -0.978 . . . . 0.0 109.264 178.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.42 ' CE2' HG23 ' A' ' 22' ' ' THR . 40.4 t80 -63.49 -52.28 61.96 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.175 -0.953 . . . . 0.0 109.416 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.449 HG21 HD12 ' A' ' 63' ' ' ILE . 77.5 mt -70.2 -36.71 68.88 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 C-N-CA 119.163 -1.015 . . . . 0.0 109.34 179.44 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -66.83 -43.08 84.66 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.057 -1.027 . . . . 0.0 108.907 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.425 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 90.0 m -61.35 -40.46 94.36 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.132 -0.98 . . . . 0.0 110.475 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.7 pp -83.05 -33.32 26.47 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 120.921 -1.112 . . . . 0.0 112.353 -178.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.419 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 46.9 t80 -86.35 -32.16 21.13 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 120.64 -1.288 . . . . 0.0 111.807 -179.413 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -98.26 -19.32 17.9 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.817 -1.177 . . . . 0.0 112.645 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 9.1 mtpt -120.35 -59.28 1.79 Allowed 'General case' 0 N--CA 1.502 2.135 0 O-C-N 120.488 -1.382 . . . . 0.0 110.704 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.0 ttt85 -62.67 -30.83 71.68 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.164 -0.96 . . . . 0.0 110.837 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 56.86 42.16 26.89 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 120.77 -1.207 . . . . 0.0 109.994 -179.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.66 35.4 3.87 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.38 -0.825 . . . . 0.0 109.991 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.433 HD11 HG23 ' A' ' 73' ' ' ILE . 14.3 tt -153.73 162.6 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.199 -0.938 . . . . 0.0 109.909 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -108.73 146.76 33.02 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.102 -0.999 . . . . 0.0 110.298 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -46.04 -32.11 2.66 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.341 -0.849 . . . . 0.0 111.586 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 38.4 m-20 -61.65 -49.95 74.47 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 120.895 -1.128 . . . . 0.0 109.352 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 28.9 tp -67.9 -44.28 77.31 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.16 -1.016 . . . . 0.0 108.408 178.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.419 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 18.3 t80 -60.03 -37.88 81.05 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.326 -0.859 . . . . 0.0 109.393 179.037 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -74.14 -42.66 59.61 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.154 -0.966 . . . . 0.0 108.695 178.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.432 ' CH2' ' HB1' ' A' ' 12' ' ' ALA . 77.7 t90 -57.43 -36.37 71.27 Favored 'General case' 0 N--CA 1.51 2.557 0 O-C-N 121.278 -0.889 . . . . 0.0 109.716 178.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.458 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 12.1 mt -69.92 -48.7 57.51 Favored 'General case' 0 N--CA 1.505 2.308 0 O-C-N 121.163 -0.961 . . . . 0.0 108.858 179.079 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 33.8 mm -56.9 -32.27 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.629 0 O-C-N 121.259 -0.901 . . . . 0.0 110.11 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.8 tmtt? -89.23 -17.9 28.13 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 120.958 -1.089 . . . . 0.0 112.074 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.428 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 21.3 mm-40 -103.68 21.71 15.69 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 120.645 -1.284 . . . . 0.0 112.087 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.7 tttp 74.6 75.07 0.11 Allowed 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.108 -0.995 . . . . 0.0 111.729 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.458 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 33.6 m-85 -135.94 -63.42 0.65 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.458 -0.776 . . . . 0.0 109.334 179.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -123.05 -171.23 2.25 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.401 -0.812 . . . . 0.0 109.276 179.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.437 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 5.5 t0 -131.09 120.25 23.13 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.086 -1.009 . . . . 0.0 110.522 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 10.8 mmtp -77.34 -39.84 46.23 Favored 'General case' 0 N--CA 1.505 2.306 0 C-N-CA 119.528 -0.869 . . . . 0.0 109.649 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 33.0 tp -60.64 -39.96 90.23 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.196 -0.94 . . . . 0.0 109.74 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.5 tp -69.85 -49.92 47.73 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.101 -0.999 . . . . 0.0 108.788 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.468 HG22 HD12 ' A' ' 92' ' ' ILE . 58.1 mt -58.87 -32.35 47.0 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.392 0 C-N-CA 119.361 -0.936 . . . . 0.0 108.993 178.25 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.04 -44.03 70.06 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 120.962 -1.087 . . . . 0.0 109.358 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.418 ' CD ' ' CD2' ' A' ' 106' ' ' LEU . 5.1 mttp -58.21 -39.14 78.24 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.099 -1.001 . . . . 0.0 110.106 179.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.0 m0 -69.09 -39.77 78.81 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.109 -0.995 . . . . 0.0 109.767 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.84 -33.95 75.75 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.245 -0.91 . . . . 0.0 110.349 179.494 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 10.3 mmtm -54.17 -177.18 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.679 0 O-C-N 121.081 -1.012 . . . . 0.0 110.526 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.96 131.75 53.69 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.217 -0.927 . . . . 0.0 109.614 179.246 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 101.44 1.91 53.58 Favored Glycine 0 N--CA 1.492 2.398 0 C-N-CA 120.066 -1.064 . . . . 0.0 111.192 -179.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 41.2 m-85 -105.64 64.03 0.69 Allowed 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 119.595 1.698 . . . . 0.0 109.903 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -88.82 -36.57 15.97 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.102 -0.998 . . . . 0.0 110.121 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -108.23 71.24 0.79 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.153 -0.967 . . . . 0.0 109.786 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 7.2 tp -117.84 133.08 56.28 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.223 -0.923 . . . . 0.0 109.627 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.435 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.3 p -109.72 -37.44 5.66 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.242 -0.911 . . . . 0.0 112.361 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.59 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 6.6 m -141.04 -169.06 2.75 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.217 -1.552 . . . . 0.0 110.1 178.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.418 ' CD2' ' CD ' ' A' ' 94' ' ' LYS . 27.9 mt -97.34 -38.07 9.79 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.186 -0.946 . . . . 0.0 110.282 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 8.7 ttt-85 -101.15 30.06 4.34 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 120.966 -1.084 . . . . 0.0 109.734 177.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.59 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.3 1.7 t -126.56 15.07 7.63 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.07 -1.019 . . . . 0.0 108.995 -179.375 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.1 pt -159.07 37.26 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.404 0 O-C-N 120.788 -1.195 . . . . 0.0 110.759 -179.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -125.44 137.28 53.98 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 120.643 -1.286 . . . . 0.0 111.767 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.437 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 17.6 ptpt -131.54 155.87 46.72 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.284 -0.885 . . . . 0.0 110.124 179.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 63.8 m-20 -127.88 166.34 18.46 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.182 -0.949 . . . . 0.0 110.234 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 72.5 mt-10 -138.77 39.89 2.18 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.213 -0.93 . . . . 0.0 110.272 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 1.3 m -118.93 -57.07 2.06 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.198 -0.938 . . . . 0.0 110.297 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 12.7 m-20 -121.19 -58.04 1.82 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.147 -0.97 . . . . 0.0 110.255 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 47.5 p30 -132.27 179.12 6.31 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.211 -0.93 . . . . 0.0 110.268 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -120.43 119.82 4.32 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 2.8 m -116.81 76.56 1.04 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.249 -1.147 . . . . 0.0 110.07 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.437 ' OG1' ' HA ' ' A' ' 111' ' ' LYS . 1.1 m -126.23 173.62 9.14 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.208 -0.932 . . . . 0.0 110.321 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 47.9 t -105.37 155.37 19.18 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.395 -0.816 . . . . 0.0 109.385 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.457 HG21 HD12 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -71.41 -35.94 59.05 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.344 0 O-C-N 121.113 -0.992 . . . . 0.0 110.801 -179.471 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.461 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.3 p -55.59 -34.27 64.67 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 120.8 -1.187 . . . . 0.0 110.929 -179.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -35.83 78.17 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 120.957 -1.09 . . . . 0.0 109.607 178.39 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.2 t -77.63 124.98 86.54 Favored Pre-proline 0 N--CA 1.505 2.291 0 O-C-N 121.167 -0.958 . . . . 0.0 109.952 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -64.94 178.92 1.61 Allowed 'Trans proline' 0 N--CA 1.489 1.237 0 O-C-N 123.176 1.093 . . . . 0.0 110.718 179.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -75.01 -36.96 61.93 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.287 -0.883 . . . . 0.0 110.627 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.61 -41.57 81.52 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 120.985 -1.072 . . . . 0.0 109.886 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -70.1 -41.19 74.35 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.338 -0.945 . . . . 0.0 108.966 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.2 mt -64.94 -39.3 93.3 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.27 -0.894 . . . . 0.0 109.465 179.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -60.41 -40.0 89.41 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.134 -0.979 . . . . 0.0 109.806 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -59.29 -37.67 78.28 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.152 -0.968 . . . . 0.0 110.251 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -59.37 -41.69 89.91 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.178 -0.951 . . . . 0.0 110.042 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.75 -48.23 80.09 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.192 -0.943 . . . . 0.0 109.614 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 1.1 ttt-85 -60.82 -37.1 80.85 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.211 -0.931 . . . . 0.0 110.067 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 33.4 mmtm -67.96 -34.12 75.96 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.103 -0.998 . . . . 0.0 110.781 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 18.4 mtmt -102.82 23.28 12.37 Favored 'General case' 0 N--CA 1.502 2.165 0 O-C-N 120.925 -1.109 . . . . 0.0 111.718 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.53 46.5 53.11 Favored Glycine 0 N--CA 1.499 2.866 0 O-C-N 120.715 -1.24 . . . . 0.0 110.851 179.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.2 t -147.18 -167.7 2.85 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.132 -1.216 . . . . 0.0 110.433 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -123.81 174.61 7.41 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.239 -0.913 . . . . 0.0 110.317 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.6 p -157.35 159.81 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.253 -0.904 . . . . 0.0 110.855 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 29.6 t -170.24 85.95 0.12 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.243 -0.911 . . . . 0.0 110.924 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.461 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 47.1 t80 -97.85 161.5 13.71 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.197 -0.939 . . . . 0.0 110.612 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 13.3 m80 -140.63 -61.08 0.5 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.521 -0.737 . . . . 0.0 109.104 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.7 151.48 51.1 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.413 -0.805 . . . . 0.0 109.037 178.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 29.2 p -95.79 153.26 17.83 Favored 'General case' 0 N--CA 1.503 2.203 0 C-N-CA 119.163 -1.015 . . . . 0.0 111.102 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.4 m -72.08 -25.7 24.07 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 O-C-N 121.44 -0.787 . . . . 0.0 111.563 -179.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -50.08 -60.41 2.97 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 120.868 -1.145 . . . . 0.0 110.219 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.444 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 25.0 p -125.83 -165.93 1.49 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.295 -0.878 . . . . 0.0 110.574 179.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -98.59 59.09 0.93 Allowed Glycine 0 N--CA 1.492 2.373 0 N-CA-C 108.16 -1.976 . . . . 0.0 108.16 178.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.7 t -103.84 143.97 32.13 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.316 -1.108 . . . . 0.0 109.931 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 14.0 ttt-85 -98.67 49.78 0.98 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.289 -0.882 . . . . 0.0 109.545 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.25 97.57 0.05 OUTLIER Glycine 0 N--CA 1.488 2.105 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.7 p -109.51 123.79 49.99 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.293 -1.122 . . . . 0.0 110.221 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -140.02 121.56 15.18 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.108 -0.995 . . . . 0.0 109.605 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -88.75 -38.41 14.72 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.121 -0.987 . . . . 0.0 110.419 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.53 -40.62 79.21 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 121.046 -1.034 . . . . 0.0 110.317 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 . . . . . 0 N--CA 1.497 1.882 0 CA-C-O 118.005 -0.997 . . . . 0.0 110.497 179.982 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.308 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 119.76 -148.87 17.97 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -123.92 87.23 53.13 Favored Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.139 -1.212 . . . . 0.0 110.205 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.56 -40.2 2.26 Favored 'Trans proline' 0 C--N 1.318 -1.059 0 O-C-N 123.419 1.22 . . . . 0.0 110.487 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 12.7 ttt180 -127.27 -59.83 1.22 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.273 -0.892 . . . . 0.0 110.225 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.2 tp -145.26 148.69 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.334 -0.853 . . . . 0.0 110.267 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.2 ttpt -129.49 130.18 45.5 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.237 -0.915 . . . . 0.0 110.145 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.9 p -127.51 127.81 44.62 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.192 -0.942 . . . . 0.0 110.2 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -137.49 99.43 3.95 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.211 -0.931 . . . . 0.0 110.224 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 18.9 ttm-85 -144.32 -58.82 0.38 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.25 -0.906 . . . . 0.0 110.392 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.3 p -115.31 -165.17 1.0 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.269 -0.894 . . . . 0.0 110.062 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.9 mtmt -114.13 162.14 24.58 Favored Pre-proline 0 N--CA 1.496 1.851 0 O-C-N 121.168 -0.957 . . . . 0.0 110.269 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.97 158.89 49.08 Favored 'Trans proline' 0 C--N 1.316 -1.163 0 O-C-N 123.411 1.216 . . . . 0.0 110.661 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.438 ' HB3' ' CH2' ' A' ' 80' ' ' TRP . . . -90.37 146.87 35.43 Favored Pre-proline 0 N--CA 1.503 2.197 0 O-C-N 121.429 -0.794 . . . . 0.0 109.736 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -70.7 162.77 41.37 Favored 'Trans proline' 0 C--N 1.317 -1.109 0 O-C-N 123.405 1.213 . . . . 0.0 110.879 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -48.64 -31.88 7.39 Favored 'General case' 0 N--CA 1.514 2.764 0 O-C-N 121.443 -0.785 . . . . 0.0 111.375 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.03 -35.14 40.22 Favored Glycine 0 N--CA 1.5 2.931 0 O-C-N 121.046 -1.034 . . . . 0.0 110.542 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -56.03 -32.93 64.47 Favored 'General case' 0 N--CA 1.511 2.621 0 O-C-N 120.973 -1.31 . . . . 0.0 110.554 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -54.61 -38.5 66.87 Favored 'General case' 0 N--CA 1.511 2.62 0 O-C-N 120.98 -1.075 . . . . 0.0 110.123 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.0 mtmt -58.64 -37.44 75.93 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.315 -0.866 . . . . 0.0 110.087 179.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.1 pt -114.86 34.79 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.152 -0.967 . . . . 0.0 110.452 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.5 OUTLIER -83.57 -43.79 0.81 Allowed Pre-proline 0 N--CA 1.509 2.48 0 O-C-N 121.052 -1.03 . . . . 0.0 113.12 -179.177 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.2 Cg_endo -76.13 -36.96 1.67 Allowed 'Trans proline' 0 N--CA 1.486 1.079 0 O-C-N 122.712 0.849 . . . . 0.0 111.455 -178.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 62.7 m -60.39 -44.24 95.84 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.004 -1.06 . . . . 0.0 109.972 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.3 mt -65.25 -40.06 93.51 Favored 'General case' 0 N--CA 1.506 2.327 0 C-N-CA 119.411 -0.916 . . . . 0.0 109.453 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 47.9 m -57.93 -35.51 71.19 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.25 -0.906 . . . . 0.0 110.1 179.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.59 -36.92 69.94 Favored 'General case' 0 N--CA 1.511 2.606 0 O-C-N 121.05 -1.031 . . . . 0.0 110.252 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.428 ' CD2' ' HD3' ' A' ' 59' ' ' ARG . 14.9 m-85 -58.57 -39.47 80.41 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.094 -1.004 . . . . 0.0 110.457 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -59.89 -38.74 83.09 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.073 -1.017 . . . . 0.0 110.662 -179.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.2 mp -66.7 -40.27 85.7 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.412 0 C-N-CA 119.196 -1.001 . . . . 0.0 109.241 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.6 tp60 -69.58 -46.5 66.21 Favored 'General case' 0 N--CA 1.506 2.342 0 C-N-CA 119.211 -0.996 . . . . 0.0 108.821 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.21 -35.28 80.28 Favored 'General case' 0 N--CA 1.508 2.469 0 C-N-CA 119.283 -0.967 . . . . 0.0 108.923 178.359 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.31 -40.04 77.05 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 120.959 -1.088 . . . . 0.0 110.075 179.338 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -62.58 -50.24 72.08 Favored 'General case' 0 N--CA 1.507 2.392 0 C-N-CA 119.262 -0.975 . . . . 0.0 109.37 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.413 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -65.9 -41.5 91.4 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.38 -0.928 . . . . 0.0 109.088 179.002 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -63.18 -34.99 78.84 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.22 -0.925 . . . . 0.0 110.03 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.6 mtpt -84.1 -37.09 22.46 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.998 -1.064 . . . . 0.0 110.318 179.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -57.86 -38.62 76.02 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.044 -1.035 . . . . 0.0 110.032 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 13.9 tptt -55.46 -36.85 67.02 Favored 'General case' 0 N--CA 1.512 2.634 0 O-C-N 121.1 -1.0 . . . . 0.0 110.348 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.6 p -103.64 39.96 1.51 Allowed 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.171 -0.955 . . . . 0.0 110.03 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.3 t -143.36 -60.15 0.42 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.259 -0.901 . . . . 0.0 109.926 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -113.93 105.1 12.84 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.285 -0.884 . . . . 0.0 109.686 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.1 tp -113.12 50.87 0.86 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.139 -0.976 . . . . 0.0 110.405 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -115.93 -56.42 2.32 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.184 -0.948 . . . . 0.0 110.135 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -144.37 163.23 34.35 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.182 -0.949 . . . . 0.0 110.408 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm 52.8 53.35 12.27 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.132 -0.98 . . . . 0.0 111.011 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.6 p -110.31 -52.29 2.79 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.052 -1.03 . . . . 0.0 110.491 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -55.31 -37.19 67.04 Favored 'General case' 0 N--CA 1.511 2.6 0 O-C-N 121.153 -0.967 . . . . 0.0 110.172 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -59.05 -39.48 82.17 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.142 -0.974 . . . . 0.0 110.042 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 50.1 tp60 -61.6 -41.23 97.15 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.119 -0.988 . . . . 0.0 109.888 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.6 mt -59.46 -38.36 80.55 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.273 -0.892 . . . . 0.0 110.319 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.445 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.5 m0 -59.91 -36.79 77.74 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.165 -0.96 . . . . 0.0 110.174 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -60.36 -30.33 69.49 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.065 -1.022 . . . . 0.0 110.126 178.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.413 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 75.0 mt -72.33 -58.68 4.53 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.276 0 O-C-N 120.879 -1.138 . . . . 0.0 109.209 179.253 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 ptm -61.55 -29.55 70.08 Favored 'General case' 0 N--CA 1.508 2.465 0 C-N-CA 118.504 -1.278 . . . . 0.0 109.683 178.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 -68.85 -37.25 79.0 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.79 -1.194 . . . . 0.0 109.063 178.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.42 HD23 ' CD2' ' A' ' 26' ' ' PHE . 11.1 mt -53.02 -32.19 45.33 Favored 'General case' 0 N--CA 1.512 2.659 0 O-C-N 121.045 -1.035 . . . . 0.0 110.155 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.439 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 66.0 t60 -54.63 -38.06 66.4 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.062 -1.024 . . . . 0.0 110.072 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.429 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 5.5 m170 -61.35 -51.19 69.86 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.17 -0.956 . . . . 0.0 109.362 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -59.38 -33.98 71.87 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 119.474 -0.89 . . . . 0.0 109.668 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.428 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -68.18 -50.2 55.91 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.067 -1.021 . . . . 0.0 109.191 179.15 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 77.3 p -63.38 -38.44 91.16 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.093 -1.004 . . . . 0.0 109.154 178.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.428 ' O ' ' OG1' ' A' ' 65' ' ' THR . 10.4 ttm-85 -64.28 -39.86 94.79 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.165 -0.96 . . . . 0.0 109.184 178.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -62.85 -51.26 67.73 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.113 -0.992 . . . . 0.0 109.292 179.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.411 HG23 HD12 ' A' ' 63' ' ' ILE . 77.5 mt -69.65 -38.99 77.65 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 O-C-N 121.257 -0.902 . . . . 0.0 109.179 179.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -65.48 -43.25 90.83 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.195 -0.941 . . . . 0.0 109.05 179.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.428 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 88.2 m -61.04 -41.26 96.25 Favored 'General case' 0 N--CA 1.503 2.186 0 C-N-CA 119.331 -0.948 . . . . 0.0 110.546 -179.501 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.7 pp -83.22 -33.35 26.13 Favored 'General case' 0 N--CA 1.504 2.245 0 C-N-CA 118.926 -1.11 . . . . 0.0 112.52 -178.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.428 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 52.0 t80 -86.33 -32.7 20.87 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 120.738 -1.226 . . . . 0.0 111.779 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -98.26 -15.74 19.69 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.752 -1.217 . . . . 0.0 112.759 -178.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.2 mtpt -124.88 -59.38 1.43 Allowed 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.394 -1.441 . . . . 0.0 110.778 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 4.5 ttp85 -62.43 -30.59 71.33 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.153 -0.967 . . . . 0.0 110.829 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.4 tttp 57.68 42.49 23.72 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 120.816 -1.178 . . . . 0.0 110.073 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.82 36.3 3.71 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.404 -0.81 . . . . 0.0 109.82 179.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.443 HD11 HG22 ' A' ' 73' ' ' ILE . 14.2 tt -154.53 162.7 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.126 -0.984 . . . . 0.0 110.011 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 73.3 m -109.8 146.81 34.38 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.174 -0.954 . . . . 0.0 110.065 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -45.25 -32.45 1.94 Allowed 'General case' 0 N--CA 1.515 2.819 0 O-C-N 121.323 -0.861 . . . . 0.0 111.7 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -61.88 -50.63 71.45 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.956 -1.09 . . . . 0.0 109.374 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 30.6 tp -66.98 -43.75 82.21 Favored 'General case' 0 N--CA 1.505 2.296 0 C-N-CA 119.155 -1.018 . . . . 0.0 108.584 178.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.428 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 15.7 t80 -60.78 -38.38 85.07 Favored 'General case' 0 N--CA 1.506 2.344 0 C-N-CA 119.645 -0.822 . . . . 0.0 109.317 178.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.1 t0 -74.63 -41.19 60.82 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.136 -0.977 . . . . 0.0 108.892 178.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.438 ' CH2' ' HB3' ' A' ' 12' ' ' ALA . 86.6 t90 -59.13 -39.14 81.41 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.184 -0.947 . . . . 0.0 109.259 178.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.453 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 14.8 mt -65.61 -54.75 23.4 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.211 -0.93 . . . . 0.0 109.223 179.072 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -55.9 -27.63 22.94 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.423 0 O-C-N 121.123 -0.986 . . . . 0.0 110.701 -179.745 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.2 tttm -88.2 -19.46 26.86 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 120.899 -1.126 . . . . 0.0 111.628 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.427 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 77.0 mm-40 -102.77 23.74 11.65 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 120.623 -1.298 . . . . 0.0 111.843 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.41 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 15.6 tttt 76.34 69.57 0.07 Allowed 'General case' 0 N--CA 1.513 2.696 0 O-C-N 121.175 -0.953 . . . . 0.0 111.916 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.453 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 28.3 m-85 -132.04 -63.1 0.82 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.467 -0.771 . . . . 0.0 109.134 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -131.2 167.43 19.17 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.477 -0.764 . . . . 0.0 109.464 179.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.439 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 24.2 t70 -120.35 121.1 37.86 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.091 -1.006 . . . . 0.0 110.599 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 29.5 mtpt -67.75 -35.39 78.64 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 121.304 -0.873 . . . . 0.0 110.227 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 25.7 tp -58.56 -40.87 84.3 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.017 -1.052 . . . . 0.0 109.965 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.424 HD21 ' CD2' ' A' ' 57' ' ' HIS . 58.5 tp -70.58 -50.62 35.41 Favored 'General case' 0 N--CA 1.506 2.343 0 C-N-CA 119.185 -1.006 . . . . 0.0 108.652 179.145 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.435 HG22 HD11 ' A' ' 92' ' ' ILE . 63.2 mt -58.45 -34.83 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.457 0 C-N-CA 119.209 -0.996 . . . . 0.0 108.823 178.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.95 -39.51 87.29 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.049 -1.032 . . . . 0.0 109.135 178.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.413 ' HD2' ' CE1' ' A' ' 100' ' ' TYR . 4.9 mmtt -57.27 -44.66 84.17 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.098 -1.001 . . . . 0.0 109.174 179.176 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.3 m0 -63.41 -35.41 80.33 Favored 'General case' 0 N--CA 1.509 2.477 0 C-N-CA 119.562 -0.855 . . . . 0.0 110.1 179.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.01 -32.53 45.15 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.087 -1.008 . . . . 0.0 110.723 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.5 mmtt -53.69 -176.91 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.714 0 O-C-N 120.989 -1.069 . . . . 0.0 110.715 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.2 m -102.91 135.07 45.27 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.099 -1.001 . . . . 0.0 109.711 179.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.03 11.71 54.07 Favored Glycine 0 N--CA 1.494 2.524 0 C-N-CA 120.183 -1.008 . . . . 0.0 111.056 -179.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.413 ' CE1' ' HD2' ' A' ' 94' ' ' LYS . 50.4 m-85 -119.97 71.94 0.91 Allowed 'General case' 0 N--CA 1.492 1.641 0 CA-C-N 119.41 1.605 . . . . 0.0 109.823 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -97.37 -34.24 11.12 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.192 -0.942 . . . . 0.0 111.18 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.1 63.4 1.15 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.974 -1.079 . . . . 0.0 111.044 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.1 pp -111.57 152.98 26.95 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.0 -1.062 . . . . 0.0 109.67 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.429 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.8 p -113.17 -30.28 7.01 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.156 -0.965 . . . . 0.0 113.463 -179.138 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.553 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.9 m -143.47 -169.03 2.97 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 120.161 -1.587 . . . . 0.0 110.175 179.372 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 16.4 mt -95.39 -38.74 10.35 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.173 -0.954 . . . . 0.0 109.95 178.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 5.6 ttt85 -102.02 29.81 4.83 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.928 -1.108 . . . . 0.0 110.092 178.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.553 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.301 1.8 t -127.65 17.57 6.89 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.035 -1.041 . . . . 0.0 108.847 -179.564 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.3 pt -158.36 38.66 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.277 0 O-C-N 120.982 -1.074 . . . . 0.0 110.216 -178.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.43 ' O ' ' OG1' ' A' ' 119' ' ' THR . 25.6 mt-30 -98.67 103.53 15.49 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.91 -1.119 . . . . 0.0 111.02 -178.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.435 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 7.6 ttmt -106.31 -50.04 3.23 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.263 -0.898 . . . . 0.0 110.568 179.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -111.62 -170.6 1.68 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.085 -1.01 . . . . 0.0 110.243 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 53.46 51.07 16.01 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.018 -1.051 . . . . 0.0 110.748 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -142.49 169.45 17.56 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.159 -0.963 . . . . 0.0 110.19 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -116.92 -61.69 1.68 Allowed 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.277 -0.889 . . . . 0.0 110.204 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -133.53 49.94 2.25 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.217 -0.927 . . . . 0.0 110.108 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -126.98 -161.39 10.86 Favored Glycine 0 N--CA 1.493 2.469 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.3 m -146.34 -175.72 4.89 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.24 -1.153 . . . . 0.0 110.427 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.435 ' OG1' ' HA ' ' A' ' 111' ' ' LYS . 1.4 m -116.11 171.19 7.96 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.192 -0.943 . . . . 0.0 110.136 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 48.7 t -94.37 154.21 17.59 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 119.401 -0.92 . . . . 0.0 108.804 178.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.452 ' CG2' ' CE1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -74.66 -30.6 25.22 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.381 0 O-C-N 121.021 -1.05 . . . . 0.0 111.654 -178.706 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.502 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.7 p -59.46 -35.75 74.67 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 120.594 -1.316 . . . . 0.0 110.639 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.82 -31.1 64.38 Favored 'General case' 0 N--CA 1.512 2.655 0 O-C-N 120.95 -1.093 . . . . 0.0 109.998 178.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 60.7 t -82.61 124.54 77.45 Favored Pre-proline 0 N--CA 1.504 2.256 0 O-C-N 121.061 -1.024 . . . . 0.0 109.974 179.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -66.21 176.03 4.31 Favored 'Trans proline' 0 N--CA 1.489 1.242 0 O-C-N 123.172 1.09 . . . . 0.0 110.871 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.0 mmm-85 -75.15 -38.37 60.98 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.292 -0.88 . . . . 0.0 110.162 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.47 -40.01 77.63 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 121.042 -1.036 . . . . 0.0 109.994 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -68.38 -42.59 78.87 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.228 -0.92 . . . . 0.0 109.192 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 11.7 mt -65.1 -39.36 93.03 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.413 -0.915 . . . . 0.0 109.362 179.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -59.04 -37.96 78.19 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.116 -0.99 . . . . 0.0 110.061 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -58.34 -39.03 78.38 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 121.123 -0.986 . . . . 0.0 110.195 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -62.41 -46.93 86.35 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.268 -0.895 . . . . 0.0 109.724 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -59.21 -38.39 79.8 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.167 -0.958 . . . . 0.0 110.2 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 25.6 ttt85 -67.59 -38.97 84.79 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.19 -0.944 . . . . 0.0 110.107 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 16.9 mttp -72.01 -34.67 69.04 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.067 -1.02 . . . . 0.0 110.511 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -88.61 -19.67 25.96 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.044 -1.035 . . . . 0.0 111.626 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.38 33.36 9.45 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.6 t -133.07 -160.67 1.07 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.066 -1.256 . . . . 0.0 109.737 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -134.19 144.45 48.47 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.076 -1.015 . . . . 0.0 110.098 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.7 p -131.45 160.58 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.169 -0.957 . . . . 0.0 110.349 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 39.2 t -169.26 95.16 0.32 Allowed 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.219 -0.925 . . . . 0.0 110.928 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.502 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 72.9 t80 -99.25 159.88 14.68 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.273 -0.892 . . . . 0.0 110.767 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 10.1 m170 -138.43 -61.12 0.6 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -138.57 150.82 46.72 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.429 -0.794 . . . . 0.0 109.227 178.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . 0.42 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 30.6 p -93.6 154.12 18.02 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.015 -1.053 . . . . 0.0 110.941 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 19.7 m -73.55 -23.14 19.27 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.46 0 O-C-N 121.363 -0.835 . . . . 0.0 111.669 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -51.39 -62.06 1.85 Allowed 'General case' 0 N--CA 1.515 2.793 0 O-C-N 120.742 -1.224 . . . . 0.0 110.066 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.445 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 21.6 p -124.17 -163.8 1.19 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.265 -0.897 . . . . 0.0 110.385 179.543 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.33 63.86 0.61 Allowed Glycine 0 N--CA 1.491 2.333 0 N-CA-C 107.997 -2.041 . . . . 0.0 107.997 178.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 34.4 t -101.09 142.41 32.59 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.289 -1.124 . . . . 0.0 109.687 -179.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -101.09 43.44 1.06 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.233 -0.917 . . . . 0.0 109.78 179.388 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 80.62 94.81 0.41 Allowed Glycine 0 N--CA 1.486 2.009 0 N-CA-C 109.87 -1.292 . . . . 0.0 109.87 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.8 p -107.85 123.95 49.36 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.272 -1.134 . . . . 0.0 110.205 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -143.1 141.66 31.3 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.081 -1.012 . . . . 0.0 110.089 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 1.4 m -104.51 42.39 1.21 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.167 -0.958 . . . . 0.0 109.617 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 28.0 m -159.64 -55.64 0.06 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.336 -0.853 . . . . 0.0 110.744 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 118.05 -0.976 . . . . 0.0 110.247 179.934 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.375 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 133.53 -129.11 5.25 Favored Glycine 0 N--CA 1.493 2.482 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.6 m -132.57 164.04 46.36 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.295 -1.12 . . . . 0.0 110.152 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.65 164.88 34.31 Favored 'Trans proline' 0 C--N 1.317 -1.091 0 O-C-N 123.441 1.232 . . . . 0.0 110.339 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 10.9 ttt-85 -140.97 174.23 10.72 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.198 -0.939 . . . . 0.0 110.302 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 86.4 mt -116.1 89.89 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.192 -0.942 . . . . 0.0 109.988 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -134.35 -164.2 1.47 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.157 -0.964 . . . . 0.0 110.072 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -112.4 89.33 3.04 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.184 -0.948 . . . . 0.0 110.156 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.72 94.85 2.77 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.199 -0.938 . . . . 0.0 110.073 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 4.2 tpt85 -133.36 145.5 50.42 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.152 -0.967 . . . . 0.0 110.332 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 71.3 m -125.16 154.18 41.91 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.249 -0.907 . . . . 0.0 110.028 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.5 mttt -145.25 155.46 54.33 Favored Pre-proline 0 N--CA 1.494 1.772 0 O-C-N 121.154 -0.966 . . . . 0.0 110.494 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -72.76 160.79 45.45 Favored 'Trans proline' 0 C--N 1.318 -1.078 0 O-C-N 123.499 1.263 . . . . 0.0 110.617 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.425 ' HB3' ' CZ2' ' A' ' 80' ' ' TRP . . . -78.71 146.28 68.64 Favored Pre-proline 0 N--CA 1.506 2.365 0 O-C-N 121.365 -0.834 . . . . 0.0 109.789 179.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.26 162.12 42.51 Favored 'Trans proline' 0 C--N 1.317 -1.092 0 O-C-N 123.311 1.164 . . . . 0.0 110.794 -179.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -48.99 -31.77 8.02 Favored 'General case' 0 N--CA 1.514 2.758 0 O-C-N 121.474 -0.767 . . . . 0.0 111.339 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.53 -34.45 42.69 Favored Glycine 0 N--CA 1.5 2.909 0 O-C-N 120.987 -1.071 . . . . 0.0 110.431 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -54.65 -32.35 59.0 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 120.968 -1.313 . . . . 0.0 110.649 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -55.21 -38.95 69.09 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.012 -1.055 . . . . 0.0 110.194 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 29.5 mttt -58.2 -37.28 74.49 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.236 -0.915 . . . . 0.0 110.078 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.453 ' CG2' ' OH ' ' A' ' 62' ' ' TYR . 1.6 pt -114.62 34.61 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.2 -0.938 . . . . 0.0 110.323 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.442 ' NZ ' ' OG1' ' A' ' 24' ' ' THR . 0.0 OUTLIER -84.73 -43.04 0.7 Allowed Pre-proline 0 N--CA 1.51 2.534 0 O-C-N 120.974 -1.079 . . . . 0.0 113.331 -179.024 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.1 Cg_endo -75.6 -36.66 2.1 Favored 'Trans proline' 0 N--CA 1.487 1.092 0 O-C-N 122.566 0.772 . . . . 0.0 111.583 -178.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 75.2 m -60.4 -43.5 96.63 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.046 -1.034 . . . . 0.0 109.936 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.3 mt -64.05 -39.38 93.96 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.233 -0.917 . . . . 0.0 109.571 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.442 ' OG1' ' NZ ' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -58.95 -37.0 75.74 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.062 -1.024 . . . . 0.0 110.15 179.595 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -57.38 -36.41 71.22 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.167 -0.958 . . . . 0.0 110.29 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.423 ' CD2' ' HD3' ' A' ' 59' ' ' ARG . 16.9 m-85 -57.43 -38.54 74.55 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.085 -1.009 . . . . 0.0 110.47 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -62.96 -22.48 66.84 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.168 -0.958 . . . . 0.0 111.854 -179.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 2.8 mp -81.26 -33.94 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.738 -1.226 . . . . 0.0 109.954 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -81.66 -34.59 30.68 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 120.949 -1.094 . . . . 0.0 109.438 178.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.83 -32.08 59.64 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.1 -1.0 . . . . 0.0 109.942 178.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.2 ptt85 -68.55 -34.84 76.54 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 120.874 -1.141 . . . . 0.0 109.998 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -68.15 -41.1 82.08 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.01 -1.056 . . . . 0.0 109.54 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.419 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -67.21 -43.35 82.29 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.269 -0.895 . . . . 0.0 109.325 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.6 mm100 -61.99 -38.79 89.92 Favored 'General case' 0 N--CA 1.506 2.373 0 C-N-CA 119.454 -0.898 . . . . 0.0 109.815 179.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 37.2 mmtm -62.41 -36.7 83.18 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.101 -1.0 . . . . 0.0 110.422 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -58.3 -41.25 84.03 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.059 -1.026 . . . . 0.0 110.04 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.2 mmtp -58.08 -34.02 69.71 Favored 'General case' 0 N--CA 1.511 2.582 0 O-C-N 121.235 -0.916 . . . . 0.0 110.763 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 36.6 m -96.96 -30.74 12.92 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.022 -1.049 . . . . 0.0 111.472 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.97 -46.9 6.02 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 120.92 -1.112 . . . . 0.0 110.497 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 15.8 mtpt -114.21 90.17 3.27 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.097 -1.002 . . . . 0.0 110.346 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.2 tp -116.51 58.43 0.76 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.13 -0.981 . . . . 0.0 110.182 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -135.13 -62.82 0.71 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.137 -0.977 . . . . 0.0 110.149 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -116.78 149.85 39.27 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.162 -0.961 . . . . 0.0 110.101 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.4 mtmm 52.83 55.25 9.26 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 120.956 -1.09 . . . . 0.0 110.69 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 18.7 m -105.86 -52.07 2.88 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.205 -0.935 . . . . 0.0 110.147 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -57.74 -39.62 77.75 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.2 -0.937 . . . . 0.0 109.813 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -60.05 -38.55 83.11 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.15 -0.969 . . . . 0.0 109.917 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 34.2 tp60 -59.09 -42.54 90.7 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 121.068 -1.02 . . . . 0.0 109.895 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.96 -37.93 77.9 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.224 -0.923 . . . . 0.0 109.993 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.446 ' CE3' ' CA ' ' A' ' 149' ' ' GLY . 37.5 m0 -59.95 -36.16 76.48 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.198 -0.939 . . . . 0.0 109.435 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -64.74 -33.11 75.19 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 120.696 -1.252 . . . . 0.0 109.502 178.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.419 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 73.4 mt -71.24 -55.17 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.315 0 O-C-N 120.981 -1.074 . . . . 0.0 109.377 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.464 ' CE ' ' HB2' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -60.56 -32.22 71.3 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 118.687 -1.205 . . . . 0.0 109.5 179.015 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.18 -41.35 96.65 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 120.856 -1.153 . . . . 0.0 108.975 178.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.422 HD22 ' CD2' ' A' ' 26' ' ' PHE . 18.2 mt -54.27 -33.76 59.34 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.242 -0.911 . . . . 0.0 109.779 178.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.442 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 13.8 t60 -56.58 -40.62 75.53 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.105 -0.997 . . . . 0.0 109.545 179.238 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.446 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 7.5 m170 -61.13 -49.84 75.61 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.212 -0.93 . . . . 0.0 108.981 178.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -60.57 -38.46 84.66 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.289 -0.882 . . . . 0.0 109.302 179.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.423 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.71 -48.98 74.91 Favored 'General case' 0 N--CA 1.507 2.381 0 C-N-CA 119.33 -0.948 . . . . 0.0 109.015 179.187 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 76.8 p -66.71 -40.43 88.45 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.159 -0.963 . . . . 0.0 108.881 178.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.405 ' O ' ' OG1' ' A' ' 65' ' ' THR . 39.4 ttt85 -64.17 -37.16 86.46 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.115 -0.99 . . . . 0.0 109.502 178.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.453 ' OH ' ' CG2' ' A' ' 19' ' ' ILE . 40.7 t80 -60.98 -49.73 76.25 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.078 -1.014 . . . . 0.0 109.332 179.473 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.452 HG21 HD12 ' A' ' 63' ' ' ILE . 83.9 mt -75.87 -42.75 39.82 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.32 0 O-C-N 121.207 -0.933 . . . . 0.0 109.011 179.108 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.434 ' CE1' HG21 ' A' ' 92' ' ' ILE . 34.8 t80 -59.05 -26.73 64.85 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.384 -0.822 . . . . 0.0 110.352 178.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.405 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 67.1 m -87.28 -34.69 18.82 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.787 -1.195 . . . . 0.0 110.533 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.406 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -82.9 -34.17 26.71 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 120.77 -1.207 . . . . 0.0 112.151 -179.19 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.439 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 54.2 t80 -86.54 -36.65 18.82 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 120.672 -1.267 . . . . 0.0 111.873 -179.395 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -95.83 -20.58 18.71 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.901 -1.124 . . . . 0.0 112.84 -178.255 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -119.34 -58.05 1.95 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 120.574 -1.329 . . . . 0.0 111.164 -179.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.77 -30.48 71.49 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.004 -1.06 . . . . 0.0 110.655 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 58.74 44.26 17.42 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 120.852 -1.155 . . . . 0.0 110.047 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -115.91 37.61 3.59 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.416 -0.802 . . . . 0.0 109.836 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.458 HD13 HG21 ' A' ' 73' ' ' ILE . 14.2 tt -156.09 162.8 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.182 -0.949 . . . . 0.0 110.118 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.3 p -108.47 147.63 31.39 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.101 -0.999 . . . . 0.0 110.102 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.4 tttp -45.9 -32.67 2.79 Favored 'General case' 0 N--CA 1.516 2.861 0 O-C-N 121.381 -0.825 . . . . 0.0 111.574 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -61.75 -49.33 76.81 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.886 -1.134 . . . . 0.0 109.467 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 50.4 tp -67.42 -44.08 79.64 Favored 'General case' 0 N--CA 1.505 2.317 0 C-N-CA 119.212 -0.995 . . . . 0.0 108.606 178.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.439 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 21.8 t80 -60.98 -38.48 86.1 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.304 -0.872 . . . . 0.0 109.43 178.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -73.89 -42.3 60.9 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.083 -1.011 . . . . 0.0 108.942 178.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.426 ' CE2' ' HG3' ' A' ' 84' ' ' GLU . 81.6 t90 -58.3 -37.04 74.25 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.24 -0.913 . . . . 0.0 109.667 178.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.469 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 13.6 mt -68.96 -48.68 62.6 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.175 -0.953 . . . . 0.0 108.981 179.209 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.436 HG21 HD11 ' A' ' 82' ' ' ILE . 32.4 mm -57.1 -30.89 35.64 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.553 0 O-C-N 121.145 -0.972 . . . . 0.0 110.1 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -87.86 -22.24 24.55 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.896 -1.128 . . . . 0.0 111.804 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.426 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 72.9 mm-40 -100.42 21.17 13.57 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 120.696 -1.253 . . . . 0.0 111.998 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt 73.56 79.42 0.13 Allowed 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.021 -1.049 . . . . 0.0 111.472 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.469 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 31.5 m-85 -137.35 -64.92 0.55 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.554 -0.716 . . . . 0.0 109.669 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -115.47 173.08 6.71 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.425 -0.797 . . . . 0.0 109.212 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.442 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 3.5 t0 -116.95 104.13 10.97 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.072 -1.017 . . . . 0.0 110.403 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.77 -39.23 84.17 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.225 -0.922 . . . . 0.0 109.857 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 18.1 tp -60.92 -40.54 93.58 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.219 -0.925 . . . . 0.0 109.947 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.41 HD23 ' CD2' ' A' ' 57' ' ' HIS . 45.5 tp -70.65 -49.06 51.43 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.266 -0.973 . . . . 0.0 108.875 179.346 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.434 HG21 ' CE1' ' A' ' 64' ' ' TYR . 49.6 mt -62.29 -32.08 53.71 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.32 0 C-N-CA 119.287 -0.965 . . . . 0.0 108.917 178.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -71.76 -42.08 67.64 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.02 -1.05 . . . . 0.0 109.157 178.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.424 ' CD ' ' CD2' ' A' ' 106' ' ' LEU . 13.0 mttp -60.73 -40.1 91.13 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.073 -1.017 . . . . 0.0 110.07 179.346 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 3.4 m0 -66.03 -38.01 87.33 Favored 'General case' 0 N--CA 1.509 2.514 0 C-N-CA 119.188 -1.005 . . . . 0.0 109.967 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.19 -35.27 63.96 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.113 -0.992 . . . . 0.0 110.179 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 17.0 mmtt -53.31 -178.82 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.671 0 O-C-N 121.124 -0.985 . . . . 0.0 110.639 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 18.4 m -107.09 142.05 37.37 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.261 -0.899 . . . . 0.0 109.438 179.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 101.98 -25.39 28.02 Favored Glycine 0 N--CA 1.494 2.508 0 C-N-CA 119.793 -1.194 . . . . 0.0 110.32 -179.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -91.71 57.88 3.34 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 120.691 -1.476 . . . . 0.0 110.111 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -70.65 -38.3 73.82 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.07 -1.019 . . . . 0.0 109.934 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.26 87.88 2.81 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.177 -0.952 . . . . 0.0 110.153 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 15.8 tp -120.35 133.01 55.52 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.187 -0.946 . . . . 0.0 109.733 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.446 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.1 p -106.21 -36.03 7.01 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.175 -0.953 . . . . 0.0 112.165 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.608 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.1 m -140.17 -169.11 2.68 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.26 -1.525 . . . . 0.0 109.461 178.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.424 ' CD2' ' CD ' ' A' ' 94' ' ' LYS . 15.3 mt -98.45 -36.1 10.05 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.064 -1.022 . . . . 0.0 110.662 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 18.3 ttm-85 -103.57 35.25 2.66 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 120.903 -1.123 . . . . 0.0 109.06 177.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.608 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.306 1.7 t -129.12 18.91 5.97 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.273 -0.892 . . . . 0.0 109.011 -178.907 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.3 pt -158.14 38.31 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 O-C-N 120.929 -1.107 . . . . 0.0 110.288 -178.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.415 ' O ' ' OG1' ' A' ' 119' ' ' THR . 11.7 tm0? -69.58 72.45 0.35 Allowed 'General case' 0 N--CA 1.509 2.525 0 O-C-N 120.878 -1.139 . . . . 0.0 110.79 -178.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -141.05 170.14 16.29 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.056 -1.027 . . . . 0.0 110.32 179.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -173.46 -58.8 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.307 -0.871 . . . . 0.0 110.587 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -136.12 -60.13 0.73 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.303 -0.873 . . . . 0.0 110.084 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 78.5 p -108.01 -169.74 1.57 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.27 -0.894 . . . . 0.0 109.731 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 41.9 t-20 -105.49 102.02 11.51 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.066 -1.021 . . . . 0.0 110.253 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -139.79 155.33 47.34 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.232 -0.918 . . . . 0.0 110.081 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 70.28 -142.43 35.74 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 17.9 m -128.68 119.33 24.47 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.2 -1.176 . . . . 0.0 110.281 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.415 ' OG1' ' O ' ' A' ' 110' ' ' GLN . 2.8 m -114.61 169.15 9.27 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.235 -0.916 . . . . 0.0 110.139 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 48.9 t -102.4 154.98 18.56 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.241 -0.912 . . . . 0.0 109.74 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.472 HG21 HD12 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -73.39 -36.83 49.73 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.348 0 O-C-N 121.202 -0.936 . . . . 0.0 111.016 -179.422 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.472 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 6.5 p -53.35 -31.39 44.26 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 120.775 -1.203 . . . . 0.0 111.262 -178.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.73 -32.89 72.15 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 120.98 -1.075 . . . . 0.0 109.765 178.334 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 53.0 t -81.57 125.5 78.3 Favored Pre-proline 0 N--CA 1.505 2.319 0 O-C-N 121.032 -1.042 . . . . 0.0 110.075 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -67.18 175.9 5.24 Favored 'Trans proline' 0 N--CA 1.488 1.199 0 O-C-N 123.191 1.1 . . . . 0.0 110.639 179.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.11 -36.74 61.65 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.241 -0.912 . . . . 0.0 110.739 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.98 -41.65 83.41 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 120.946 -1.096 . . . . 0.0 110.024 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -68.16 -41.63 81.28 Favored 'General case' 0 N--CA 1.506 2.356 0 C-N-CA 119.317 -0.953 . . . . 0.0 109.221 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.5 mt -62.79 -39.52 94.51 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.236 -0.915 . . . . 0.0 109.669 179.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -59.24 -39.56 83.14 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.191 -0.943 . . . . 0.0 110.027 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -60.19 -39.26 85.89 Favored 'General case' 0 N--CA 1.508 2.46 0 C-N-CA 119.385 -0.926 . . . . 0.0 110.05 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -61.86 -46.09 90.92 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.231 -0.918 . . . . 0.0 109.812 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.53 -41.21 97.0 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.177 -0.952 . . . . 0.0 109.916 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 10.0 mmt-85 -65.57 -33.89 76.98 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.228 -0.92 . . . . 0.0 110.343 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 26.2 ttmt -76.82 -31.67 57.07 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.042 -1.036 . . . . 0.0 111.016 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 4.0 tppt? -99.93 23.38 9.87 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 120.945 -1.097 . . . . 0.0 111.762 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.89 46.74 49.11 Favored Glycine 0 N--CA 1.5 2.913 0 O-C-N 120.732 -1.23 . . . . 0.0 110.951 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 10.1 t -146.61 -163.54 1.77 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.065 -1.256 . . . . 0.0 110.295 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -137.12 151.02 48.38 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.105 -0.997 . . . . 0.0 110.396 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.3 p -132.9 161.1 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.23 -0.919 . . . . 0.0 110.004 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 47.3 t -169.3 75.73 0.09 Allowed 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.172 -0.955 . . . . 0.0 111.211 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.472 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 36.8 t80 -91.86 161.62 14.77 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.263 -0.898 . . . . 0.0 109.975 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 3.3 m80 -139.54 -60.91 0.55 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.517 -0.739 . . . . 0.0 109.157 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.26 152.27 50.69 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 179.259 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 25.4 p -98.66 155.24 17.42 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.313 -0.867 . . . . 0.0 110.532 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.3 p -75.33 -23.31 16.92 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.572 0 O-C-N 121.271 -0.893 . . . . 0.0 112.045 -179.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -52.27 -44.54 65.02 Favored 'General case' 0 N--CA 1.516 2.867 0 O-C-N 120.667 -1.27 . . . . 0.0 109.592 179.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.464 ' HB2' ' CE ' ' A' ' 53' ' ' MET . 29.3 p -140.15 -169.41 2.74 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.34 -0.85 . . . . 0.0 110.599 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . 0.446 ' CA ' ' CE3' ' A' ' 50' ' ' TRP . . . -98.98 56.93 0.93 Allowed Glycine 0 N--CA 1.489 2.169 0 N-CA-C 107.426 -2.27 . . . . 0.0 107.426 178.268 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 24.1 t -101.19 142.51 32.52 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.466 -1.02 . . . . 0.0 109.672 -178.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 2.4 ttp85 -97.4 53.02 1.13 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.258 -0.901 . . . . 0.0 109.379 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.42 97.55 0.03 OUTLIER Glycine 0 N--CA 1.488 2.139 0 N-CA-C 109.559 -1.417 . . . . 0.0 109.559 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 p -107.57 128.69 54.75 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.319 -1.106 . . . . 0.0 110.338 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -136.79 141.58 42.92 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.157 -0.964 . . . . 0.0 110.108 -179.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -104.37 41.78 1.27 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.211 -0.931 . . . . 0.0 109.672 179.521 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -160.34 -55.65 0.06 Allowed 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.287 -0.883 . . . . 0.0 110.742 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 . . . . . 0 N--CA 1.493 1.723 0 CA-C-O 118.005 -0.997 . . . . 0.0 110.271 179.905 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.305 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -79.62 -177.53 50.41 Favored Glycine 0 N--CA 1.492 2.425 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.6 p -131.76 131.77 22.92 Favored Pre-proline 0 N--CA 1.494 1.726 0 O-C-N 121.192 -1.181 . . . . 0.0 110.097 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -74.16 78.93 2.49 Favored 'Trans proline' 0 N--CA 1.486 1.035 0 O-C-N 123.206 1.109 . . . . 0.0 110.345 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 27.2 ttm-85 -126.27 110.31 13.27 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.252 -0.905 . . . . 0.0 110.354 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.2 tp -157.02 60.86 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 O-C-N 121.196 -0.94 . . . . 0.0 110.731 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.9 tttt -148.08 162.03 40.22 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.144 -0.972 . . . . 0.0 110.428 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.9 m -145.36 47.08 1.3 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.231 -0.918 . . . . 0.0 110.42 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.27 130.61 26.88 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.156 -0.965 . . . . 0.0 110.077 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -120.38 -61.52 1.57 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.19 -0.944 . . . . 0.0 110.194 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.4 t -155.25 81.65 1.06 Allowed 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.183 -0.948 . . . . 0.0 110.737 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 12.6 mmmt -143.35 63.77 13.07 Favored Pre-proline 0 N--CA 1.495 1.805 0 O-C-N 121.224 -0.923 . . . . 0.0 110.155 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -73.09 157.54 50.62 Favored 'Trans proline' 0 C--N 1.317 -1.082 0 O-C-N 123.356 1.187 . . . . 0.0 110.656 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.439 ' HB1' ' CE3' ' A' ' 80' ' ' TRP . . . 61.89 146.46 0.08 OUTLIER Pre-proline 0 N--CA 1.503 2.198 0 O-C-N 121.395 -0.816 . . . . 0.0 110.69 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -73.75 162.71 38.93 Favored 'Trans proline' 0 C--N 1.318 -1.037 0 O-C-N 123.272 1.143 . . . . 0.0 110.52 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -48.94 -31.95 8.23 Favored 'General case' 0 N--CA 1.516 2.845 0 O-C-N 121.317 -0.864 . . . . 0.0 111.327 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.93 -34.46 51.77 Favored Glycine 0 N--CA 1.498 2.775 0 O-C-N 121.01 -1.056 . . . . 0.0 110.517 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -54.62 -31.8 57.83 Favored 'General case' 0 N--CA 1.511 2.621 0 O-C-N 120.924 -1.339 . . . . 0.0 110.821 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -54.24 -37.83 65.07 Favored 'General case' 0 N--CA 1.512 2.652 0 O-C-N 120.886 -1.134 . . . . 0.0 110.286 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 15.8 mttm -59.27 -37.62 78.07 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.254 -0.904 . . . . 0.0 110.139 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.426 HG23 ' OH ' ' A' ' 62' ' ' TYR . 1.7 pt -116.3 34.78 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 O-C-N 121.166 -0.959 . . . . 0.0 110.498 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.42 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.4 OUTLIER -85.1 -43.72 0.67 Allowed Pre-proline 0 N--CA 1.509 2.52 0 O-C-N 121.038 -1.039 . . . . 0.0 113.529 -178.911 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.42 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.1 Cg_endo -74.8 -34.14 4.32 Favored 'Trans proline' 0 N--CA 1.487 1.095 0 O-C-N 122.529 0.752 . . . . 0.0 111.96 -177.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 91.6 m -62.06 -47.78 83.16 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 120.909 -1.119 . . . . 0.0 109.792 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.7 mt -62.45 -39.53 93.68 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.27 -0.894 . . . . 0.0 109.519 179.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.7 m -57.1 -34.82 68.73 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.17 -0.956 . . . . 0.0 110.206 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -56.62 -37.13 70.27 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.094 -1.004 . . . . 0.0 110.266 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.449 ' CD1' ' CD ' ' A' ' 59' ' ' ARG . 20.2 m-85 -56.97 -37.4 71.54 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.141 -0.974 . . . . 0.0 110.254 179.576 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -56.45 -27.81 57.86 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.23 -0.919 . . . . 0.0 110.975 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 2.7 mp -77.75 -35.82 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.45 0 O-C-N 121.044 -1.035 . . . . 0.0 109.411 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -79.83 -40.03 29.41 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.006 -1.059 . . . . 0.0 108.603 178.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.415 ' CD1' ' CG2' ' A' ' 52' ' ' ILE . 7.0 tp -69.46 -34.04 73.81 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.238 -0.914 . . . . 0.0 110.364 179.066 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -71.41 -35.72 71.09 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 118.833 -1.147 . . . . 0.0 109.854 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -65.33 -39.95 93.05 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.106 -0.996 . . . . 0.0 109.645 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.406 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -72.76 -42.02 64.45 Favored 'General case' 0 N--CA 1.504 2.265 0 C-N-CA 119.167 -1.013 . . . . 0.0 109.031 179.01 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -62.92 -34.11 76.76 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.282 -0.887 . . . . 0.0 109.936 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 40.7 mmtt -84.4 -32.68 24.01 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.036 -1.04 . . . . 0.0 110.78 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -55.07 -36.66 65.84 Favored 'General case' 0 N--CA 1.511 2.616 0 O-C-N 120.985 -1.072 . . . . 0.0 110.392 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt -54.56 -38.18 66.34 Favored 'General case' 0 N--CA 1.513 2.691 0 O-C-N 121.107 -0.996 . . . . 0.0 110.399 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.5 m 53.19 -166.82 0.07 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 120.973 -1.079 . . . . 0.0 110.823 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.1 t -110.87 -53.94 2.65 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.218 -0.927 . . . . 0.0 110.171 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.2 mmmt -108.13 72.32 0.84 Allowed 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.245 -0.909 . . . . 0.0 109.746 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.3 tp -165.64 92.92 0.55 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.172 -0.955 . . . . 0.0 110.688 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -102.37 105.44 16.05 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.184 -0.948 . . . . 0.0 110.392 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -169.05 109.83 0.48 Allowed 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.183 -0.948 . . . . 0.0 110.683 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 18.8 mtpt 53.22 41.57 32.14 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.026 -1.046 . . . . 0.0 110.42 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.8 t -95.7 -35.53 11.54 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.307 -0.871 . . . . 0.0 110.865 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 50.0 m-20 -55.85 -38.99 70.83 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 120.982 -1.074 . . . . 0.0 110.122 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -62.36 -41.57 98.72 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.236 -0.915 . . . . 0.0 109.67 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 55.7 tp60 -61.98 -40.62 96.24 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.19 -0.944 . . . . 0.0 109.681 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -58.68 -39.02 79.51 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.172 -0.955 . . . . 0.0 109.979 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.429 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 52.8 m0 -58.56 -36.84 74.55 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.153 -0.967 . . . . 0.0 109.826 179.398 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -60.71 -30.19 69.81 Favored 'General case' 0 N--CA 1.506 2.325 0 O-C-N 121.08 -1.013 . . . . 0.0 109.733 178.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.415 ' CG2' ' CD1' ' A' ' 30' ' ' LEU . 22.6 mt -71.36 -60.64 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.226 0 O-C-N 120.952 -1.092 . . . . 0.0 108.845 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -60.51 -28.69 68.58 Favored 'General case' 0 N--CA 1.51 2.537 0 C-N-CA 118.547 -1.261 . . . . 0.0 109.774 178.61 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -72.24 -39.22 68.62 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 120.875 -1.14 . . . . 0.0 108.89 178.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 11.0 mt -54.04 -33.71 58.06 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 121.105 -0.997 . . . . 0.0 110.269 178.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.439 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 12.9 t60 -57.03 -35.39 69.22 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.089 -1.007 . . . . 0.0 110.438 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.444 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.3 m170 -60.56 -50.65 72.69 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 120.981 -1.074 . . . . 0.0 109.603 179.314 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -58.72 -35.83 73.29 Favored 'General case' 0 N--CA 1.508 2.449 0 C-N-CA 119.501 -0.88 . . . . 0.0 109.596 179.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.449 ' CD ' ' CD1' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -68.27 -49.61 59.37 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.079 -1.013 . . . . 0.0 109.176 179.003 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.1 p -62.12 -38.46 89.02 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.201 -0.937 . . . . 0.0 109.356 179.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.407 ' O ' ' OG1' ' A' ' 65' ' ' THR . 37.5 ttt-85 -65.12 -38.22 89.97 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.092 -1.005 . . . . 0.0 109.384 179.075 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.426 ' OH ' HG23 ' A' ' 19' ' ' ILE . 34.1 t80 -59.78 -48.87 79.95 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.211 -0.93 . . . . 0.0 109.368 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.402 ' CG2' ' CD1' ' A' ' 78' ' ' TYR . 92.0 mt -76.27 -44.25 36.42 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.266 0 C-N-CA 119.505 -0.878 . . . . 0.0 108.869 179.121 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.432 ' CE1' HG21 ' A' ' 92' ' ' ILE . 40.9 t80 -58.92 -25.7 63.67 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.323 -0.86 . . . . 0.0 110.365 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.407 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 88.4 m -87.25 -36.09 18.13 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.756 -1.215 . . . . 0.0 110.373 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.7 pp -82.92 -33.08 26.93 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 120.813 -1.179 . . . . 0.0 112.34 -179.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.404 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 33.3 t80 -86.42 -34.61 20.1 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 120.707 -1.246 . . . . 0.0 111.922 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -96.21 -22.02 17.52 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 120.903 -1.123 . . . . 0.0 112.986 -178.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.5 mtpt -112.59 -58.13 2.19 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 120.527 -1.358 . . . . 0.0 110.979 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.2 mmm-85 -71.7 -29.39 64.51 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.139 -0.975 . . . . 0.0 110.919 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 58.83 43.91 17.61 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.815 -1.178 . . . . 0.0 109.953 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.01 35.08 3.52 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.302 -0.874 . . . . 0.0 109.807 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.452 HD11 HG23 ' A' ' 73' ' ' ILE . 13.4 tt -153.1 162.7 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.23 -0.919 . . . . 0.0 109.784 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.4 p -107.44 146.76 31.31 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.089 -1.007 . . . . 0.0 110.415 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -46.34 -32.31 3.09 Favored 'General case' 0 N--CA 1.516 2.869 0 O-C-N 121.307 -0.87 . . . . 0.0 111.469 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -62.14 -49.68 74.88 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 120.894 -1.129 . . . . 0.0 109.302 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.5 tp -67.28 -43.46 81.74 Favored 'General case' 0 N--CA 1.505 2.295 0 C-N-CA 119.185 -1.006 . . . . 0.0 108.552 178.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.404 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 17.5 t80 -61.64 -38.87 89.27 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.291 -0.88 . . . . 0.0 109.432 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -72.22 -42.41 65.77 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 120.998 -1.064 . . . . 0.0 108.991 178.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.439 ' CE3' ' HB1' ' A' ' 12' ' ' ALA . 84.2 t90 -57.94 -36.89 73.16 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.214 -0.929 . . . . 0.0 109.691 179.159 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.462 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 30.7 mt -68.75 -46.06 69.82 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.129 -0.982 . . . . 0.0 109.116 179.296 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.458 HG23 HD11 ' A' ' 82' ' ' ILE . 35.2 mm -58.46 -32.84 46.47 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.532 0 O-C-N 121.26 -0.9 . . . . 0.0 110.001 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.5 mmtp -89.16 -8.79 52.98 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 120.895 -1.128 . . . . 0.0 112.278 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.435 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 75.7 mm-40 -112.17 21.55 15.71 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 120.556 -1.34 . . . . 0.0 112.04 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt 74.05 77.9 0.12 Allowed 'General case' 0 N--CA 1.51 2.543 0 O-C-N 120.97 -1.081 . . . . 0.0 111.456 179.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.462 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 33.6 m-85 -137.06 -63.0 0.62 Allowed 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.558 -0.714 . . . . 0.0 109.49 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -126.38 175.97 7.47 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.403 -0.811 . . . . 0.0 109.44 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.439 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 19.1 t0 -116.24 105.5 12.64 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.114 -0.991 . . . . 0.0 110.505 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 13.1 mmmt -61.34 -39.74 91.69 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.228 -0.92 . . . . 0.0 109.655 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 26.9 tp -60.49 -42.41 96.28 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.104 -0.997 . . . . 0.0 109.658 179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.443 HD21 ' NE2' ' A' ' 57' ' ' HIS . 43.4 tp -67.78 -49.36 62.82 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.291 -0.964 . . . . 0.0 109.119 179.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.432 HG21 ' CE1' ' A' ' 64' ' ' TYR . 34.3 mt -58.54 -29.88 39.97 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.48 0 C-N-CA 119.27 -0.972 . . . . 0.0 109.212 178.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.68 -46.2 66.62 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 120.911 -1.118 . . . . 0.0 109.328 178.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.418 ' CD ' ' CD2' ' A' ' 106' ' ' LEU . 6.4 mttp -58.16 -38.94 77.61 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.094 -1.004 . . . . 0.0 110.084 179.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.415 ' CH2' HD21 ' A' ' 91' ' ' LEU . 5.6 m0 -66.27 -39.98 89.81 Favored 'General case' 0 N--CA 1.508 2.467 0 C-N-CA 119.318 -0.953 . . . . 0.0 109.515 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.05 -33.65 70.49 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.282 -0.886 . . . . 0.0 110.358 179.468 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.6 mmtp -53.78 -177.17 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.699 0 O-C-N 121.037 -1.039 . . . . 0.0 110.651 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -106.34 133.22 51.37 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.183 -0.948 . . . . 0.0 109.797 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.95 3.1 56.0 Favored Glycine 0 N--CA 1.493 2.487 0 C-N-CA 120.06 -1.067 . . . . 0.0 111.31 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -108.62 48.48 0.86 Allowed 'General case' 0 N--CA 1.498 1.968 0 CA-C-N 119.645 1.723 . . . . 0.0 110.115 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -64.58 -39.51 93.87 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.213 -0.93 . . . . 0.0 109.911 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.78 104.26 11.78 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.153 -0.967 . . . . 0.0 109.979 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 8.9 tp -141.59 132.48 25.93 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.17 -0.956 . . . . 0.0 109.713 -179.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.444 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.4 p -108.4 -37.3 6.01 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.176 -0.953 . . . . 0.0 112.305 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.583 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.6 m -140.76 -168.93 2.69 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 120.265 -1.522 . . . . 0.0 109.924 178.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.418 ' CD2' ' CD ' ' A' ' 94' ' ' LYS . 32.7 mt -97.69 -36.74 10.15 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.035 -1.04 . . . . 0.0 110.462 179.272 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 12.1 ttm-85 -103.11 32.72 3.6 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 120.92 -1.112 . . . . 0.0 109.473 178.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.583 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.309 1.7 t -128.98 16.47 6.24 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.207 -0.933 . . . . 0.0 109.219 -179.066 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.1 pt -158.89 37.99 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 O-C-N 120.843 -1.161 . . . . 0.0 110.604 -178.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.414 ' O ' ' OG1' ' A' ' 119' ' ' THR . 0.0 OUTLIER -115.75 131.16 57.02 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 120.708 -1.245 . . . . 0.0 111.79 -178.433 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.439 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 5.8 ptpt -133.34 -175.19 3.72 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.349 -0.844 . . . . 0.0 110.119 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -147.0 167.88 22.91 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.127 -0.983 . . . . 0.0 110.442 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -117.38 125.16 50.52 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.194 -0.941 . . . . 0.0 110.155 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 1.6 m 52.81 38.91 27.86 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.997 -1.064 . . . . 0.0 110.647 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -143.49 -171.88 3.6 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.221 -0.924 . . . . 0.0 110.145 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -113.31 73.02 0.8 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.19 -0.944 . . . . 0.0 110.165 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -107.64 -169.61 21.82 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 74.0 m -144.77 132.83 21.48 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.172 -1.193 . . . . 0.0 110.362 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.439 ' OG1' ' HA ' ' A' ' 111' ' ' LYS . 2.5 m -125.04 168.55 13.2 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.251 -0.906 . . . . 0.0 110.216 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 45.6 t -92.14 154.44 18.7 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.296 -0.878 . . . . 0.0 109.038 178.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.448 ' CG2' ' CE1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -71.31 -36.33 61.17 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.42 0 O-C-N 121.101 -1.0 . . . . 0.0 110.882 -179.159 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.472 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.4 p -55.37 -34.35 64.23 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 120.828 -1.17 . . . . 0.0 110.869 -179.004 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 3.0 ttp85 -59.36 -35.55 74.1 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.006 -1.059 . . . . 0.0 109.65 178.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 55.6 t -78.91 125.03 84.67 Favored Pre-proline 0 N--CA 1.503 2.202 0 O-C-N 121.171 -0.956 . . . . 0.0 109.823 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -65.03 174.92 4.26 Favored 'Trans proline' 0 N--CA 1.487 1.133 0 O-C-N 123.143 1.075 . . . . 0.0 110.734 179.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -75.05 -36.18 61.83 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.203 -0.936 . . . . 0.0 110.719 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.53 -40.9 79.79 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.005 -1.06 . . . . 0.0 109.985 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 7.7 tp60 -69.68 -41.32 75.63 Favored 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 119.341 -0.944 . . . . 0.0 109.274 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 3.1 mt -65.5 -38.77 90.67 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.204 -0.935 . . . . 0.0 109.554 179.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -61.25 -39.91 92.09 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.181 -0.949 . . . . 0.0 109.757 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -59.03 -37.13 76.25 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.179 -0.951 . . . . 0.0 110.326 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -61.4 -44.97 96.22 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.115 -0.991 . . . . 0.0 110.057 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.8 -41.68 96.13 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.172 -0.955 . . . . 0.0 109.914 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 11.0 mtt180 -59.46 -36.9 76.85 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.143 -0.973 . . . . 0.0 110.178 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 44.6 mttm -65.93 -33.77 76.59 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.075 -1.016 . . . . 0.0 110.81 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 35.6 mtmt -105.51 22.39 15.56 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 120.931 -1.106 . . . . 0.0 111.923 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.72 46.47 54.16 Favored Glycine 0 N--CA 1.499 2.89 0 O-C-N 120.608 -1.307 . . . . 0.0 110.799 179.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.4 t -138.84 -163.5 1.48 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.197 -1.178 . . . . 0.0 110.088 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -138.6 146.62 41.99 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.098 -1.001 . . . . 0.0 110.549 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.9 p -131.0 161.46 40.98 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.185 -0.947 . . . . 0.0 109.723 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 42.1 t -166.75 83.56 0.26 Allowed 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.128 -0.982 . . . . 0.0 111.305 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.472 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 38.9 t80 -95.0 161.75 14.01 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.295 -0.878 . . . . 0.0 110.049 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -140.67 -60.61 0.51 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.571 -0.705 . . . . 0.0 109.19 179.011 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.22 151.25 50.94 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.437 -0.789 . . . . 0.0 109.293 178.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 28.0 p -97.06 154.43 17.33 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.122 -0.986 . . . . 0.0 111.065 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 19.7 m -74.06 -23.35 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.433 0 O-C-N 121.395 -0.816 . . . . 0.0 111.676 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -51.68 -52.01 51.44 Favored 'General case' 0 N--CA 1.515 2.779 0 O-C-N 120.717 -1.239 . . . . 0.0 109.967 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.429 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 26.4 p -133.58 -164.88 1.55 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.329 -0.857 . . . . 0.0 110.518 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.59 56.51 0.78 Allowed Glycine 0 N--CA 1.492 2.386 0 N-CA-C 107.925 -2.07 . . . . 0.0 107.925 178.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 18.3 t -101.39 144.07 30.65 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.33 -1.1 . . . . 0.0 109.912 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 7.6 ttm-85 -98.49 50.27 0.99 Allowed 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.3 -0.875 . . . . 0.0 109.531 179.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 69.73 98.82 0.04 OUTLIER Glycine 0 N--CA 1.488 2.106 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.0 p -111.13 128.32 55.85 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.237 -1.155 . . . . 0.0 110.229 179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -144.95 137.31 26.07 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.075 -1.016 . . . . 0.0 110.2 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -96.2 -38.58 10.07 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.208 -0.933 . . . . 0.0 110.559 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 2.7 m -55.41 -38.65 69.21 Favored 'General case' 0 N--CA 1.512 2.642 0 O-C-N 121.007 -1.058 . . . . 0.0 110.525 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 . . . . . 0 N--CA 1.494 1.768 0 CA-C-O 117.969 -1.015 . . . . 0.0 110.174 179.947 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.313 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -117.84 61.79 0.43 Allowed Glycine 0 N--CA 1.494 2.502 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.1 p -120.79 166.37 15.83 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.278 -1.131 . . . . 0.0 110.275 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.79 155.13 53.97 Favored 'Trans proline' 0 C--N 1.316 -1.133 0 O-C-N 123.434 1.229 . . . . 0.0 110.389 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.7 tpt180 -136.77 141.03 42.95 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.228 -0.92 . . . . 0.0 110.216 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 45.1 pt -136.85 144.46 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.222 -0.924 . . . . 0.0 110.3 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.7 ptpt -145.14 -176.71 5.21 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.17 -0.956 . . . . 0.0 110.35 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 66.1 p -128.96 -65.95 0.85 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.238 -0.914 . . . . 0.0 110.255 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 77.1 mtt-85 -145.99 126.82 14.42 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.284 -0.885 . . . . 0.0 110.377 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 25.6 ttp85 -144.04 95.53 2.74 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.172 -0.955 . . . . 0.0 110.261 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.1 t -140.47 93.82 2.66 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.187 -0.945 . . . . 0.0 110.195 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.6 mmtt 52.81 75.17 0.67 Allowed Pre-proline 0 N--CA 1.501 2.099 0 O-C-N 121.02 -1.05 . . . . 0.0 110.648 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -73.06 158.57 49.25 Favored 'Trans proline' 0 C--N 1.316 -1.151 0 O-C-N 123.361 1.19 . . . . 0.0 110.764 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.431 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -100.23 147.3 33.34 Favored Pre-proline 0 N--CA 1.499 1.987 0 O-C-N 121.391 -0.818 . . . . 0.0 109.748 179.54 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -69.94 162.7 41.19 Favored 'Trans proline' 0 C--N 1.317 -1.125 0 O-C-N 123.315 1.166 . . . . 0.0 110.812 -179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -48.7 -31.83 7.46 Favored 'General case' 0 N--CA 1.514 2.758 0 O-C-N 121.451 -0.78 . . . . 0.0 111.339 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.67 -34.29 43.47 Favored Glycine 0 N--CA 1.499 2.861 0 O-C-N 120.941 -1.1 . . . . 0.0 110.609 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -55.6 -33.19 63.73 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 120.965 -1.315 . . . . 0.0 110.688 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -54.03 -37.65 64.33 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 121.04 -1.037 . . . . 0.0 110.187 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -58.9 -37.45 76.64 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.288 -0.882 . . . . 0.0 110.072 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.428 HG21 ' OH ' ' A' ' 62' ' ' TYR . 2.5 pt -116.43 34.5 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 O-C-N 121.118 -0.989 . . . . 0.0 110.554 179.689 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -82.89 -44.29 0.89 Allowed Pre-proline 0 N--CA 1.51 2.544 0 O-C-N 121.011 -1.055 . . . . 0.0 112.871 -179.252 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.4 Cg_endo -76.68 -36.12 1.74 Allowed 'Trans proline' 0 N--CA 1.486 1.087 0 O-C-N 122.642 0.811 . . . . 0.0 111.407 -178.464 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.417 HG21 ' CE2' ' A' ' 62' ' ' TYR . 87.3 m -58.71 -41.77 87.1 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 120.986 -1.071 . . . . 0.0 109.964 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.412 HD21 ' CD2' ' A' ' 86' ' ' TYR . 2.3 mt -66.84 -40.97 88.14 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.263 -0.898 . . . . 0.0 109.397 179.481 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.6 m -59.42 -35.26 73.68 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.199 -0.938 . . . . 0.0 110.084 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -57.04 -36.94 71.07 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 121.036 -1.04 . . . . 0.0 110.266 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.408 ' CE2' ' HG3' ' A' ' 59' ' ' ARG . 12.5 m-85 -58.18 -37.95 75.74 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.136 -0.977 . . . . 0.0 110.497 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -60.74 -39.78 89.98 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.147 -0.971 . . . . 0.0 110.602 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.1 mp -65.83 -41.57 90.4 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 C-N-CA 119.23 -0.988 . . . . 0.0 109.039 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -67.78 -48.16 67.13 Favored 'General case' 0 N--CA 1.505 2.319 0 C-N-CA 119.224 -0.99 . . . . 0.0 108.643 178.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.93 -36.39 83.24 Favored 'General case' 0 N--CA 1.509 2.507 0 C-N-CA 119.35 -0.94 . . . . 0.0 108.936 178.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -57.31 -41.8 80.59 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.061 -1.025 . . . . 0.0 109.879 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -61.99 -45.28 94.33 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 119.393 -0.923 . . . . 0.0 109.862 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.413 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -68.72 -39.68 80.29 Favored 'General case' 0 N--CA 1.507 2.385 0 C-N-CA 119.343 -0.943 . . . . 0.0 109.652 179.479 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -68.93 -31.13 69.81 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.218 -0.926 . . . . 0.0 110.647 179.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.9 mtpt -98.02 -29.17 13.43 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.94 -1.1 . . . . 0.0 111.886 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -58.44 -36.72 74.07 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 120.757 -1.214 . . . . 0.0 110.344 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.1 ttmm -54.64 -38.98 67.52 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.007 -1.058 . . . . 0.0 110.387 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.3 t 52.62 -166.35 0.06 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.061 -1.024 . . . . 0.0 110.884 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.4 t -96.55 -38.99 9.75 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 121.173 -0.955 . . . . 0.0 110.468 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.34 82.23 1.71 Allowed 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.052 -1.03 . . . . 0.0 109.906 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 18.4 tp -155.03 88.64 1.18 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.176 -0.952 . . . . 0.0 110.484 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -103.23 35.57 2.52 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.253 -0.905 . . . . 0.0 110.651 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -127.29 120.74 29.32 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.263 -0.898 . . . . 0.0 109.901 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.5 mptt 53.15 58.04 5.68 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.008 -1.058 . . . . 0.0 110.547 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -101.98 -44.02 5.61 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.088 -1.008 . . . . 0.0 110.871 -179.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -57.85 -40.31 79.84 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.098 -1.001 . . . . 0.0 110.151 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -59.94 -39.29 85.02 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.26 -0.9 . . . . 0.0 110.052 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -62.36 -45.94 90.93 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.174 -0.954 . . . . 0.0 109.736 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 23.9 mt -59.21 -36.74 75.94 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.177 -0.952 . . . . 0.0 110.32 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 47.7 m0 -58.63 -37.74 76.56 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 121.035 -1.04 . . . . 0.0 110.038 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -61.22 -32.86 72.64 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 119.148 -1.021 . . . . 0.0 109.701 178.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.413 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 74.1 mt -71.06 -59.65 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.283 0 O-C-N 121.092 -1.005 . . . . 0.0 108.883 179.101 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -61.1 -29.4 69.73 Favored 'General case' 0 N--CA 1.511 2.591 0 C-N-CA 118.544 -1.263 . . . . 0.0 109.754 178.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -69.48 -37.15 77.14 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.79 -1.194 . . . . 0.0 109.062 178.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 10.9 mt -53.31 -33.55 53.81 Favored 'General case' 0 N--CA 1.511 2.616 0 O-C-N 120.982 -1.074 . . . . 0.0 110.179 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.444 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 71.1 t60 -54.47 -38.28 66.22 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 120.965 -1.085 . . . . 0.0 110.059 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.429 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.6 m170 -61.09 -48.08 83.35 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.193 -0.942 . . . . 0.0 109.359 179.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -59.39 -36.57 76.06 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.279 -0.888 . . . . 0.0 109.676 179.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.408 ' HG3' ' CE2' ' A' ' 26' ' ' PHE . 8.0 mtp85 -63.59 -49.58 72.79 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.125 -0.984 . . . . 0.0 109.477 179.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 93.8 p -63.83 -40.74 97.34 Favored 'General case' 0 N--CA 1.504 2.269 0 C-N-CA 119.301 -0.96 . . . . 0.0 109.118 179.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.422 ' O ' ' OG1' ' A' ' 65' ' ' THR . 3.9 ttt85 -62.14 -38.85 90.55 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.192 -0.943 . . . . 0.0 109.405 179.018 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.428 ' OH ' HG21 ' A' ' 19' ' ' ILE . 39.1 t80 -62.94 -51.7 65.88 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.081 -1.012 . . . . 0.0 109.345 179.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 92.7 mt -69.81 -37.97 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.365 0 C-N-CA 119.321 -0.952 . . . . 0.0 109.332 179.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.422 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 7.1 t80 -66.1 -42.65 89.0 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.127 -0.983 . . . . 0.0 109.018 178.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.422 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 92.9 m -60.78 -40.88 94.21 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.19 -0.944 . . . . 0.0 110.384 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.7 pp -83.14 -35.34 25.64 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.818 -1.176 . . . . 0.0 112.422 -178.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 30.6 t80 -86.48 -33.02 20.49 Favored 'General case' 0 N--CA 1.513 2.712 0 O-C-N 120.589 -1.319 . . . . 0.0 112.054 -179.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.422 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 7.0 m-85 -98.41 -6.29 30.88 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 120.802 -1.186 . . . . 0.0 113.138 -178.444 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 15.0 mtpt -129.8 -58.09 1.1 Allowed 'General case' 0 N--CA 1.502 2.17 0 O-C-N 120.366 -1.459 . . . . 0.0 110.534 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.3 mtt85 -72.01 -28.95 63.72 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.145 -0.972 . . . . 0.0 110.83 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.7 tttp 58.58 43.62 18.89 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.771 -1.205 . . . . 0.0 110.034 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -109.85 34.23 3.96 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.363 -0.836 . . . . 0.0 109.915 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.448 HD11 HG21 ' A' ' 73' ' ' ILE . 13.4 tt -151.07 162.65 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 O-C-N 121.202 -0.936 . . . . 0.0 109.657 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.8 t -107.92 144.3 35.36 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.128 -0.983 . . . . 0.0 110.34 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 50.6 tttt -45.08 -32.48 1.76 Allowed 'General case' 0 N--CA 1.515 2.785 0 O-C-N 121.328 -0.857 . . . . 0.0 111.732 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.42 -49.65 76.02 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 120.915 -1.115 . . . . 0.0 109.321 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 33.6 tp -67.09 -46.93 72.75 Favored 'General case' 0 N--CA 1.505 2.276 0 C-N-CA 119.077 -1.049 . . . . 0.0 108.45 178.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -58.15 -38.64 76.98 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.294 -0.879 . . . . 0.0 109.395 178.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -71.7 -42.97 66.73 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.035 -1.041 . . . . 0.0 108.433 178.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.443 ' CE2' ' HG3' ' A' ' 84' ' ' GLU . 73.4 t90 -56.33 -37.76 70.4 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.265 -0.897 . . . . 0.0 109.561 178.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.45 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 8.0 mt -66.56 -50.39 63.28 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.206 -0.934 . . . . 0.0 109.153 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.449 HG21 HD13 ' A' ' 82' ' ' ILE . 36.9 mm -57.91 -33.18 45.24 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.545 0 O-C-N 121.178 -0.951 . . . . 0.0 110.181 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -89.18 -6.07 57.21 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.894 -1.129 . . . . 0.0 112.416 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.443 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 17.3 mm-40 -115.01 22.61 13.24 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.395 -1.441 . . . . 0.0 112.016 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt 75.08 72.82 0.1 Allowed 'General case' 0 N--CA 1.511 2.623 0 O-C-N 121.104 -0.997 . . . . 0.0 111.679 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.45 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 31.5 m-85 -133.37 -62.35 0.79 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.432 -0.793 . . . . 0.0 109.333 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -132.24 167.26 20.13 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.467 -0.771 . . . . 0.0 109.593 179.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.444 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.5 t0 -109.77 107.24 17.16 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.155 -0.965 . . . . 0.0 110.237 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 12.4 mmtt -58.17 -38.15 76.08 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.263 -0.898 . . . . 0.0 110.035 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.6 tp -58.82 -38.43 78.62 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.213 -0.929 . . . . 0.0 110.161 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.409 HD23 ' CD2' ' A' ' 57' ' ' HIS . 57.6 tp -71.23 -45.35 63.49 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.133 -0.979 . . . . 0.0 108.835 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.439 HD13 HG21 ' A' ' 92' ' ' ILE . 24.9 mt -59.63 -37.78 72.38 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 C-N-CA 119.396 -0.921 . . . . 0.0 108.531 178.208 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.73 -38.99 87.78 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.176 -0.953 . . . . 0.0 109.112 178.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.414 ' HE3' ' CZ ' ' A' ' 100' ' ' TYR . 9.8 mmtm -57.75 -41.25 81.5 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.001 -1.062 . . . . 0.0 109.755 179.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.3 m0 -68.1 -35.36 78.03 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.259 -0.901 . . . . 0.0 110.337 179.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 10.1 mtp85 -83.36 -31.41 26.77 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.072 -1.018 . . . . 0.0 110.888 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.3 mmtt -51.63 177.15 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.739 0 O-C-N 120.865 -1.147 . . . . 0.0 110.759 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.58 140.67 37.23 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.202 -0.936 . . . . 0.0 109.48 179.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 101.07 -23.52 35.23 Favored Glycine 0 N--CA 1.493 2.474 0 C-N-CA 119.814 -1.184 . . . . 0.0 110.407 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.414 ' CZ ' ' HE3' ' A' ' 94' ' ' LYS . 63.5 m-85 -92.04 58.11 3.27 Favored 'General case' 0 N--CA 1.504 2.246 0 CA-C-N 119.098 1.449 . . . . 0.0 110.056 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -66.92 -32.83 74.35 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.138 -0.976 . . . . 0.0 110.522 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt -132.9 102.07 5.49 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.002 -1.061 . . . . 0.0 110.506 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.9 pp -140.62 155.0 46.67 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.083 -1.011 . . . . 0.0 110.551 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.429 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.5 p -118.95 -35.61 3.61 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.29 -0.881 . . . . 0.0 113.222 -179.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.612 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.4 m -142.91 -170.72 3.3 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.253 -1.529 . . . . 0.0 110.384 179.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 24.3 mt -98.35 -35.91 10.15 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.28 -0.887 . . . . 0.0 110.333 178.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 1.1 ttt-85 -103.47 35.18 2.67 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.816 -1.177 . . . . 0.0 109.538 178.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.612 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.279 1.7 t -126.85 -59.75 1.25 Allowed 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 105.65 -1.982 . . . . 0.0 105.65 -179.631 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.401 HG13 ' N ' ' A' ' 110' ' ' GLN . 15.1 pt -68.95 -26.01 31.45 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.546 0 O-C-N 120.902 -1.124 . . . . 0.0 110.854 176.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.401 ' N ' HG13 ' A' ' 109' ' ' ILE . 44.3 tt0 -126.16 155.09 42.26 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.972 -1.08 . . . . 0.0 110.138 -179.214 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 2.0 tpmt? -117.88 -56.96 2.15 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.186 -0.946 . . . . 0.0 110.163 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -149.34 -172.69 4.19 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.156 -0.965 . . . . 0.0 110.373 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -117.11 73.57 0.87 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.163 -0.961 . . . . 0.0 110.046 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.47 -164.33 1.7 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.219 -0.926 . . . . 0.0 110.026 -179.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 37.2 t-20 -95.08 -38.75 10.48 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.107 -0.996 . . . . 0.0 110.318 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -112.29 163.21 14.65 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.146 -0.971 . . . . 0.0 110.231 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 140.05 -168.5 25.05 Favored Glycine 0 N--CA 1.494 2.519 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.4 m -142.38 174.89 10.21 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.171 -1.193 . . . . 0.0 110.257 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 1.7 m -140.84 174.34 10.61 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.225 -0.922 . . . . 0.0 109.802 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 34.0 t -53.41 153.94 3.73 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 120.928 -1.108 . . . . 0.0 109.801 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.461 HG21 HD11 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -73.77 -35.26 43.01 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.444 0 O-C-N 121.08 -1.012 . . . . 0.0 111.161 -178.948 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.506 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 12.1 p -54.52 -33.53 60.16 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 120.735 -1.228 . . . . 0.0 111.208 -178.827 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -34.16 70.1 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.907 -1.121 . . . . 0.0 109.635 178.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 53.0 t -81.65 124.66 79.62 Favored Pre-proline 0 N--CA 1.505 2.282 0 O-C-N 121.123 -0.985 . . . . 0.0 109.779 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -66.25 178.82 2.28 Favored 'Trans proline' 0 N--CA 1.489 1.234 0 O-C-N 123.194 1.102 . . . . 0.0 110.637 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 6.6 tpt180 -75.04 -38.41 61.44 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.197 -0.939 . . . . 0.0 110.427 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.26 -43.32 92.45 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.074 -1.016 . . . . 0.0 109.809 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.8 tm0? -67.31 -41.17 85.81 Favored 'General case' 0 N--CA 1.505 2.296 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.239 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 74.6 mt -63.96 -39.94 95.3 Favored 'General case' 0 N--CA 1.506 2.369 0 C-N-CA 119.493 -0.883 . . . . 0.0 109.491 179.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -59.2 -38.3 79.52 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.119 -0.988 . . . . 0.0 109.966 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -57.52 -36.48 71.63 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.107 -0.995 . . . . 0.0 110.397 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -63.07 -48.94 76.47 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.205 -0.934 . . . . 0.0 109.833 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -59.08 -38.43 79.44 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.09 -1.007 . . . . 0.0 109.834 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -59.74 -38.58 82.12 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.146 -0.971 . . . . 0.0 110.207 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 58.7 mttt -87.13 -42.14 13.25 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.071 -1.018 . . . . 0.0 109.96 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 21.6 mmtt -63.03 -25.82 68.56 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.27 -0.894 . . . . 0.0 111.178 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.75 33.51 9.07 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 7.8 t -145.99 -160.84 1.2 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.084 -1.245 . . . . 0.0 109.91 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -130.89 143.85 51.03 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.079 -1.013 . . . . 0.0 109.967 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 12.3 p -124.85 160.28 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.206 -0.934 . . . . 0.0 110.722 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 43.8 t -165.5 87.97 0.41 Allowed 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.365 -0.834 . . . . 0.0 110.6 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.506 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 60.5 t80 -100.41 161.1 13.82 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.23 -0.919 . . . . 0.0 110.999 -179.19 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -139.29 -60.96 0.56 Allowed 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -134.68 150.52 50.64 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.359 -0.838 . . . . 0.0 108.952 178.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . 0.421 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.5 p -90.79 152.71 20.68 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.056 -1.027 . . . . 0.0 111.237 -179.528 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.8 m -70.9 -26.5 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 C-N-CA 119.736 -0.786 . . . . 0.0 111.298 -179.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -50.38 -58.83 4.8 Favored 'General case' 0 N--CA 1.515 2.818 0 O-C-N 120.9 -1.125 . . . . 0.0 110.221 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 22.9 p -128.3 -166.73 1.67 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.248 -0.908 . . . . 0.0 110.451 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -99.95 60.92 0.71 Allowed Glycine 0 N--CA 1.493 2.44 0 N-CA-C 108.076 -2.01 . . . . 0.0 108.076 178.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 17.4 t -98.72 145.44 26.9 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.315 -1.109 . . . . 0.0 109.902 -179.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 32.4 mtt-85 -98.62 49.93 0.98 Allowed 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.236 -0.915 . . . . 0.0 109.444 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 68.18 97.39 0.04 OUTLIER Glycine 0 N--CA 1.488 2.141 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 22.4 p -109.94 129.08 55.71 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.163 -1.198 . . . . 0.0 110.508 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -151.0 140.17 21.2 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.187 -0.946 . . . . 0.0 110.179 -179.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -116.52 -57.06 2.23 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.211 -0.931 . . . . 0.0 110.277 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 7.0 m -140.83 51.39 1.63 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.223 -0.923 . . . . 0.0 110.131 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.494 1.754 0 CA-C-O 117.961 -1.019 . . . . 0.0 110.177 -179.963 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 64.5 89.69 0.04 OUTLIER Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.486 -1.446 . . . . 0.0 109.486 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.424 ' OG ' ' HD3' ' A' ' 2' ' ' PRO . 0.0 OUTLIER -63.31 -57.84 18.56 Favored Pre-proline 0 N--CA 1.508 2.431 0 O-C-N 121.176 -1.191 . . . . 0.0 110.12 -179.997 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.424 ' HD3' ' OG ' ' A' ' 1' ' ' SER . 47.1 Cg_endo -73.43 111.07 3.2 Favored 'Trans proline' 0 C--N 1.319 -1.019 0 O-C-N 123.285 1.15 . . . . 0.0 110.414 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.9 ptt-85 -134.79 173.12 12.05 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.248 -0.907 . . . . 0.0 110.323 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.2 tt -141.68 50.9 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 O-C-N 121.186 -0.946 . . . . 0.0 110.108 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 20.5 mtmt -115.66 146.92 41.41 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.189 -0.945 . . . . 0.0 110.198 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 12.3 p -123.77 71.76 1.12 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.272 -0.893 . . . . 0.0 110.272 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -127.54 -179.09 4.74 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.08 -1.013 . . . . 0.0 110.176 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.8 ptt85 -159.69 -172.67 3.77 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.171 -0.955 . . . . 0.0 110.877 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -115.57 -165.31 1.02 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.225 -0.922 . . . . 0.0 110.159 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -115.91 138.81 24.3 Favored Pre-proline 0 N--CA 1.494 1.759 0 O-C-N 121.183 -0.948 . . . . 0.0 110.15 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -74.58 158.11 44.02 Favored 'Trans proline' 0 C--N 1.319 -0.998 0 O-C-N 123.248 1.13 . . . . 0.0 110.557 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.432 ' HB3' ' CH2' ' A' ' 80' ' ' TRP . . . 61.78 149.1 0.09 OUTLIER Pre-proline 0 N--CA 1.503 2.201 0 O-C-N 121.328 -0.857 . . . . 0.0 110.721 179.775 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -72.6 165.21 33.38 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 O-C-N 123.287 1.151 . . . . 0.0 110.612 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -48.47 -32.02 7.21 Favored 'General case' 0 N--CA 1.515 2.776 0 O-C-N 121.481 -0.762 . . . . 0.0 111.391 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.83 -34.84 51.82 Favored Glycine 0 N--CA 1.498 2.795 0 N-CA-C 110.449 -1.061 . . . . 0.0 110.449 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -54.77 -32.74 60.42 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 120.919 -1.341 . . . . 0.0 110.673 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -53.94 -37.66 64.12 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 121.015 -1.053 . . . . 0.0 110.276 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.0 mmpt? -58.31 -36.13 72.88 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.203 -0.935 . . . . 0.0 110.275 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pt -117.06 36.26 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.181 -0.95 . . . . 0.0 110.547 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.422 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.5 OUTLIER -83.22 -44.68 0.85 Allowed Pre-proline 0 N--CA 1.509 2.514 0 O-C-N 121.075 -1.016 . . . . 0.0 113.065 -179.178 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.422 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.1 Cg_endo -75.64 -35.87 2.48 Favored 'Trans proline' 0 N--CA 1.485 1.027 0 O-C-N 122.655 0.819 . . . . 0.0 111.757 -178.138 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 60.7 m -60.35 -43.64 96.31 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 120.933 -1.104 . . . . 0.0 110.014 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.416 HD21 ' CD2' ' A' ' 86' ' ' TYR . 4.2 mt -65.49 -41.03 93.73 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 119.45 -0.9 . . . . 0.0 109.419 179.488 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -57.56 -34.15 68.88 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.164 -0.96 . . . . 0.0 110.192 179.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -57.0 -37.21 71.34 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.106 -0.996 . . . . 0.0 110.316 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -58.76 -38.69 79.03 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.136 -0.977 . . . . 0.0 110.476 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -59.56 -39.7 84.92 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.164 -0.96 . . . . 0.0 110.437 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.0 mp -64.99 -40.22 88.35 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 C-N-CA 119.227 -0.989 . . . . 0.0 108.958 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -69.01 -50.41 49.1 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.122 -0.986 . . . . 0.0 108.887 178.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.94 -35.54 77.0 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.119 -0.988 . . . . 0.0 109.278 178.535 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.44 -39.36 70.2 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 121.087 -1.008 . . . . 0.0 109.911 179.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.41 -41.75 88.8 Favored 'General case' 0 N--CA 1.507 2.376 0 C-N-CA 119.206 -0.998 . . . . 0.0 109.395 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.419 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -70.84 -41.92 70.85 Favored 'General case' 0 N--CA 1.504 2.229 0 C-N-CA 119.228 -0.989 . . . . 0.0 109.073 179.068 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -60.4 -34.44 73.92 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.285 -0.885 . . . . 0.0 109.963 179.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.8 mmmt -80.08 -29.69 39.16 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.0 -1.062 . . . . 0.0 110.965 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.76 -35.9 57.11 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 120.808 -1.183 . . . . 0.0 110.266 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.7 tmtt? -52.48 -33.7 45.89 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 121.204 -0.935 . . . . 0.0 110.821 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.7 m -53.54 -179.76 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.706 0 O-C-N 121.016 -1.053 . . . . 0.0 110.632 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.9 m -109.05 163.45 13.31 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.174 -0.954 . . . . 0.0 110.297 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.7 ttmt 52.29 38.33 24.57 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.094 -1.004 . . . . 0.0 110.736 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 14.5 tp -124.72 -57.69 1.53 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.188 -0.945 . . . . 0.0 110.372 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.31 -171.12 3.76 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.091 -1.006 . . . . 0.0 110.673 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -113.16 -173.7 2.31 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.2 -0.937 . . . . 0.0 109.99 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.5 mptt 52.28 94.51 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.043 -1.036 . . . . 0.0 110.678 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.31 -51.02 3.59 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.188 -0.945 . . . . 0.0 109.82 179.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.401 ' OD1' ' CZ2' ' A' ' 50' ' ' TRP . 1.5 t-20 -62.69 -39.65 94.65 Favored 'General case' 0 N--CA 1.506 2.345 0 C-N-CA 119.446 -0.902 . . . . 0.0 109.338 179.173 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -65.75 -40.15 91.79 Favored 'General case' 0 N--CA 1.507 2.39 0 C-N-CA 119.473 -0.891 . . . . 0.0 109.566 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -63.31 -40.86 98.51 Favored 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 119.413 -0.915 . . . . 0.0 109.664 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.4 mt -59.54 -39.28 83.46 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.13 -0.981 . . . . 0.0 109.72 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.444 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.1 m0 -58.01 -36.23 72.39 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.202 -0.936 . . . . 0.0 109.842 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -62.41 -29.89 70.82 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.054 -1.028 . . . . 0.0 109.672 178.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.419 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 46.4 mt -70.55 -59.07 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 120.953 -1.092 . . . . 0.0 109.089 179.425 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.3 ptm -60.37 -29.82 69.17 Favored 'General case' 0 N--CA 1.51 2.546 0 C-N-CA 118.46 -1.296 . . . . 0.0 109.754 178.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -68.01 -37.41 81.4 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 120.885 -1.134 . . . . 0.0 109.263 178.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 11.9 mt -53.05 -32.19 45.54 Favored 'General case' 0 N--CA 1.513 2.688 0 O-C-N 120.962 -1.086 . . . . 0.0 110.304 179.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.442 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 5.0 t60 -56.1 -36.77 68.55 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.057 -1.027 . . . . 0.0 110.113 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.429 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 5.5 m170 -60.48 -49.49 77.34 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.1 -1.0 . . . . 0.0 109.508 179.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -58.24 -37.42 74.87 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.3 -0.875 . . . . 0.0 109.679 179.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.3 mtt180 -63.07 -48.77 77.23 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.172 -0.955 . . . . 0.0 109.482 179.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.7 p -60.74 -40.37 92.14 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.172 -0.955 . . . . 0.0 109.564 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.409 ' O ' ' OG1' ' A' ' 65' ' ' THR . 4.1 tpt85 -62.6 -40.99 98.68 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 119.343 -0.943 . . . . 0.0 109.319 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -62.95 -50.23 71.63 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.276 -0.89 . . . . 0.0 109.512 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 79.7 mt -70.28 -36.78 68.78 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 C-N-CA 119.3 -0.96 . . . . 0.0 109.453 179.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.424 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 9.5 t80 -67.8 -42.12 82.09 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.068 -1.02 . . . . 0.0 108.891 178.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.409 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 90.1 m -60.92 -40.83 94.68 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.175 -0.953 . . . . 0.0 110.097 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.8 pp -83.2 -36.49 24.62 Favored 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 118.99 -1.084 . . . . 0.0 112.465 -179.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.432 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 50.0 t80 -86.65 -35.12 19.54 Favored 'General case' 0 N--CA 1.513 2.693 0 O-C-N 120.63 -1.294 . . . . 0.0 111.858 -179.54 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.424 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 6.6 m-85 -98.32 -3.42 37.21 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.903 -1.123 . . . . 0.0 113.25 -178.5 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.87 -58.93 0.61 Allowed 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.374 -1.454 . . . . 0.0 110.749 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.57 -29.44 70.59 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.063 -1.023 . . . . 0.0 110.654 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.1 tttt 59.87 44.41 13.75 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.768 -1.207 . . . . 0.0 109.985 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -117.38 37.61 3.83 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.342 -0.849 . . . . 0.0 109.888 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.468 HG21 HD12 ' A' ' 73' ' ' ILE . 14.9 tt -157.35 162.69 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.227 -0.921 . . . . 0.0 110.411 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.8 p -110.31 149.0 30.82 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.119 -0.988 . . . . 0.0 110.104 179.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.3 tttt -46.34 -31.92 2.87 Favored 'General case' 0 N--CA 1.515 2.791 0 O-C-N 121.269 -0.895 . . . . 0.0 111.722 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -62.86 -51.91 65.17 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 120.964 -1.085 . . . . 0.0 109.423 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 31.4 tp -65.04 -43.02 93.72 Favored 'General case' 0 N--CA 1.507 2.38 0 C-N-CA 119.145 -1.022 . . . . 0.0 108.816 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.432 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 16.9 t80 -62.53 -40.48 96.94 Favored 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 119.53 -0.868 . . . . 0.0 109.235 179.182 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -70.25 -42.05 72.7 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.168 -0.957 . . . . 0.0 108.849 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.432 ' CH2' ' HB3' ' A' ' 12' ' ' ALA . 81.1 t90 -57.06 -35.51 69.43 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.262 -0.899 . . . . 0.0 109.876 179.062 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.464 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 12.4 mt -69.9 -48.23 59.44 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.079 -1.013 . . . . 0.0 108.971 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.9 mm -57.47 -31.66 39.45 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.609 0 O-C-N 121.312 -0.868 . . . . 0.0 110.053 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 6.9 tttp -89.28 -15.87 32.52 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.938 -1.101 . . . . 0.0 112.136 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.428 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 18.9 mm-40 -106.33 22.26 16.06 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 120.529 -1.357 . . . . 0.0 112.098 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 19.4 tptt 74.24 75.77 0.12 Allowed 'General case' 0 N--CA 1.512 2.667 0 O-C-N 121.038 -1.039 . . . . 0.0 111.742 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.464 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 33.0 m-85 -135.42 -63.04 0.69 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.558 -0.714 . . . . 0.0 109.306 179.62 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -125.48 -172.99 2.72 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.485 -0.76 . . . . 0.0 109.198 179.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.442 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 8.4 t0 -131.24 102.91 6.19 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.057 -1.027 . . . . 0.0 110.524 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -59.41 -39.18 82.62 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.195 -0.941 . . . . 0.0 109.799 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 19.7 tp -59.5 -40.26 86.49 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.127 -0.983 . . . . 0.0 109.772 179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.421 HD22 ' NE2' ' A' ' 57' ' ' HIS . 59.5 tp -71.05 -46.77 61.38 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.173 -0.954 . . . . 0.0 108.552 179.001 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.441 HG21 HD13 ' A' ' 92' ' ' ILE . 62.8 mt -60.24 -33.52 53.93 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.344 0 C-N-CA 119.406 -0.918 . . . . 0.0 109.047 178.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.67 -46.36 72.56 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.043 -1.035 . . . . 0.0 109.292 178.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.421 ' CD ' ' CD2' ' A' ' 106' ' ' LEU . 12.2 mttp -57.48 -40.81 79.39 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.092 -1.005 . . . . 0.0 110.146 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.407 ' CH2' HD22 ' A' ' 91' ' ' LEU . 3.0 m0 -60.77 -26.85 67.55 Favored 'General case' 0 N--CA 1.508 2.468 0 C-N-CA 119.188 -1.005 . . . . 0.0 110.668 179.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.56 -35.8 22.55 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 120.796 -1.19 . . . . 0.0 110.448 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -52.23 178.86 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.76 0 O-C-N 121.022 -1.049 . . . . 0.0 110.764 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -103.4 138.2 40.47 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.259 -0.9 . . . . 0.0 109.22 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 102.85 -27.49 19.98 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 109.948 -1.261 . . . . 0.0 109.948 -178.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 73.3 m-85 -92.32 58.78 3.31 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.885 -1.362 . . . . 0.0 109.808 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -85.56 -35.0 21.34 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.068 -1.02 . . . . 0.0 110.475 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.417 ' HB2' ' OG ' ' A' ' 155' ' ' SER . 0.0 OUTLIER -117.49 62.34 0.74 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.987 -1.071 . . . . 0.0 110.586 -179.827 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -107.29 152.33 24.27 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.003 -1.06 . . . . 0.0 109.847 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.429 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.8 p -113.75 -29.33 7.13 Favored 'General case' 0 N--CA 1.501 2.121 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -179.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.574 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.8 m -143.87 -168.12 2.77 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 120.109 -1.619 . . . . 0.0 110.019 179.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.421 ' CD2' ' CD ' ' A' ' 94' ' ' LYS . 16.7 mt -96.35 -38.87 9.89 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.218 -0.926 . . . . 0.0 110.128 179.02 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -102.1 30.3 4.56 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 120.999 -1.063 . . . . 0.0 109.866 178.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.574 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.7 t -127.37 17.18 7.08 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.043 -1.035 . . . . 0.0 108.833 -179.545 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.1 pt -158.99 38.91 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 O-C-N 120.957 -1.09 . . . . 0.0 110.24 -178.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.425 ' O ' ' OG1' ' A' ' 119' ' ' THR . 7.3 tt0 -103.75 101.22 11.04 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.868 -1.145 . . . . 0.0 111.201 -178.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.423 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 1.9 tttt -113.01 -179.61 3.69 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.353 -0.842 . . . . 0.0 110.022 179.368 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -144.77 164.57 30.62 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.173 -0.955 . . . . 0.0 110.324 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -115.61 39.52 2.97 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.102 -0.998 . . . . 0.0 110.246 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 62.7 m -160.13 -56.37 0.06 Allowed 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.176 -0.952 . . . . 0.0 110.735 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -116.94 -171.1 1.96 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.217 -0.927 . . . . 0.0 109.98 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -110.08 85.09 2.04 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.187 -0.946 . . . . 0.0 110.138 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -72.15 -113.75 0.05 OUTLIER Glycine 0 N--CA 1.493 2.438 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 1.8 m -146.39 103.67 3.71 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.24 -1.153 . . . . 0.0 110.454 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.425 ' OG1' ' O ' ' A' ' 110' ' ' GLN . 1.1 m -119.07 172.84 7.28 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.133 -0.98 . . . . 0.0 110.135 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 49.6 t -103.87 154.93 19.05 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.26 -0.9 . . . . 0.0 109.207 178.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.459 ' CG2' ' CE1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -75.34 -30.7 22.89 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 O-C-N 121.158 -0.964 . . . . 0.0 111.62 -179.033 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.495 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.3 p -58.58 -35.72 72.85 Favored 'General case' 0 N--CA 1.511 2.608 0 O-C-N 120.705 -1.247 . . . . 0.0 110.765 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.06 -33.24 64.81 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 120.937 -1.102 . . . . 0.0 109.964 178.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 58.3 t -81.29 124.28 80.78 Favored Pre-proline 0 N--CA 1.504 2.228 0 O-C-N 121.16 -0.963 . . . . 0.0 109.863 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -66.73 173.48 7.95 Favored 'Trans proline' 0 N--CA 1.488 1.163 0 O-C-N 123.187 1.098 . . . . 0.0 110.874 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.9 tpp85 -75.19 -37.66 61.1 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.292 -0.88 . . . . 0.0 110.421 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.89 -40.96 81.57 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.004 -1.06 . . . . 0.0 110.039 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -69.41 -41.8 75.91 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 119.312 -0.955 . . . . 0.0 109.249 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 21.1 mt -65.39 -38.6 90.49 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.215 -0.928 . . . . 0.0 109.558 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -60.99 -39.88 91.34 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.132 -0.98 . . . . 0.0 109.877 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -60.37 -39.62 87.86 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.147 -0.97 . . . . 0.0 110.082 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -60.85 -41.01 95.0 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.244 -0.91 . . . . 0.0 109.941 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.3 -41.88 94.35 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.15 -0.969 . . . . 0.0 110.06 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 20.8 ttt85 -58.97 -38.44 79.09 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.088 -1.007 . . . . 0.0 109.908 179.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -57.87 -35.99 71.73 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.12 -0.987 . . . . 0.0 110.549 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -106.55 18.5 21.84 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.022 -1.049 . . . . 0.0 111.987 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 56.2 44.61 88.94 Favored Glycine 0 N--CA 1.497 2.729 0 O-C-N 120.612 -1.305 . . . . 0.0 110.327 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.7 t -133.75 -163.31 1.34 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.188 -1.184 . . . . 0.0 109.948 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 10.2 mp0 -139.64 144.43 37.66 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.155 -0.965 . . . . 0.0 110.344 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.6 p -132.1 161.4 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.284 -0.885 . . . . 0.0 110.018 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 38.4 t -166.78 100.07 0.56 Allowed 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.231 -0.918 . . . . 0.0 111.104 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.495 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 77.1 t80 -102.58 160.08 14.88 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.336 -0.852 . . . . 0.0 110.639 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 58.7 m-70 -137.83 -61.63 0.62 Allowed 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 178.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.56 150.75 44.07 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.536 -0.727 . . . . 0.0 109.278 178.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . 0.413 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.4 p -93.56 154.82 17.66 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.016 -1.053 . . . . 0.0 110.986 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.7 p -73.62 -25.14 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.569 0 O-C-N 121.334 -0.854 . . . . 0.0 111.598 -179.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -49.44 -59.06 4.07 Favored 'General case' 0 N--CA 1.517 2.879 0 O-C-N 120.873 -1.142 . . . . 0.0 110.167 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.444 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.9 p -127.65 -164.39 1.36 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.192 -0.942 . . . . 0.0 110.369 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . 0.408 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.93 63.38 0.56 Allowed Glycine 0 N--CA 1.492 2.381 0 N-CA-C 107.936 -2.066 . . . . 0.0 107.936 178.422 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 32.8 t -101.83 142.18 33.54 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.332 -1.099 . . . . 0.0 109.797 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 9.3 ttt85 -100.0 46.32 0.96 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.262 -0.899 . . . . 0.0 109.638 179.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 76.38 96.16 0.17 Allowed Glycine 0 N--CA 1.486 2.011 0 N-CA-C 109.883 -1.287 . . . . 0.0 109.883 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.4 p -108.25 126.01 52.33 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.333 -1.098 . . . . 0.0 110.161 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -146.65 148.93 32.57 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.153 -0.967 . . . . 0.0 110.308 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' SER . . . . . 0.417 ' OG ' ' HB2' ' A' ' 102' ' ' LYS . 1.5 m -115.2 -54.14 2.57 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.291 -0.88 . . . . 0.0 110.695 -179.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 8.3 p -50.96 -37.63 45.76 Favored 'General case' 0 N--CA 1.513 2.702 0 O-C-N 121.002 -1.061 . . . . 0.0 111.017 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 . . . . . 0 N--CA 1.494 1.766 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.235 179.922 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.348 0 N-CA-C 109.614 -1.394 . . . . 0.0 109.614 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -131.27 62.78 0.64 Allowed Glycine 0 N--CA 1.493 2.46 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 3.2 m -141.34 85.44 11.84 Favored Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.191 -1.182 . . . . 0.0 110.266 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.31 -39.99 2.58 Favored 'Trans proline' 0 C--N 1.317 -1.085 0 O-C-N 123.376 1.198 . . . . 0.0 110.471 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 7.5 ttm-85 -135.75 40.31 2.76 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.2 -0.937 . . . . 0.0 110.219 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 75.8 mt -120.63 133.16 68.22 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 O-C-N 121.154 -0.966 . . . . 0.0 109.985 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -138.31 -59.86 0.62 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.257 -0.902 . . . . 0.0 110.227 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 33.1 m -134.62 161.44 35.11 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.174 -0.954 . . . . 0.0 110.234 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.28 149.03 42.47 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.198 -0.939 . . . . 0.0 110.105 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.26 51.1 1.96 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.11 -0.994 . . . . 0.0 110.269 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 88.6 p -133.84 39.63 3.14 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.185 -0.947 . . . . 0.0 110.407 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -134.04 84.41 42.95 Favored Pre-proline 0 N--CA 1.494 1.728 0 O-C-N 121.19 -0.943 . . . . 0.0 110.121 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.86 158.5 49.96 Favored 'Trans proline' 0 C--N 1.317 -1.094 0 O-C-N 123.373 1.196 . . . . 0.0 110.692 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.439 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -86.59 148.6 46.79 Favored Pre-proline 0 N--CA 1.504 2.233 0 O-C-N 121.391 -0.818 . . . . 0.0 109.63 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.14 162.83 40.82 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.411 1.216 . . . . 0.0 110.919 -179.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -47.62 -32.34 5.45 Favored 'General case' 0 N--CA 1.515 2.796 0 O-C-N 121.431 -0.793 . . . . 0.0 111.596 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.99 -34.73 39.11 Favored Glycine 0 N--CA 1.5 2.918 0 O-C-N 121.039 -1.038 . . . . 0.0 110.514 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.7 t80 -55.84 -32.29 63.47 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.061 -1.258 . . . . 0.0 110.695 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -54.32 -38.65 66.24 Favored 'General case' 0 N--CA 1.513 2.71 0 O-C-N 120.913 -1.117 . . . . 0.0 110.147 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.22 -36.14 72.73 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.209 -0.932 . . . . 0.0 110.164 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.43 HG23 ' OH ' ' A' ' 62' ' ' TYR . 3.0 pt -115.34 36.12 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 O-C-N 121.204 -0.935 . . . . 0.0 110.373 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.434 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.3 OUTLIER -84.06 -43.41 0.77 Allowed Pre-proline 0 N--CA 1.509 2.519 0 O-C-N 121.073 -1.017 . . . . 0.0 113.217 -179.187 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.434 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.2 Cg_endo -75.58 -36.39 2.25 Favored 'Trans proline' 0 N--CA 1.486 1.083 0 O-C-N 122.62 0.8 . . . . 0.0 111.634 -178.243 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 85.5 m -61.54 -46.65 89.04 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 120.938 -1.101 . . . . 0.0 109.756 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.424 HD21 ' CD2' ' A' ' 86' ' ' TYR . 4.9 mt -61.81 -39.22 90.99 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.48 -0.888 . . . . 0.0 109.632 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.5 m -57.2 -35.7 69.95 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.137 -0.977 . . . . 0.0 110.295 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -57.63 -37.95 74.18 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.068 -1.02 . . . . 0.0 110.248 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.419 ' CD2' HD22 ' A' ' 55' ' ' LEU . 14.2 m-85 -59.0 -38.53 79.43 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.126 -0.984 . . . . 0.0 110.391 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -58.31 -39.36 79.17 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.175 -0.953 . . . . 0.0 110.309 -179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.4 mp -67.97 -41.19 84.41 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.279 0 C-N-CA 119.225 -0.99 . . . . 0.0 108.734 179.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -66.74 -49.03 67.3 Favored 'General case' 0 N--CA 1.506 2.329 0 C-N-CA 119.177 -1.009 . . . . 0.0 108.341 178.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.3 tp -63.1 -36.21 82.82 Favored 'General case' 0 N--CA 1.508 2.434 0 C-N-CA 119.39 -0.924 . . . . 0.0 108.921 178.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.7 -38.03 74.51 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.117 -0.989 . . . . 0.0 110.298 179.618 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -64.56 -50.55 66.85 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.094 -1.004 . . . . 0.0 109.728 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.413 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -70.78 -36.57 73.12 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 119.202 -0.999 . . . . 0.0 109.48 179.051 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -72.2 -30.83 65.33 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.127 -0.983 . . . . 0.0 110.281 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.8 mmtt -95.11 -32.72 12.96 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 120.952 -1.093 . . . . 0.0 111.12 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -61.21 -39.34 89.86 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.02 -1.05 . . . . 0.0 109.994 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.3 tttt -56.89 -39.06 73.69 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.116 -0.99 . . . . 0.0 110.263 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.2 p -68.42 178.11 2.12 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.228 -0.92 . . . . 0.0 109.683 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.85 -71.01 0.08 Allowed 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.175 -0.953 . . . . 0.0 110.552 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -116.97 124.29 49.01 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.954 -1.091 . . . . 0.0 110.06 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -136.0 64.55 1.56 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.197 -0.94 . . . . 0.0 110.357 -179.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -115.19 -56.18 2.39 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.134 -0.979 . . . . 0.0 110.256 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -122.26 173.63 7.49 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.227 -0.921 . . . . 0.0 110.266 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 32.8 tptt 52.82 62.93 2.44 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.134 -0.979 . . . . 0.0 110.78 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.39 -57.02 2.32 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.179 -0.951 . . . . 0.0 110.07 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.406 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 15.4 m120 -58.4 -41.79 85.71 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.235 -0.916 . . . . 0.0 109.624 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -62.25 -37.4 85.29 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.297 -0.877 . . . . 0.0 109.988 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -66.04 -43.2 88.21 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.12 -0.988 . . . . 0.0 109.558 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 43.6 mt -64.47 -34.01 77.21 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.258 -0.901 . . . . 0.0 110.321 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.43 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 46.9 m0 -57.76 -40.73 80.45 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 120.929 -1.107 . . . . 0.0 109.724 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -59.73 -35.05 73.77 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.359 -0.937 . . . . 0.0 109.957 179.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.413 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 18.3 mt -72.04 -57.24 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.161 0 O-C-N 121.046 -1.034 . . . . 0.0 109.121 179.229 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 ptm -61.58 -26.9 68.26 Favored 'General case' 0 N--CA 1.507 2.421 0 C-N-CA 118.53 -1.268 . . . . 0.0 110.06 178.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -73.49 -39.78 64.6 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 120.723 -1.235 . . . . 0.0 108.708 177.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.419 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.0 mt -53.38 -30.5 40.16 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.087 -1.008 . . . . 0.0 110.303 178.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.458 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 15.9 t60 -57.73 -39.92 78.42 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.943 -1.098 . . . . 0.0 110.111 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.413 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 6.8 m170 -60.51 -46.95 88.25 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.172 -0.955 . . . . 0.0 109.442 179.23 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -61.17 -37.38 82.72 Favored 'General case' 0 N--CA 1.505 2.3 0 C-N-CA 119.463 -0.895 . . . . 0.0 109.57 179.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.416 ' HD3' ' CG ' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -67.16 -48.35 68.25 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.097 -1.002 . . . . 0.0 109.31 179.176 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.2 p -61.68 -38.46 87.87 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.185 -0.947 . . . . 0.0 109.383 179.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -37.71 88.5 Favored 'General case' 0 N--CA 1.507 2.401 0 C-N-CA 119.261 -0.975 . . . . 0.0 109.464 179.176 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.43 ' OH ' HG23 ' A' ' 19' ' ' ILE . 42.2 t80 -61.1 -48.69 80.49 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.118 -0.989 . . . . 0.0 109.454 179.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 84.0 mt -76.25 -43.25 37.21 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 O-C-N 121.189 -0.944 . . . . 0.0 108.854 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.412 ' CE1' HG21 ' A' ' 92' ' ' ILE . 40.7 t80 -59.75 -24.94 64.46 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.408 -0.808 . . . . 0.0 110.39 178.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 85.5 m -88.35 -34.99 17.42 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.692 -1.255 . . . . 0.0 110.441 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.6 pp -82.88 -32.95 27.11 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 120.806 -1.184 . . . . 0.0 112.025 -179.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.405 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 33.3 t80 -86.45 -37.16 18.59 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 120.714 -1.241 . . . . 0.0 111.835 -179.317 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -93.22 -19.58 21.29 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 120.897 -1.127 . . . . 0.0 113.086 -178.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 15.5 mtpt -116.54 -58.6 2.07 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.518 -1.364 . . . . 0.0 110.97 -179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -68.67 -29.21 67.63 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.082 -1.011 . . . . 0.0 110.873 -179.54 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.6 tttt 58.53 42.84 20.22 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.796 -1.19 . . . . 0.0 109.957 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.72 34.32 4.05 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.447 -0.783 . . . . 0.0 109.949 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.443 HD13 HG21 ' A' ' 73' ' ' ILE . 14.1 tt -153.41 162.41 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.156 -0.965 . . . . 0.0 109.728 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 49.7 m -107.93 148.35 29.76 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.056 -1.027 . . . . 0.0 110.406 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.0 ttmm -46.81 -32.34 3.63 Favored 'General case' 0 N--CA 1.514 2.763 0 O-C-N 121.262 -0.898 . . . . 0.0 111.417 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -62.27 -51.15 68.86 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 120.976 -1.078 . . . . 0.0 109.29 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 35.0 tp -65.94 -43.84 86.85 Favored 'General case' 0 N--CA 1.506 2.351 0 C-N-CA 119.202 -0.999 . . . . 0.0 108.528 178.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.405 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 19.3 t80 -60.73 -39.94 90.53 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.279 -0.888 . . . . 0.0 109.335 179.1 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -71.62 -42.22 67.91 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.11 -0.994 . . . . 0.0 108.823 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.439 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 81.7 t90 -56.76 -36.99 70.44 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 121.301 -0.874 . . . . 0.0 109.687 179.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.468 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 51.9 mt -68.85 -47.28 66.36 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.22 -0.925 . . . . 0.0 109.122 179.156 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.443 HG21 HD12 ' A' ' 82' ' ' ILE . 37.0 mm -57.77 -33.3 45.02 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.535 0 O-C-N 121.258 -0.901 . . . . 0.0 110.032 179.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.6 tmtt? -89.32 -11.77 42.47 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.965 -1.084 . . . . 0.0 112.48 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.431 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 71.5 mm-40 -108.52 22.68 15.6 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 120.475 -1.39 . . . . 0.0 112.206 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 15.8 tttt 74.96 73.99 0.1 Allowed 'General case' 0 N--CA 1.512 2.672 0 O-C-N 121.102 -0.998 . . . . 0.0 111.799 179.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.468 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 34.1 m-85 -134.54 -62.51 0.74 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.449 -0.782 . . . . 0.0 109.196 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -132.59 160.85 35.42 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.402 -0.811 . . . . 0.0 109.257 179.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.458 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.4 t70 -105.65 119.1 38.27 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.047 -1.033 . . . . 0.0 110.421 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.1 mmtt -60.87 -38.08 84.36 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 119.478 -0.889 . . . . 0.0 109.825 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 8.3 tp -60.29 -37.93 82.02 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.096 -1.003 . . . . 0.0 109.707 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.444 ' CD1' ' CZ3' ' A' ' 95' ' ' TRP . 0.2 OUTLIER -65.81 -55.82 15.15 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.096 -1.003 . . . . 0.0 108.895 179.21 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.412 HG21 ' CE1' ' A' ' 64' ' ' TYR . 39.6 mt -61.75 -36.02 71.11 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.475 0 C-N-CA 119.342 -0.943 . . . . 0.0 108.888 178.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.92 -39.95 91.02 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.09 -1.006 . . . . 0.0 109.354 178.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.42 ' HD2' ' CE1' ' A' ' 100' ' ' TYR . 10.8 mmtm -58.68 -44.25 90.2 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 121.154 -0.966 . . . . 0.0 109.501 179.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.444 ' CZ3' ' CD1' ' A' ' 91' ' ' LEU . 2.6 m0 -62.58 -34.97 78.04 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.192 -0.942 . . . . 0.0 110.153 179.378 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.41 ' NH1' ' OH ' ' A' ' 64' ' ' TYR . 0.3 OUTLIER -81.25 -31.9 33.54 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.02 -1.05 . . . . 0.0 110.79 179.757 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 23.6 mmtt -53.91 -176.73 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.711 0 O-C-N 120.899 -1.126 . . . . 0.0 110.582 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -103.38 134.52 46.62 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.241 -0.912 . . . . 0.0 109.808 179.201 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.42 14.2 45.36 Favored Glycine 0 N--CA 1.493 2.494 0 C-N-CA 120.2 -1.0 . . . . 0.0 110.863 -179.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.42 ' CE1' ' HD2' ' A' ' 94' ' ' LYS . 51.3 m-85 -123.03 72.49 1.1 Allowed 'General case' 0 N--CA 1.493 1.676 0 CA-C-N 119.43 1.615 . . . . 0.0 109.983 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.12 -36.46 12.65 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.159 -0.963 . . . . 0.0 110.468 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.77 77.21 1.74 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.006 -1.059 . . . . 0.0 110.565 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -120.85 150.54 40.88 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.036 -1.04 . . . . 0.0 110.059 179.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.413 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.7 p -111.91 -32.59 6.55 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.173 -0.954 . . . . 0.0 112.98 -179.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.55 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.0 m -142.05 -168.5 2.71 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.204 -1.56 . . . . 0.0 110.156 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 62.1 mt -96.73 -38.46 9.9 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.252 -0.905 . . . . 0.0 110.122 178.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 22.9 ttt-85 -101.27 28.9 5.05 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 120.952 -1.093 . . . . 0.0 109.943 178.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.55 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.308 1.8 t -127.05 17.29 7.24 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.065 -1.022 . . . . 0.0 108.623 -179.801 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 2.0 pt -156.35 34.38 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.062 0 O-C-N 120.806 -1.184 . . . . 0.0 111.05 -178.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -152.37 150.12 29.36 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.711 -1.243 . . . . 0.0 111.147 -178.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.41 ' HG3' ' OG1' ' A' ' 119' ' ' THR . 0.2 OUTLIER -101.29 -178.83 3.85 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.282 -0.886 . . . . 0.0 110.334 179.836 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -144.3 -59.44 0.38 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.27 -0.894 . . . . 0.0 110.182 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -115.37 -173.06 2.26 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.138 -0.976 . . . . 0.0 110.149 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 3.6 m -124.81 48.14 2.03 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.143 -0.973 . . . . 0.0 110.303 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 47.4 m-20 -145.56 -65.72 0.31 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.207 -0.933 . . . . 0.0 110.306 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -116.73 139.52 50.47 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.249 -0.907 . . . . 0.0 110.183 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 66.81 123.4 0.02 OUTLIER Glycine 0 N--CA 1.492 2.416 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.4 m -143.29 95.6 2.78 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.269 -1.136 . . . . 0.0 110.235 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.41 ' OG1' ' HG3' ' A' ' 111' ' ' LYS . 0.2 OUTLIER 56.68 171.94 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.086 -1.008 . . . . 0.0 110.373 -179.925 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 42.7 t -86.9 153.58 21.5 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.12 -0.988 . . . . 0.0 108.661 178.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.457 ' CD1' ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -72.5 -30.89 35.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.378 0 O-C-N 121.079 -1.013 . . . . 0.0 111.627 -178.695 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.5 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.8 p -60.0 -35.73 75.67 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 120.593 -1.317 . . . . 0.0 110.396 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 7.0 ttt-85 -57.2 -32.85 66.91 Favored 'General case' 0 N--CA 1.512 2.626 0 O-C-N 121.077 -1.014 . . . . 0.0 109.925 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 61.9 t -79.99 124.4 83.07 Favored Pre-proline 0 N--CA 1.506 2.333 0 O-C-N 121.056 -1.028 . . . . 0.0 109.913 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -67.56 -179.73 2.12 Favored 'Trans proline' 0 N--CA 1.488 1.153 0 O-C-N 123.112 1.059 . . . . 0.0 110.87 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.19 -37.85 61.02 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.22 -0.925 . . . . 0.0 110.419 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.97 -40.83 81.57 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.025 -1.047 . . . . 0.0 110.092 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 22.7 tp60 -69.19 -41.54 77.01 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.339 -0.944 . . . . 0.0 109.238 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 9.4 mt -66.01 -38.73 89.19 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 121.21 -0.931 . . . . 0.0 109.517 179.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -60.61 -38.81 85.93 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.184 -0.947 . . . . 0.0 109.907 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -58.76 -37.9 77.27 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.141 -0.974 . . . . 0.0 110.382 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -64.35 -40.47 95.93 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.094 -1.004 . . . . 0.0 110.098 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -66.48 -41.33 89.13 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.067 -1.021 . . . . 0.0 109.675 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 11.3 mmp_? -63.89 -34.81 78.8 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.227 -0.921 . . . . 0.0 110.254 179.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 9.9 mmmt -74.41 -31.81 62.46 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 120.958 -1.089 . . . . 0.0 110.956 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 29.2 mttm -99.76 22.28 11.25 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 120.882 -1.136 . . . . 0.0 111.804 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.0 46.42 55.71 Favored Glycine 0 N--CA 1.499 2.884 0 O-C-N 120.607 -1.308 . . . . 0.0 110.743 179.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.7 t -145.68 -163.79 1.8 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.145 -1.209 . . . . 0.0 110.32 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 12.6 mt-30 -131.85 171.44 13.54 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.132 -0.98 . . . . 0.0 110.213 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.7 p -159.18 160.96 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.209 -0.932 . . . . 0.0 110.859 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 30.3 t -168.63 96.87 0.39 Allowed 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.319 -0.863 . . . . 0.0 110.924 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.5 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 73.4 t80 -97.16 159.6 14.82 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.202 -0.936 . . . . 0.0 110.518 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 17.7 m170 -138.3 -61.24 0.6 Allowed 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 178.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -139.48 151.13 45.94 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.526 -0.734 . . . . 0.0 109.264 178.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . 0.412 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.0 p -92.52 155.71 17.63 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.065 -1.022 . . . . 0.0 111.024 -179.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.4 p -74.78 -23.09 17.51 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.435 -0.79 . . . . 0.0 111.7 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -51.72 -57.24 9.8 Favored 'General case' 0 N--CA 1.514 2.751 0 O-C-N 120.81 -1.181 . . . . 0.0 110.002 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.43 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.2 p -128.91 -164.15 1.36 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.281 -0.887 . . . . 0.0 110.385 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -102.11 62.43 0.51 Allowed Glycine 0 N--CA 1.493 2.459 0 N-CA-C 107.81 -2.116 . . . . 0.0 107.81 178.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 21.6 t -99.54 146.01 26.88 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.32 -1.106 . . . . 0.0 109.792 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 11.1 mtt85 -100.92 44.14 1.03 Allowed 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.219 -0.926 . . . . 0.0 109.689 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 76.67 97.18 0.17 Allowed Glycine 0 N--CA 1.486 2.033 0 N-CA-C 109.846 -1.302 . . . . 0.0 109.846 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.4 p -110.39 125.78 53.58 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.344 -1.092 . . . . 0.0 110.202 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -142.16 137.34 30.8 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.13 -0.981 . . . . 0.0 109.949 -179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 1.1 m -105.27 42.07 1.28 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.137 -0.977 . . . . 0.0 109.689 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 2.3 m -157.43 -56.14 0.08 Allowed 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.246 -0.909 . . . . 0.0 110.634 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 . . . . . 0 N--CA 1.495 1.821 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.211 179.954 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.374 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -93.07 179.21 39.37 Favored Glycine 0 N--CA 1.494 2.5 0 N-CA-C 109.556 -1.417 . . . . 0.0 109.556 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.9 t -124.24 148.79 58.9 Favored Pre-proline 0 N--CA 1.495 1.779 0 O-C-N 121.246 -1.149 . . . . 0.0 110.177 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -72.89 120.9 6.91 Favored 'Trans proline' 0 C--N 1.318 -1.056 0 O-C-N 123.35 1.184 . . . . 0.0 110.506 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.86 119.27 9.01 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.177 -0.952 . . . . 0.0 110.36 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.0 tt -155.19 57.4 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.161 -0.962 . . . . 0.0 110.645 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.5 mttm -116.29 -58.27 2.11 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.188 -0.945 . . . . 0.0 110.289 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 11.2 p -118.73 96.23 5.18 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.148 -0.97 . . . . 0.0 110.335 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 18.3 ttm-85 -122.0 -57.09 1.81 Allowed 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.174 -0.954 . . . . 0.0 110.344 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -121.38 154.67 36.18 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.151 -0.968 . . . . 0.0 110.228 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.5 m -130.05 -178.94 4.95 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.273 -0.892 . . . . 0.0 110.236 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.9 79.65 32.6 Favored Pre-proline 0 N--CA 1.494 1.739 0 O-C-N 121.212 -0.93 . . . . 0.0 110.209 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -73.01 158.05 50.17 Favored 'Trans proline' 0 C--N 1.317 -1.112 0 O-C-N 123.369 1.194 . . . . 0.0 110.588 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.431 ' HB3' ' CH2' ' A' ' 80' ' ' TRP . . . 61.69 148.74 0.09 OUTLIER Pre-proline 0 N--CA 1.503 2.222 0 O-C-N 121.408 -0.808 . . . . 0.0 110.636 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.12 163.95 37.15 Favored 'Trans proline' 0 C--N 1.318 -1.059 0 O-C-N 123.307 1.162 . . . . 0.0 110.652 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -48.46 -32.23 7.48 Favored 'General case' 0 N--CA 1.515 2.801 0 O-C-N 121.483 -0.761 . . . . 0.0 111.375 -179.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.86 -34.12 50.84 Favored Glycine 0 N--CA 1.498 2.779 0 O-C-N 121.018 -1.051 . . . . 0.0 110.502 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -54.63 -32.55 59.16 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 120.999 -1.295 . . . . 0.0 110.76 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 -54.18 -37.9 65.0 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 121.006 -1.059 . . . . 0.0 110.18 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.0 mptt -58.63 -36.52 74.21 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.179 -0.951 . . . . 0.0 110.25 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 3.3 pt -117.06 35.69 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.152 -0.968 . . . . 0.0 110.514 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.421 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 6.6 tmtt? -84.64 -43.21 0.71 Allowed Pre-proline 0 N--CA 1.508 2.451 0 O-C-N 121.093 -1.004 . . . . 0.0 113.265 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.421 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.8 Cg_endo -76.44 -38.01 1.17 Allowed 'Trans proline' 0 N--CA 1.487 1.134 0 O-C-N 122.603 0.791 . . . . 0.0 111.582 -178.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 86.0 m -59.73 -43.18 94.3 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 120.86 -1.15 . . . . 0.0 109.992 -179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.423 HD23 ' CD2' ' A' ' 86' ' ' TYR . 1.6 mt -63.12 -37.98 89.35 Favored 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 119.487 -0.885 . . . . 0.0 109.772 179.432 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.6 -36.63 72.01 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.091 -1.005 . . . . 0.0 110.394 179.652 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -57.26 -37.38 72.25 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.091 -1.005 . . . . 0.0 110.256 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.427 ' CE2' HD23 ' A' ' 55' ' ' LEU . 13.3 m-85 -58.42 -38.98 78.54 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.091 -1.006 . . . . 0.0 110.556 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -60.84 -38.91 87.11 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.233 -0.917 . . . . 0.0 110.864 -179.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.2 mp -65.71 -39.23 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.415 0 C-N-CA 119.119 -1.032 . . . . 0.0 109.591 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.8 tt0 -72.16 -46.0 58.19 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.034 -1.041 . . . . 0.0 108.831 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.29 -33.76 76.75 Favored 'General case' 0 N--CA 1.508 2.44 0 C-N-CA 119.27 -0.972 . . . . 0.0 108.902 178.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -57.17 -39.51 75.46 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 120.994 -1.066 . . . . 0.0 110.011 179.349 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.83 -49.86 73.25 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.25 -0.98 . . . . 0.0 109.605 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.412 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -69.33 -39.39 78.23 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.18 -0.95 . . . . 0.0 109.352 179.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 10.8 mm-40 -69.73 -30.8 68.5 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.231 -0.918 . . . . 0.0 110.446 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -94.79 -31.24 13.84 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.85 -1.156 . . . . 0.0 111.261 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -56.68 -36.72 69.93 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 120.873 -1.142 . . . . 0.0 110.282 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.3 ttmt -53.79 -36.74 62.77 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 121.047 -1.033 . . . . 0.0 110.528 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.5 t -106.41 39.49 1.81 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.043 -1.036 . . . . 0.0 110.118 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -150.52 -58.84 0.18 Allowed 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.211 -0.931 . . . . 0.0 110.298 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -122.63 100.1 6.75 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.232 -0.918 . . . . 0.0 109.978 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.5 tt -117.71 69.43 0.77 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.123 -0.985 . . . . 0.0 110.076 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -112.13 -54.33 2.63 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.204 -0.935 . . . . 0.0 110.262 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -135.55 159.3 42.04 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.139 -0.976 . . . . 0.0 110.291 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 52.2 mmtt 52.87 95.26 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.095 -1.003 . . . . 0.0 110.935 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -121.53 -58.45 1.76 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.21 -0.931 . . . . 0.0 110.222 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -55.47 -38.41 69.06 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.202 -0.936 . . . . 0.0 109.821 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -58.0 -34.67 70.25 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.229 -0.919 . . . . 0.0 110.166 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -57.46 -41.02 79.77 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 120.948 -1.095 . . . . 0.0 109.953 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 93.4 mt -64.71 -38.62 91.6 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.254 -0.904 . . . . 0.0 109.885 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.447 ' CE3' ' CA ' ' A' ' 149' ' ' GLY . 39.9 m0 -58.18 -32.13 67.95 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.151 -0.968 . . . . 0.0 109.865 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -69.37 -33.33 72.9 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.643 -1.286 . . . . 0.0 109.624 178.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.412 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 68.4 mt -72.54 -51.1 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.298 0 O-C-N 120.904 -1.122 . . . . 0.0 109.39 179.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.477 ' CE ' ' HB2' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -61.02 -33.31 73.07 Favored 'General case' 0 N--CA 1.508 2.464 0 C-N-CA 118.799 -1.16 . . . . 0.0 109.648 179.07 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -62.48 -38.16 88.78 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.93 -1.106 . . . . 0.0 109.608 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.427 HD23 ' CE2' ' A' ' 26' ' ' PHE . 19.6 mt -53.79 -35.16 61.06 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.113 -0.992 . . . . 0.0 110.017 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.439 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 38.5 t60 -56.19 -38.81 71.47 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 120.98 -1.075 . . . . 0.0 109.881 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.428 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 10.4 m170 -61.42 -50.39 73.0 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.224 -0.923 . . . . 0.0 109.051 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -60.93 -38.7 86.72 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 119.468 -0.893 . . . . 0.0 109.271 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.419 ' HG3' ' CE2' ' A' ' 26' ' ' PHE . 5.2 mtt180 -62.23 -48.06 81.65 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.164 -0.96 . . . . 0.0 109.33 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 94.6 p -65.44 -39.09 91.65 Favored 'General case' 0 N--CA 1.503 2.204 0 C-N-CA 119.306 -0.958 . . . . 0.0 109.159 179.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.43 ' O ' ' OG1' ' A' ' 65' ' ' THR . 34.9 ttt85 -65.52 -39.82 92.24 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.111 -0.993 . . . . 0.0 109.134 178.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -62.46 -50.41 71.59 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.119 -0.988 . . . . 0.0 109.344 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.438 HG23 HD13 ' A' ' 63' ' ' ILE . 91.6 mt -71.8 -39.49 68.15 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 O-C-N 121.221 -0.924 . . . . 0.0 109.255 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -65.15 -42.58 93.63 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.214 -0.929 . . . . 0.0 109.036 179.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.43 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 95.6 m -61.67 -41.45 97.57 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.134 -0.979 . . . . 0.0 110.389 -179.601 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.404 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -83.17 -32.28 26.69 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 120.874 -1.141 . . . . 0.0 112.391 -178.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.42 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 40.3 t80 -86.27 -32.24 21.22 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 120.755 -1.216 . . . . 0.0 111.714 -179.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -98.01 -19.42 18.02 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 120.806 -1.184 . . . . 0.0 112.487 -178.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.4 mttm -119.4 -58.5 1.91 Allowed 'General case' 0 N--CA 1.503 2.207 0 O-C-N 120.509 -1.369 . . . . 0.0 110.621 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 23.9 ttt-85 -65.14 -31.26 72.37 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.112 -0.992 . . . . 0.0 110.878 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.1 tptt 57.44 42.18 25.01 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.897 -1.127 . . . . 0.0 110.036 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.88 35.02 3.68 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.356 -0.84 . . . . 0.0 109.817 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.448 HG22 HD13 ' A' ' 73' ' ' ILE . 13.8 tt -154.14 162.53 2.0 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.235 -0.915 . . . . 0.0 109.84 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.1 t -108.85 147.44 32.11 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.13 -0.981 . . . . 0.0 110.299 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.7 ttmt -45.79 -31.96 2.31 Favored 'General case' 0 N--CA 1.516 2.837 0 O-C-N 121.289 -0.882 . . . . 0.0 111.604 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -62.35 -51.23 68.46 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 120.956 -1.09 . . . . 0.0 109.234 179.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 46.5 tp -66.25 -42.96 87.83 Favored 'General case' 0 N--CA 1.506 2.334 0 C-N-CA 119.274 -0.971 . . . . 0.0 108.52 178.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.42 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 17.0 t80 -61.41 -39.71 91.75 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 121.341 -0.849 . . . . 0.0 109.3 179.229 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -71.42 -42.45 68.27 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.059 -1.026 . . . . 0.0 108.724 178.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.439 ' CE2' ' HG3' ' A' ' 84' ' ' GLU . 80.9 t90 -56.34 -36.42 68.74 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.307 -0.871 . . . . 0.0 109.725 178.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.464 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 18.3 mt -69.04 -49.95 53.0 Favored 'General case' 0 N--CA 1.505 2.299 0 C-N-CA 119.393 -0.923 . . . . 0.0 108.916 179.029 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.1 mm -56.59 -32.86 38.28 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.584 0 O-C-N 121.202 -0.937 . . . . 0.0 109.954 179.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.9 mtpp -89.34 -14.89 34.64 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 120.877 -1.139 . . . . 0.0 112.208 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.439 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 5.6 mm-40 -105.73 22.36 15.68 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.593 -1.317 . . . . 0.0 112.069 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt 75.43 71.59 0.09 Allowed 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.041 -1.037 . . . . 0.0 111.916 179.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.464 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 32.6 m-85 -133.63 -62.77 0.77 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.488 -0.757 . . . . 0.0 108.977 179.272 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -134.03 163.02 30.48 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.451 -0.781 . . . . 0.0 109.202 179.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.439 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 16.4 t0 -112.19 111.53 22.49 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.088 -1.008 . . . . 0.0 110.482 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 28.0 mttt -57.94 -37.0 73.33 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.245 -0.909 . . . . 0.0 110.114 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 18.2 tp -57.88 -37.46 73.99 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.091 -1.006 . . . . 0.0 110.192 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 64.2 tp -72.79 -47.62 45.05 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.052 -1.03 . . . . 0.0 108.512 179.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.443 HG22 HD13 ' A' ' 92' ' ' ILE . 54.5 mt -60.55 -36.55 70.74 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.38 0 O-C-N 121.184 -0.947 . . . . 0.0 108.641 178.291 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.74 -39.27 84.23 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.086 -1.009 . . . . 0.0 109.275 178.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 8.7 mmtt -58.24 -42.65 86.82 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.062 -1.024 . . . . 0.0 109.434 179.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 6.9 m0 -68.29 -38.64 81.87 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.28 -0.888 . . . . 0.0 109.875 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.78 -31.94 67.13 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.225 -0.922 . . . . 0.0 110.476 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.0 mmtm -54.37 -176.56 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.671 0 O-C-N 120.927 -1.108 . . . . 0.0 110.498 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -104.76 134.24 48.24 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.184 -0.947 . . . . 0.0 109.823 179.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.69 10.19 55.64 Favored Glycine 0 N--CA 1.493 2.458 0 C-N-CA 120.19 -1.005 . . . . 0.0 111.129 -179.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -114.13 68.72 0.7 Allowed 'General case' 0 N--CA 1.495 1.808 0 CA-C-N 119.485 1.643 . . . . 0.0 110.044 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -90.22 -38.61 13.33 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.15 -0.969 . . . . 0.0 109.963 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.37 84.25 1.94 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.159 -0.963 . . . . 0.0 109.728 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 9.0 tp -125.86 137.13 53.73 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.373 -0.829 . . . . 0.0 109.881 -179.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.428 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.6 p -111.37 -38.97 4.82 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.211 -0.931 . . . . 0.0 112.434 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.595 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 5.9 m -138.75 -168.16 2.35 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 120.213 -1.554 . . . . 0.0 109.678 179.04 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 13.3 mt -97.99 -38.12 9.51 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 120.973 -1.079 . . . . 0.0 110.541 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 11.8 tpt85 -101.97 32.2 3.56 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 120.991 -1.068 . . . . 0.0 109.498 178.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.595 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.306 1.7 t -127.05 15.31 7.34 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.19 -0.944 . . . . 0.0 109.216 -179.289 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.1 pt -158.26 36.91 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.333 0 O-C-N 120.842 -1.161 . . . . 0.0 110.658 -178.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.407 ' O ' ' OG1' ' A' ' 119' ' ' THR . 5.6 mm-40 -119.15 137.06 53.86 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 120.748 -1.22 . . . . 0.0 111.68 -178.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.447 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 15.5 ptpt -137.62 -177.12 4.65 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.353 -0.842 . . . . 0.0 110.012 179.464 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -145.53 -59.32 0.33 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.126 -0.984 . . . . 0.0 110.421 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -120.11 -171.02 2.07 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.225 -0.922 . . . . 0.0 110.339 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 62.7 m -96.78 -36.89 10.49 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.216 -0.928 . . . . 0.0 110.682 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 55.9 t-20 -98.24 -43.29 7.03 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.935 -1.103 . . . . 0.0 110.44 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -113.63 88.63 2.89 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.17 -0.956 . . . . 0.0 110.363 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -142.35 169.77 25.31 Favored Glycine 0 N--CA 1.494 2.522 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.9 m -129.56 103.3 6.79 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.245 -1.15 . . . . 0.0 110.217 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.447 ' OG1' ' HA ' ' A' ' 111' ' ' LYS . 5.4 m -141.92 166.0 25.93 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.296 -0.877 . . . . 0.0 110.316 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 45.8 t -82.44 154.02 25.37 Favored 'General case' 0 N--CA 1.5 2.067 0 C-N-CA 119.374 -0.93 . . . . 0.0 109.084 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.452 HG22 HD11 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -72.75 -37.16 54.68 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 O-C-N 121.082 -1.011 . . . . 0.0 110.796 -179.389 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.47 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 4.5 p -54.18 -32.74 56.36 Favored 'General case' 0 N--CA 1.512 2.671 0 O-C-N 120.727 -1.233 . . . . 0.0 111.021 -179.08 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 7.3 ttp85 -57.93 -34.06 69.46 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 120.909 -1.12 . . . . 0.0 109.641 178.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 62.0 t -81.42 125.09 79.68 Favored Pre-proline 0 N--CA 1.504 2.229 0 O-C-N 121.137 -0.977 . . . . 0.0 109.725 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -65.77 172.87 7.61 Favored 'Trans proline' 0 N--CA 1.488 1.16 0 O-C-N 123.142 1.075 . . . . 0.0 110.772 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 2.0 tpt180 -75.07 -36.42 61.78 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.188 -0.945 . . . . 0.0 110.901 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.88 -44.01 91.06 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 120.943 -1.098 . . . . 0.0 109.985 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -65.27 -40.71 94.26 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.191 -0.943 . . . . 0.0 109.385 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.4 mt -61.82 -40.85 96.7 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.199 -0.938 . . . . 0.0 109.757 179.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -58.18 -39.93 80.16 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.158 -0.964 . . . . 0.0 109.988 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -60.36 -36.8 78.86 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.19 -0.943 . . . . 0.0 110.056 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -62.75 -47.15 84.79 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.158 -0.964 . . . . 0.0 109.946 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.29 -41.19 98.96 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.14 -0.975 . . . . 0.0 109.788 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 6.8 ttt85 -65.06 -32.59 74.38 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.226 -0.921 . . . . 0.0 110.378 179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 31.7 mttt -81.78 -29.79 32.59 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 120.86 -1.15 . . . . 0.0 111.077 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 36.3 mttt -98.71 24.35 7.66 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 120.82 -1.175 . . . . 0.0 111.712 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.15 46.94 42.56 Favored Glycine 0 N--CA 1.5 2.951 0 O-C-N 120.772 -1.205 . . . . 0.0 111.119 179.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.3 t -148.35 -164.76 2.09 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.114 -1.227 . . . . 0.0 110.422 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -132.65 159.57 39.22 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.185 -0.947 . . . . 0.0 110.283 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.8 p -147.34 161.01 8.3 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.227 -0.921 . . . . 0.0 110.24 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 25.5 t -170.57 83.51 0.1 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.188 -0.945 . . . . 0.0 111.167 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.47 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 52.0 t80 -95.02 159.07 15.19 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.139 -0.976 . . . . 0.0 110.263 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -135.81 -60.37 0.74 Allowed 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -138.71 151.9 47.54 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.401 -0.812 . . . . 0.0 109.518 179.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 26.5 p -93.6 156.1 16.92 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.157 -0.964 . . . . 0.0 110.891 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.8 p -74.55 -25.09 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 121.314 -0.866 . . . . 0.0 111.637 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 -50.88 -45.84 60.17 Favored 'General case' 0 N--CA 1.517 2.883 0 O-C-N 120.756 -1.215 . . . . 0.0 109.457 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.477 ' HB2' ' CE ' ' A' ' 53' ' ' MET . 29.1 p -143.43 177.52 8.39 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.348 -0.845 . . . . 0.0 110.537 179.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . 0.447 ' CA ' ' CE3' ' A' ' 50' ' ' TRP . . . -87.77 64.26 3.71 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 107.957 -2.057 . . . . 0.0 107.957 178.114 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 28.1 t -106.18 139.29 40.92 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.306 -1.114 . . . . 0.0 109.694 -179.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 31.1 mtt-85 -92.31 56.63 2.83 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.163 -0.961 . . . . 0.0 109.776 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 61.15 96.13 0.01 OUTLIER Glycine 0 N--CA 1.488 2.149 0 N-CA-C 109.764 -1.335 . . . . 0.0 109.764 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.8 p -105.13 129.21 53.58 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.288 -1.124 . . . . 0.0 110.4 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -143.7 138.34 28.82 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.15 -0.968 . . . . 0.0 109.926 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -103.03 -47.23 4.42 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.158 -0.964 . . . . 0.0 110.484 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 19.7 m -55.77 -39.81 71.74 Favored 'General case' 0 N--CA 1.512 2.646 0 O-C-N 121.142 -0.974 . . . . 0.0 110.521 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 . . . . . 0 N--CA 1.494 1.739 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.348 -179.914 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.366 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -85.64 167.27 40.45 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 45.3 t -121.32 81.55 37.99 Favored Pre-proline 0 N--CA 1.494 1.741 0 O-C-N 121.232 -1.157 . . . . 0.0 110.184 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.85 88.25 0.94 Allowed 'Trans proline' 0 C--N 1.315 -1.194 0 O-C-N 123.339 1.178 . . . . 0.0 110.444 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 36.2 mtt-85 -118.09 124.89 49.16 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.237 -0.915 . . . . 0.0 110.184 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 12.9 mt -117.76 126.43 74.78 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.264 -0.897 . . . . 0.0 109.935 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -121.99 85.05 2.35 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.17 -0.956 . . . . 0.0 110.131 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.1 t -142.35 179.67 6.8 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.286 -0.884 . . . . 0.0 110.299 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.1 mtt85 -126.89 98.88 5.51 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.243 -0.91 . . . . 0.0 110.151 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.5 mmt85 -132.78 165.38 24.68 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.189 -0.944 . . . . 0.0 110.249 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.8 t -116.45 141.26 48.41 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.305 -0.872 . . . . 0.0 110.006 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.2 mttt -142.39 171.21 7.5 Favored Pre-proline 0 N--CA 1.494 1.768 0 O-C-N 121.217 -0.927 . . . . 0.0 110.395 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.4 161.37 44.48 Favored 'Trans proline' 0 C--N 1.316 -1.145 0 O-C-N 123.509 1.268 . . . . 0.0 110.681 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.443 ' HB1' ' CH2' ' A' ' 80' ' ' TRP . . . -85.76 145.65 41.97 Favored Pre-proline 0 N--CA 1.505 2.294 0 C-N-CA 119.803 -0.759 . . . . 0.0 109.759 179.634 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.78 162.8 41.34 Favored 'Trans proline' 0 C--N 1.315 -1.185 0 O-C-N 123.34 1.179 . . . . 0.0 110.759 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -48.61 -31.87 7.31 Favored 'General case' 0 N--CA 1.514 2.772 0 O-C-N 121.444 -0.785 . . . . 0.0 111.408 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.78 -34.19 36.44 Favored Glycine 0 N--CA 1.5 2.947 0 O-C-N 120.871 -1.143 . . . . 0.0 110.569 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -55.16 -33.4 62.92 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 120.978 -1.307 . . . . 0.0 110.568 179.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -54.12 -37.12 63.99 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.064 -1.022 . . . . 0.0 110.227 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.9 mmtt -57.81 -35.63 71.1 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.155 -0.966 . . . . 0.0 110.27 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 3.7 pt -116.23 36.68 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.138 -0.976 . . . . 0.0 110.454 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.431 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.2 OUTLIER -84.68 -43.49 0.7 Allowed Pre-proline 0 N--CA 1.508 2.442 0 O-C-N 121.038 -1.039 . . . . 0.0 113.392 -179.21 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.2 Cg_endo -76.13 -38.33 1.19 Allowed 'Trans proline' 0 N--CA 1.488 1.149 0 O-C-N 122.51 0.742 . . . . 0.0 111.922 -178.037 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 85.0 m -59.56 -42.95 93.61 Favored 'General case' 0 N--CA 1.512 2.654 0 O-C-N 120.925 -1.11 . . . . 0.0 109.952 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 45.2 mt -65.55 -38.75 90.52 Favored 'General case' 0 N--CA 1.506 2.347 0 C-N-CA 119.404 -0.919 . . . . 0.0 109.31 179.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.0 m -57.7 -34.93 69.97 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.143 -0.973 . . . . 0.0 110.227 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -56.16 -36.87 68.81 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 121.015 -1.053 . . . . 0.0 110.235 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.421 ' CE1' ' HG2' ' A' ' 59' ' ' ARG . 15.4 m-85 -55.89 -36.79 68.02 Favored 'General case' 0 N--CA 1.511 2.621 0 O-C-N 121.108 -0.995 . . . . 0.0 110.256 179.606 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -57.13 -27.74 62.09 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.184 -0.947 . . . . 0.0 111.001 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 2.7 mp -76.67 -37.37 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 O-C-N 121.001 -1.062 . . . . 0.0 109.403 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 34.9 tp60 -79.24 -39.55 32.82 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 120.945 -1.097 . . . . 0.0 108.746 178.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.414 ' CD1' ' CG2' ' A' ' 52' ' ' ILE . 7.2 tp -70.21 -34.0 72.38 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.491 -0.884 . . . . 0.0 110.399 179.084 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.7 ptm85 -71.85 -36.14 70.07 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 120.824 -1.173 . . . . 0.0 109.746 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.14 -39.49 94.84 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.06 -1.025 . . . . 0.0 109.662 179.434 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.407 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -74.81 -40.98 60.79 Favored 'General case' 0 N--CA 1.505 2.287 0 C-N-CA 119.162 -1.015 . . . . 0.0 109.15 179.026 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -67.75 -29.97 69.32 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 119.531 -0.868 . . . . 0.0 110.423 179.357 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -87.08 -32.82 19.73 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.777 -1.202 . . . . 0.0 110.89 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -55.72 -37.55 68.57 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 120.923 -1.111 . . . . 0.0 110.386 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.44 -39.35 76.07 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 121.177 -0.952 . . . . 0.0 110.158 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 38.4 t 52.87 -166.85 0.06 Allowed 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.068 -1.02 . . . . 0.0 110.933 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.8 m -109.25 -51.93 2.82 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.281 -0.887 . . . . 0.0 110.311 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.9 mmmt -101.22 71.55 1.39 Allowed 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.205 -0.935 . . . . 0.0 109.789 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 15.8 tp -168.13 94.19 0.38 Allowed 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.254 -0.904 . . . . 0.0 110.762 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -98.0 106.11 18.36 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.229 -0.92 . . . . 0.0 110.325 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -168.49 109.81 0.54 Allowed 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.242 -0.911 . . . . 0.0 110.732 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 52.91 68.72 0.79 Allowed 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.013 -1.054 . . . . 0.0 110.546 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.1 m -98.3 -42.87 7.19 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.151 -0.968 . . . . 0.0 110.579 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.405 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 9.9 m120 -58.82 -40.12 83.21 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.171 -0.956 . . . . 0.0 109.977 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.42 ' HA ' ' CE3' ' A' ' 50' ' ' TRP . 20.7 mt-10 -60.12 -43.53 95.55 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.132 -0.98 . . . . 0.0 109.813 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 41.4 tp60 -62.89 -45.02 94.49 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.233 -0.917 . . . . 0.0 109.538 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 43.8 mt -59.29 -33.81 71.54 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.279 -0.888 . . . . 0.0 110.372 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.437 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 48.3 m0 -57.78 -40.55 80.07 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 120.834 -1.166 . . . . 0.0 109.581 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -62.41 -32.8 73.68 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 119.183 -1.007 . . . . 0.0 109.423 178.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.414 ' CG2' ' CD1' ' A' ' 30' ' ' LEU . 21.4 mt -71.04 -58.31 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.198 0 O-C-N 121.001 -1.062 . . . . 0.0 109.007 179.161 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 ptm -62.36 -29.11 70.23 Favored 'General case' 0 N--CA 1.508 2.448 0 C-N-CA 118.555 -1.258 . . . . 0.0 109.752 178.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -70.59 -38.75 74.08 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 120.859 -1.15 . . . . 0.0 109.124 178.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.419 HD22 ' CD1' ' A' ' 26' ' ' PHE . 11.0 mt -54.15 -32.87 56.47 Favored 'General case' 0 N--CA 1.513 2.696 0 O-C-N 121.054 -1.029 . . . . 0.0 110.214 178.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.438 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 6.7 t60 -55.94 -36.73 68.08 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.065 -1.022 . . . . 0.0 110.173 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.426 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 6.8 m170 -59.04 -47.32 85.65 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 121.023 -1.048 . . . . 0.0 109.544 179.352 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -59.73 -37.18 78.21 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.529 -0.868 . . . . 0.0 109.801 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.421 ' HG2' ' CE1' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -62.66 -48.29 79.99 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.096 -1.003 . . . . 0.0 109.447 179.421 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 26.6 p -62.99 -41.66 99.63 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.103 -0.998 . . . . 0.0 109.301 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.412 ' O ' ' OG1' ' A' ' 65' ' ' THR . 6.9 ttt85 -62.22 -40.27 95.57 Favored 'General case' 0 N--CA 1.505 2.314 0 C-N-CA 119.381 -0.928 . . . . 0.0 109.291 179.121 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -63.3 -51.49 65.86 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.117 -0.989 . . . . 0.0 109.446 179.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 71.6 mt -68.99 -36.41 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.384 0 C-N-CA 119.303 -0.959 . . . . 0.0 109.422 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.426 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 10.3 t80 -67.54 -41.81 83.68 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.044 -1.035 . . . . 0.0 108.97 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.412 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 91.5 m -60.75 -40.97 94.45 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.071 -1.018 . . . . 0.0 110.143 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.403 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.8 pp -83.26 -36.36 24.61 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 120.966 -1.084 . . . . 0.0 112.411 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.432 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 55.3 t80 -86.63 -35.26 19.49 Favored 'General case' 0 N--CA 1.512 2.641 0 O-C-N 120.608 -1.308 . . . . 0.0 111.826 -179.419 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.426 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 6.9 m-85 -98.36 -3.4 37.11 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 120.904 -1.123 . . . . 0.0 113.219 -178.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.79 -58.73 0.61 Allowed 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.352 -1.468 . . . . 0.0 110.8 179.437 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.7 tpt85 -62.52 -29.55 70.64 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 121.03 -1.043 . . . . 0.0 110.696 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 ttmm 59.72 44.26 14.4 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.819 -1.175 . . . . 0.0 110.021 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -118.2 37.73 3.92 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.389 -0.819 . . . . 0.0 109.87 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.459 HG21 HD11 ' A' ' 73' ' ' ILE . 14.8 tt -156.46 162.74 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.198 -0.939 . . . . 0.0 110.154 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 63.3 m -110.18 147.39 33.83 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.204 -0.935 . . . . 0.0 110.153 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.4 tttt -46.02 -32.21 2.69 Favored 'General case' 0 N--CA 1.516 2.864 0 O-C-N 121.328 -0.858 . . . . 0.0 111.606 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -62.11 -49.82 74.38 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.037 -1.039 . . . . 0.0 109.511 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 27.8 tp -67.39 -43.73 80.61 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 119.161 -1.016 . . . . 0.0 108.712 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.432 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 18.2 t80 -61.9 -38.13 87.21 Favored 'General case' 0 N--CA 1.506 2.327 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.325 179.135 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -73.73 -42.51 61.05 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.123 -0.986 . . . . 0.0 108.802 178.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.443 ' CH2' ' HB1' ' A' ' 12' ' ' ALA . 85.8 t90 -57.52 -37.01 72.32 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.31 -0.869 . . . . 0.0 109.712 178.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.465 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 14.6 mt -69.23 -48.57 61.6 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.21 -0.932 . . . . 0.0 108.897 179.089 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 32.4 mm -56.72 -31.74 35.95 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.614 0 O-C-N 121.124 -0.985 . . . . 0.0 109.911 179.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.7 mttt -86.67 -22.62 25.99 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 120.918 -1.114 . . . . 0.0 111.611 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.429 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 76.3 mm-40 -99.18 20.49 13.4 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 120.756 -1.215 . . . . 0.0 112.015 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.401 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 0.3 OUTLIER 74.03 77.22 0.12 Allowed 'General case' 0 N--CA 1.511 2.599 0 O-C-N 121.01 -1.056 . . . . 0.0 111.484 179.257 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.465 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 30.3 m-85 -135.69 -65.04 0.61 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.539 -0.726 . . . . 0.0 109.642 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -118.03 174.53 6.15 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.276 -0.89 . . . . 0.0 109.653 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.438 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 12.6 t0 -114.42 102.77 10.4 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.261 -0.899 . . . . 0.0 109.962 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -66.8 -40.21 88.02 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.303 -0.873 . . . . 0.0 109.886 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 60.7 tp -61.85 -40.3 94.85 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.188 -0.945 . . . . 0.0 109.735 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.424 HD23 ' NE2' ' A' ' 57' ' ' HIS . 59.6 tp -71.93 -43.44 65.28 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.097 -1.002 . . . . 0.0 108.674 179.229 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.445 HG23 HD12 ' A' ' 92' ' ' ILE . 54.2 mt -58.36 -35.75 55.31 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.479 0 O-C-N 121.206 -0.934 . . . . 0.0 108.702 178.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.85 -39.52 83.8 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.17 -0.956 . . . . 0.0 109.091 178.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.432 ' CD ' ' CZ ' ' A' ' 100' ' ' TYR . 8.1 mmtm -57.17 -42.57 81.36 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.031 -1.043 . . . . 0.0 109.484 179.186 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.408 ' CZ3' ' HG ' ' A' ' 91' ' ' LEU . 2.7 m0 -65.36 -35.79 82.04 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.342 -0.849 . . . . 0.0 110.053 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.23 -31.78 38.49 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.125 -0.985 . . . . 0.0 110.655 179.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 20.4 mmtm -53.64 -176.86 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.706 0 O-C-N 120.996 -1.065 . . . . 0.0 110.745 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -104.62 135.46 45.99 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.211 -0.931 . . . . 0.0 109.765 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.04 11.94 53.52 Favored Glycine 0 N--CA 1.492 2.428 0 C-N-CA 120.262 -0.971 . . . . 0.0 110.993 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.432 ' CZ ' ' CD ' ' A' ' 94' ' ' LYS . 48.4 m-85 -119.95 72.15 0.92 Allowed 'General case' 0 N--CA 1.492 1.664 0 CA-C-N 119.435 1.617 . . . . 0.0 109.973 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -93.69 -35.82 12.63 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.094 -1.004 . . . . 0.0 110.491 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -123.86 80.14 1.78 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.979 -1.075 . . . . 0.0 110.662 -179.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.8 pp -124.55 146.38 49.04 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.107 -0.996 . . . . 0.0 110.033 179.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.426 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.6 p -109.94 -30.87 7.61 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.154 -0.966 . . . . 0.0 112.967 -179.349 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.617 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.4 m -145.15 -169.79 3.28 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 120.194 -1.566 . . . . 0.0 110.098 179.39 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 16.7 mt -99.76 -35.99 9.61 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.295 -0.878 . . . . 0.0 110.227 178.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 3.3 ttt85 -103.06 33.69 3.17 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.869 -1.145 . . . . 0.0 109.653 178.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.617 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.276 1.6 t -124.82 -60.75 1.35 Allowed 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 105.18 -2.155 . . . . 0.0 105.18 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 4.2 pt -69.01 -21.95 25.9 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.671 0 O-C-N 120.879 -1.138 . . . . 0.0 110.784 176.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -130.61 151.83 50.65 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.837 -1.164 . . . . 0.0 109.756 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -116.26 -56.59 2.29 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.096 -1.002 . . . . 0.0 110.269 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -146.34 139.92 26.03 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.246 -0.909 . . . . 0.0 110.34 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 52.41 -173.57 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.036 -1.04 . . . . 0.0 110.668 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 16.2 m -106.86 76.99 1.14 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.151 -0.968 . . . . 0.0 110.086 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -140.36 -178.59 5.56 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.175 -0.953 . . . . 0.0 110.078 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -122.27 86.82 2.64 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.121 -0.987 . . . . 0.0 110.218 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -137.54 -73.91 0.06 OUTLIER Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.665 -1.374 . . . . 0.0 109.665 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 2.0 m -115.32 126.53 54.57 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.184 -1.186 . . . . 0.0 110.205 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -158.78 177.93 10.65 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.197 -0.939 . . . . 0.0 110.548 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 34.2 t -59.35 154.97 15.59 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.137 -0.977 . . . . 0.0 109.485 179.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.455 HG21 ' CE1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -76.84 -30.11 18.2 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.384 0 O-C-N 121.066 -1.021 . . . . 0.0 111.63 -179.013 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.489 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.7 p -58.67 -35.81 73.17 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 120.684 -1.26 . . . . 0.0 110.861 -178.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.18 -30.3 64.4 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 120.914 -1.116 . . . . 0.0 110.196 178.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.6 t -83.55 122.66 76.9 Favored Pre-proline 0 N--CA 1.505 2.303 0 O-C-N 120.976 -1.078 . . . . 0.0 110.217 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . 0.402 ' HB3' ' CB ' ' A' ' 154' ' ' ALA . 39.0 Cg_endo -66.08 179.2 2.0 Favored 'Trans proline' 0 N--CA 1.49 1.277 0 O-C-N 123.175 1.092 . . . . 0.0 110.94 179.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.26 -37.68 60.84 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.256 -0.902 . . . . 0.0 110.511 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.29 -40.62 78.19 Favored 'General case' 0 N--CA 1.511 2.622 0 O-C-N 121.047 -1.033 . . . . 0.0 110.057 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -70.41 -41.7 72.62 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 119.346 -0.941 . . . . 0.0 109.113 179.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.3 mt -66.02 -38.77 89.27 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 121.288 -0.882 . . . . 0.0 109.402 178.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -59.95 -38.11 81.51 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.113 -0.992 . . . . 0.0 109.958 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -58.58 -37.75 76.46 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.064 -1.022 . . . . 0.0 110.379 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -63.84 -45.72 88.3 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.139 -0.976 . . . . 0.0 109.807 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.68 -40.97 96.84 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.169 -0.957 . . . . 0.0 109.776 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 34.7 mtt-85 -59.88 -36.12 76.25 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.245 -0.909 . . . . 0.0 110.121 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 20.7 mttm -70.54 -32.91 70.54 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.042 -1.036 . . . . 0.0 110.879 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 2.1 ttmm -100.59 22.01 12.48 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 120.97 -1.081 . . . . 0.0 111.713 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.18 45.98 57.04 Favored Glycine 0 N--CA 1.499 2.87 0 O-C-N 120.592 -1.318 . . . . 0.0 110.688 179.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.3 t -143.04 -165.46 2.07 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.186 -1.185 . . . . 0.0 110.164 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -134.35 149.48 50.85 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.147 -0.971 . . . . 0.0 110.302 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.7 p -130.98 161.34 41.17 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 121.241 -0.912 . . . . 0.0 109.954 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 30.3 t -166.17 100.2 0.63 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.187 -0.946 . . . . 0.0 111.19 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.489 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 74.3 t80 -101.31 160.54 14.32 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.311 -0.868 . . . . 0.0 110.371 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -138.44 -60.88 0.6 Allowed 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.05 149.25 41.43 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.392 -0.817 . . . . 0.0 109.419 179.122 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . 0.439 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.7 p -91.65 157.96 16.67 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 120.992 -1.067 . . . . 0.0 110.765 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 12.5 p -78.42 -23.06 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 O-C-N 121.29 -0.881 . . . . 0.0 111.906 -179.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -51.77 -57.92 7.88 Favored 'General case' 0 N--CA 1.515 2.825 0 O-C-N 120.725 -1.234 . . . . 0.0 109.956 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.437 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 24.2 p -126.78 -165.49 1.46 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.296 -0.878 . . . . 0.0 110.387 179.634 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.42 65.07 0.58 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 107.891 -2.084 . . . . 0.0 107.891 178.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 33.6 t -101.72 141.76 34.09 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.344 -1.092 . . . . 0.0 109.813 -179.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 66.0 mtm-85 -100.38 43.56 1.05 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.18 -0.95 . . . . 0.0 109.772 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 80.61 95.55 0.39 Allowed Glycine 0 N--CA 1.486 2.002 0 N-CA-C 109.99 -1.244 . . . . 0.0 109.99 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.6 p -109.31 126.97 53.93 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.202 -1.176 . . . . 0.0 110.136 179.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . 0.402 ' CB ' ' HB3' ' A' ' 125' ' ' PRO . . . -154.32 147.6 24.88 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.118 -0.989 . . . . 0.0 110.415 -179.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -101.07 -45.32 5.43 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.228 -0.92 . . . . 0.0 110.542 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 2.4 m -57.8 -39.52 77.73 Favored 'General case' 0 N--CA 1.51 2.525 0 O-C-N 121.059 -1.026 . . . . 0.0 110.257 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 . . . . . 0 N--CA 1.495 1.781 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.254 179.917 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.296 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 135.98 -106.92 0.59 Allowed Glycine 0 N--CA 1.493 2.45 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 21.9 t -139.99 95.37 8.58 Favored Pre-proline 0 N--CA 1.494 1.733 0 O-C-N 121.202 -1.175 . . . . 0.0 110.222 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.72 78.54 2.06 Favored 'Trans proline' 0 C--N 1.317 -1.116 0 O-C-N 123.483 1.254 . . . . 0.0 110.449 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 11.6 mmt85 -134.87 -64.55 0.66 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.179 -0.951 . . . . 0.0 110.279 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 42.7 pt -133.65 40.88 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.321 -0.862 . . . . 0.0 110.25 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.6 mttt -131.78 98.75 4.56 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.193 -0.942 . . . . 0.0 110.232 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 10.4 m -131.92 158.95 40.07 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.204 -0.935 . . . . 0.0 110.276 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.6 ptt-85 -136.24 62.62 1.61 Allowed 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.261 -0.9 . . . . 0.0 110.197 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.0 ttt180 54.61 47.82 21.75 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.019 -1.05 . . . . 0.0 110.572 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.1 m -147.34 86.98 1.63 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.232 -0.918 . . . . 0.0 110.464 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.6 tptt -120.96 66.2 14.0 Favored Pre-proline 0 N--CA 1.494 1.73 0 O-C-N 121.173 -0.954 . . . . 0.0 110.019 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -73.13 158.57 48.97 Favored 'Trans proline' 0 C--N 1.318 -1.066 0 O-C-N 123.317 1.167 . . . . 0.0 110.846 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.433 ' HB1' ' CH2' ' A' ' 80' ' ' TRP . . . -104.65 149.68 37.72 Favored Pre-proline 0 N--CA 1.499 1.988 0 O-C-N 121.391 -0.818 . . . . 0.0 109.738 179.559 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -69.72 162.76 40.82 Favored 'Trans proline' 0 C--N 1.314 -1.238 0 O-C-N 123.435 1.229 . . . . 0.0 110.84 -179.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -48.61 -31.43 6.63 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.417 -0.802 . . . . 0.0 111.532 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.41 -35.73 36.54 Favored Glycine 0 N--CA 1.499 2.881 0 O-C-N 120.958 -1.089 . . . . 0.0 110.6 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.405 ' CE2' ' HG2' ' A' ' 20' ' ' LYS . 22.7 t80 -56.98 -33.48 67.14 Favored 'General case' 0 N--CA 1.511 2.617 0 O-C-N 121.034 -1.274 . . . . 0.0 110.579 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -53.78 -38.71 64.76 Favored 'General case' 0 N--CA 1.512 2.647 0 O-C-N 120.991 -1.068 . . . . 0.0 110.166 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 79.6 mttt -60.73 -36.59 79.25 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.366 -0.833 . . . . 0.0 110.081 179.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 1.8 pt -114.32 33.49 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 O-C-N 121.247 -0.908 . . . . 0.0 110.757 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.412 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -83.99 -45.54 0.76 Allowed Pre-proline 0 N--CA 1.51 2.525 0 O-C-N 121.056 -1.027 . . . . 0.0 112.872 -179.279 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.412 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.3 Cg_endo -76.78 -36.45 1.55 Allowed 'Trans proline' 0 N--CA 1.485 1.017 0 O-C-N 122.688 0.836 . . . . 0.0 111.46 -178.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 87.1 m -59.08 -42.64 90.89 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 120.935 -1.103 . . . . 0.0 109.893 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 93.6 mt -66.11 -39.95 90.33 Favored 'General case' 0 N--CA 1.505 2.302 0 C-N-CA 119.442 -0.903 . . . . 0.0 109.468 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.9 m -57.95 -34.5 69.97 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.167 -0.958 . . . . 0.0 110.072 179.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -55.84 -35.14 66.07 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 121.018 -1.051 . . . . 0.0 110.332 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.419 ' CE2' HD21 ' A' ' 55' ' ' LEU . 15.0 m-85 -57.67 -39.45 77.12 Favored 'General case' 0 N--CA 1.51 2.526 0 O-C-N 121.006 -1.059 . . . . 0.0 110.486 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -59.99 -34.36 73.21 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.238 -0.914 . . . . 0.0 111.022 -179.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.4 mp -71.43 -39.62 71.53 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.369 0 O-C-N 121.017 -1.052 . . . . 0.0 109.265 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 -70.52 -43.77 68.94 Favored 'General case' 0 N--CA 1.507 2.378 0 C-N-CA 119.199 -1.0 . . . . 0.0 108.725 178.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.35 -34.92 79.06 Favored 'General case' 0 N--CA 1.506 2.357 0 C-N-CA 119.366 -0.933 . . . . 0.0 108.974 178.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -57.62 -40.61 79.53 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.102 -0.999 . . . . 0.0 109.962 179.392 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.95 -46.37 88.06 Favored 'General case' 0 N--CA 1.506 2.371 0 C-N-CA 119.301 -0.96 . . . . 0.0 109.829 -179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.43 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -67.89 -40.43 83.51 Favored 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 119.237 -0.985 . . . . 0.0 109.215 179.081 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -59.62 -35.06 73.62 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.249 -0.907 . . . . 0.0 110.346 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 46.4 mmtt -95.29 -38.49 10.51 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 120.992 -1.067 . . . . 0.0 110.641 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -57.41 -38.74 74.83 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 121.059 -1.025 . . . . 0.0 110.099 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.8 tttm -59.47 -49.5 77.55 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.139 -0.976 . . . . 0.0 109.952 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 6.2 t 51.04 -165.11 0.05 OUTLIER 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.024 -1.047 . . . . 0.0 110.803 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -112.87 -55.47 2.52 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.198 -0.939 . . . . 0.0 110.186 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.2 mtmm -142.16 54.9 1.46 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.269 -0.894 . . . . 0.0 110.2 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.9 tt -116.74 -56.65 2.26 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.099 -1.001 . . . . 0.0 110.293 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -117.12 -165.19 1.04 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.121 -0.987 . . . . 0.0 110.263 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -112.59 -169.96 1.58 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.116 -0.99 . . . . 0.0 110.157 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.0 mtmt 53.03 80.03 0.11 Allowed 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.977 -1.077 . . . . 0.0 110.731 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.423 ' OG ' ' N ' ' A' ' 46' ' ' ASN . 5.7 p -109.26 -53.57 2.64 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.271 -0.893 . . . . 0.0 110.228 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.423 ' N ' ' OG ' ' A' ' 45' ' ' SER . 3.1 m120 -57.09 -38.55 73.51 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.256 -0.902 . . . . 0.0 109.967 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.414 ' HA ' ' CE3' ' A' ' 50' ' ' TRP . 20.0 mt-10 -63.24 -41.09 99.04 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.155 -0.966 . . . . 0.0 109.797 179.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.0 tp60 -61.87 -39.99 93.83 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.141 -0.974 . . . . 0.0 109.782 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -62.66 -36.87 84.24 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.188 -0.945 . . . . 0.0 110.283 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.442 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.9 m0 -54.41 -39.57 67.43 Favored 'General case' 0 N--CA 1.512 2.639 0 O-C-N 120.909 -1.119 . . . . 0.0 109.724 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -63.45 -38.08 89.77 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.258 -0.901 . . . . 0.0 109.635 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.43 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 78.8 mt -64.86 -44.96 96.23 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.394 0 O-C-N 121.135 -0.978 . . . . 0.0 109.173 179.632 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.435 ' CE ' ' HB3' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -68.17 -30.55 69.69 Favored 'General case' 0 N--CA 1.501 2.101 0 C-N-CA 118.889 -1.124 . . . . 0.0 109.743 178.999 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.426 ' N ' ' HG3' ' A' ' 53' ' ' MET . 48.1 mt-30 -67.39 -37.4 83.08 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.898 -1.126 . . . . 0.0 109.111 178.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.419 HD21 ' CE2' ' A' ' 26' ' ' PHE . 13.6 mt -52.35 -32.33 37.76 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.115 -0.99 . . . . 0.0 109.917 178.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.444 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 13.3 t60 -56.92 -40.27 76.01 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.023 -1.048 . . . . 0.0 109.389 179.024 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.423 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 8.0 m170 -60.44 -49.16 78.67 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.154 -0.966 . . . . 0.0 109.137 178.583 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -59.59 -39.45 84.19 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.343 -0.848 . . . . 0.0 109.365 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.408 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -62.42 -48.13 81.06 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.138 -0.976 . . . . 0.0 108.928 178.955 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 12.6 p -66.81 -40.57 88.09 Favored 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 119.384 -0.926 . . . . 0.0 108.699 178.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.8 ttt85 -63.01 -37.52 87.53 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.13 -0.981 . . . . 0.0 109.413 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -61.1 -50.83 71.67 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.124 -0.985 . . . . 0.0 109.293 179.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 88.6 mt -73.33 -42.01 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.344 0 C-N-CA 119.37 -0.932 . . . . 0.0 108.855 179.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.424 ' CE1' HG21 ' A' ' 92' ' ' ILE . 47.7 t80 -57.85 -32.56 67.76 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.331 -0.855 . . . . 0.0 110.235 178.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 61.9 m -80.78 -36.97 31.08 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 120.881 -1.137 . . . . 0.0 110.59 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.416 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -82.93 -32.05 27.4 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 120.954 -1.092 . . . . 0.0 112.25 -179.173 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.446 ' CE2' ' CD2' ' A' ' 78' ' ' TYR . 90.3 t80 -86.47 -36.16 19.21 Favored 'General case' 0 N--CA 1.512 2.655 0 O-C-N 120.658 -1.277 . . . . 0.0 111.731 -179.37 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -98.56 -20.6 16.95 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 120.896 -1.128 . . . . 0.0 112.951 -178.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -119.27 -56.45 2.07 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 120.48 -1.387 . . . . 0.0 111.637 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.402 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 8.4 ttt-85 -66.76 -29.72 69.76 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.056 -1.027 . . . . 0.0 110.805 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 59.5 44.6 14.6 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.822 -1.174 . . . . 0.0 110.042 -179.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.52 37.17 3.3 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.336 -0.853 . . . . 0.0 109.523 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.424 HD13 HG21 ' A' ' 73' ' ' ILE . 13.6 tt -160.43 162.69 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 121.243 -0.911 . . . . 0.0 110.139 -179.583 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.8 p -108.26 148.83 29.43 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.135 -0.978 . . . . 0.0 110.024 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.8 tttt -46.71 -32.2 3.43 Favored 'General case' 0 N--CA 1.515 2.799 0 O-C-N 121.271 -0.893 . . . . 0.0 111.556 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -61.69 -50.32 72.94 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.917 -1.114 . . . . 0.0 109.337 179.542 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 34.8 tp -67.33 -42.16 84.04 Favored 'General case' 0 N--CA 1.504 2.235 0 C-N-CA 119.118 -1.033 . . . . 0.0 108.657 178.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.446 ' CD2' ' CE2' ' A' ' 67' ' ' TYR . 19.1 t80 -61.6 -39.71 92.19 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.227 -0.921 . . . . 0.0 109.194 178.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -70.36 -42.44 71.8 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.142 -0.974 . . . . 0.0 108.728 178.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.433 ' CH2' ' HB1' ' A' ' 12' ' ' ALA . 68.3 t90 -56.95 -35.16 68.79 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.215 -0.928 . . . . 0.0 109.859 178.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.466 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 13.2 mt -70.37 -49.82 45.24 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.077 -1.015 . . . . 0.0 108.902 179.116 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 36.1 mm -58.37 -32.52 45.36 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.567 0 O-C-N 121.26 -0.9 . . . . 0.0 110.032 179.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.9 mttm -89.27 -15.74 32.81 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 120.894 -1.128 . . . . 0.0 112.108 -179.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.42 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 26.3 mm-40 -105.36 20.64 18.54 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 120.581 -1.324 . . . . 0.0 112.063 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt 73.85 77.36 0.13 Allowed 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.05 -1.031 . . . . 0.0 111.578 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.466 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 28.6 m-85 -135.01 -63.45 0.69 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.531 -0.73 . . . . 0.0 109.711 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -120.23 -174.48 2.79 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.377 -0.827 . . . . 0.0 109.894 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.444 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.7 t0 -124.04 112.78 17.56 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.134 -0.979 . . . . 0.0 110.435 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -63.74 -40.74 97.46 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.117 -0.989 . . . . 0.0 109.395 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.0 tp -59.59 -40.64 88.11 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.126 -0.984 . . . . 0.0 109.596 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.443 ' CD1' ' CZ3' ' A' ' 95' ' ' TRP . 0.2 OUTLIER -65.22 -53.24 47.57 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.188 -0.945 . . . . 0.0 109.012 179.368 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.45 HD11 HG23 ' A' ' 92' ' ' ILE . 55.8 mt -62.32 -34.71 65.64 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.313 0 O-C-N 121.228 -0.92 . . . . 0.0 109.127 178.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.93 -40.07 91.08 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.052 -1.03 . . . . 0.0 109.9 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.432 ' CD ' ' CD2' ' A' ' 106' ' ' LEU . 9.4 mttp -64.98 -42.53 94.47 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.026 -1.047 . . . . 0.0 110.267 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.443 ' CZ3' ' CD1' ' A' ' 91' ' ' LEU . 3.1 m0 -62.15 -33.5 74.62 Favored 'General case' 0 N--CA 1.51 2.553 0 C-N-CA 118.983 -1.087 . . . . 0.0 110.107 178.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.12 -35.3 36.97 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 120.963 -1.086 . . . . 0.0 110.452 179.596 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.6 mmtp -53.13 -179.31 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.652 0 O-C-N 121.009 -1.057 . . . . 0.0 110.718 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.1 m -106.6 140.46 39.44 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.289 -0.882 . . . . 0.0 109.544 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 101.23 -24.53 31.5 Favored Glycine 0 N--CA 1.492 2.408 0 C-N-CA 119.834 -1.174 . . . . 0.0 110.45 -179.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -91.95 58.56 3.41 Favored 'General case' 0 N--CA 1.503 2.224 0 CA-C-N 119.083 1.441 . . . . 0.0 110.047 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -71.18 -37.46 72.16 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.018 -1.051 . . . . 0.0 110.208 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.62 84.86 2.33 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.046 -1.034 . . . . 0.0 110.617 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.3 pp -120.54 140.83 50.9 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.086 -1.009 . . . . 0.0 110.303 179.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.423 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.5 p -108.03 -28.82 9.33 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.235 -0.916 . . . . 0.0 112.598 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.627 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 10.6 m -146.68 -169.83 3.37 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 120.366 -1.459 . . . . 0.0 110.005 179.314 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.432 ' CD2' ' CD ' ' A' ' 94' ' ' LYS . 93.9 mt -100.09 -35.1 9.8 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.211 -0.931 . . . . 0.0 110.583 178.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.92 36.67 2.37 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.757 -1.215 . . . . 0.0 109.187 178.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.627 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.284 1.6 t -127.72 -59.01 1.22 Allowed 'General case' 0 N--CA 1.498 1.946 0 N-CA-C 105.788 -1.931 . . . . 0.0 105.788 -179.411 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 18.8 pt -69.15 -26.22 31.49 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.617 0 O-C-N 121.001 -1.062 . . . . 0.0 110.741 177.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -124.6 161.96 25.1 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.865 -1.147 . . . . 0.0 110.175 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 7.3 tppt? -124.82 -57.93 1.51 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.145 -0.972 . . . . 0.0 110.369 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -115.74 -172.58 2.18 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.126 -0.984 . . . . 0.0 110.146 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -115.39 52.52 0.87 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.205 -0.935 . . . . 0.0 110.218 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.18 -58.8 0.34 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.152 -0.967 . . . . 0.0 110.414 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -144.62 -167.8 2.74 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.076 -1.015 . . . . 0.0 110.314 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -117.57 84.59 2.19 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.189 -0.944 . . . . 0.0 110.172 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -106.66 -55.27 0.66 Allowed Glycine 0 N--CA 1.493 2.465 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 1.5 m -126.46 120.53 29.96 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.221 -1.164 . . . . 0.0 110.306 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -140.96 177.46 8.03 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.206 -0.934 . . . . 0.0 109.877 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 35.1 t -55.48 153.68 7.28 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.047 -1.033 . . . . 0.0 110.047 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.443 HD12 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -74.22 -36.17 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.469 0 O-C-N 121.144 -0.973 . . . . 0.0 111.279 -179.07 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.509 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 10.7 p -52.72 -30.72 33.93 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.75 -1.219 . . . . 0.0 111.723 -178.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 1.5 ttt85 -61.61 -37.01 82.35 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 120.873 -1.142 . . . . 0.0 109.531 178.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 50.5 t -76.12 124.16 88.24 Favored Pre-proline 0 N--CA 1.505 2.286 0 O-C-N 121.109 -0.994 . . . . 0.0 110.031 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -66.09 172.83 8.07 Favored 'Trans proline' 0 N--CA 1.488 1.201 0 O-C-N 123.241 1.127 . . . . 0.0 110.707 179.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 27.1 mmm-85 -75.04 -36.2 61.88 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 121.19 -0.944 . . . . 0.0 110.675 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.05 -40.8 77.53 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 120.974 -1.079 . . . . 0.0 110.123 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -68.69 -41.6 78.93 Favored 'General case' 0 N--CA 1.506 2.348 0 C-N-CA 119.349 -0.94 . . . . 0.0 109.276 179.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.6 mt -64.53 -39.39 93.69 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.263 -0.898 . . . . 0.0 109.501 179.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -59.0 -37.82 77.75 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.181 -0.949 . . . . 0.0 110.13 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -58.15 -37.15 74.09 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.046 -1.034 . . . . 0.0 110.454 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.16 -47.67 81.69 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.237 -0.915 . . . . 0.0 109.892 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.2 -39.86 91.78 Favored 'General case' 0 N--CA 1.508 2.456 0 C-N-CA 119.33 -0.948 . . . . 0.0 109.787 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -37.33 79.63 Favored 'General case' 0 N--CA 1.512 2.631 0 O-C-N 121.174 -0.954 . . . . 0.0 110.149 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 13.5 mmtm -87.06 -38.86 16.14 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.084 -1.01 . . . . 0.0 110.261 179.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.28 -26.71 63.93 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.14 -0.975 . . . . 0.0 111.158 179.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 91.69 32.28 8.73 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 110.006 -1.238 . . . . 0.0 110.006 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.6 t -139.96 -159.67 0.98 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.981 -1.305 . . . . 0.0 109.725 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -134.41 134.73 41.98 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.045 -1.034 . . . . 0.0 110.228 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 13.2 p -120.42 160.55 20.92 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.258 -0.902 . . . . 0.0 110.116 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 35.6 t -168.92 80.51 0.13 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.165 -0.959 . . . . 0.0 111.327 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.509 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 40.1 t80 -87.72 160.34 18.13 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.163 -0.961 . . . . 0.0 109.679 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -136.77 -61.26 0.68 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.515 -0.741 . . . . 0.0 109.092 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -135.57 153.25 51.75 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.435 -0.79 . . . . 0.0 109.504 179.184 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . 0.4 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.0 p -95.3 155.76 16.6 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.137 -0.977 . . . . 0.0 110.92 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.6 m -73.96 -25.85 20.66 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.522 0 O-C-N 121.271 -0.893 . . . . 0.0 111.814 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -51.64 -48.0 63.52 Favored 'General case' 0 N--CA 1.515 2.815 0 O-C-N 120.835 -1.166 . . . . 0.0 110.04 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.442 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 30.9 p -137.85 -168.87 2.43 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.161 -0.962 . . . . 0.0 111.01 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -98.85 57.41 0.93 Allowed Glycine 0 N--CA 1.492 2.429 0 N-CA-C 107.633 -2.187 . . . . 0.0 107.633 178.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 19.8 t -97.51 141.2 30.85 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.421 -1.046 . . . . 0.0 109.744 -179.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.21 51.74 1.11 Allowed 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.312 -0.868 . . . . 0.0 109.506 179.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 68.77 98.16 0.04 OUTLIER Glycine 0 N--CA 1.488 2.1 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.8 p -109.6 129.42 55.59 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.213 -1.169 . . . . 0.0 110.332 179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -145.51 147.65 32.36 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.18 -0.95 . . . . 0.0 110.212 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.49 -48.28 3.47 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.206 -0.933 . . . . 0.0 110.735 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 37.5 p -51.32 -37.24 46.61 Favored 'General case' 0 N--CA 1.515 2.783 0 O-C-N 121.027 -1.045 . . . . 0.0 110.878 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 62.7 m-20 . . . . . 0 N--CA 1.495 1.815 0 CA-C-O 117.969 -1.015 . . . . 0.0 110.156 179.942 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.319 0 N-CA-C 109.489 -1.445 . . . . 0.0 109.489 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -79.27 -110.28 0.23 Allowed Glycine 0 N--CA 1.492 2.426 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.4 t -119.04 150.59 49.11 Favored Pre-proline 0 N--CA 1.494 1.759 0 O-C-N 121.208 -1.172 . . . . 0.0 110.222 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.59 174.72 11.24 Favored 'Trans proline' 0 C--N 1.316 -1.142 0 O-C-N 123.436 1.229 . . . . 0.0 110.388 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 12.7 mtp180 -132.9 118.89 19.47 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.067 -1.02 . . . . 0.0 110.258 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.8 mp -128.88 71.6 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 O-C-N 121.258 -0.901 . . . . 0.0 109.849 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -158.59 174.53 14.92 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.186 -0.946 . . . . 0.0 110.811 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.7 t -144.42 59.07 1.33 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.153 -0.967 . . . . 0.0 110.41 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.8 ttm-85 59.97 113.51 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.148 -0.97 . . . . 0.0 110.718 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 13.4 mtp85 -107.6 159.83 16.15 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.055 -1.028 . . . . 0.0 110.116 179.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -116.38 -60.92 1.8 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.211 -0.931 . . . . 0.0 110.261 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.7 mtmp? -145.24 143.04 19.13 Favored Pre-proline 0 N--CA 1.495 1.789 0 O-C-N 121.127 -0.983 . . . . 0.0 110.392 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -74.89 158.24 42.73 Favored 'Trans proline' 0 C--N 1.318 -1.041 0 O-C-N 123.326 1.171 . . . . 0.0 110.484 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.443 ' HB3' ' CH2' ' A' ' 80' ' ' TRP . . . 61.31 152.49 0.1 Allowed Pre-proline 0 N--CA 1.501 2.124 0 O-C-N 121.324 -0.86 . . . . 0.0 110.573 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -71.15 163.46 39.12 Favored 'Trans proline' 0 C--N 1.317 -1.113 0 O-C-N 123.309 1.162 . . . . 0.0 110.734 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -48.18 -32.51 7.14 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 121.479 -0.763 . . . . 0.0 111.358 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -54.37 -34.16 54.02 Favored Glycine 0 N--CA 1.497 2.744 0 O-C-N 120.984 -1.072 . . . . 0.0 110.431 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -54.46 -31.88 56.51 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.985 -1.303 . . . . 0.0 110.843 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.17 -37.73 64.78 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.02 -1.05 . . . . 0.0 110.272 179.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.7 mmmm -58.02 -35.78 71.76 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.232 -0.917 . . . . 0.0 110.342 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pt -117.97 36.37 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.047 0 O-C-N 121.208 -0.933 . . . . 0.0 110.473 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.436 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -83.84 -43.64 0.79 Allowed Pre-proline 0 N--CA 1.508 2.448 0 O-C-N 120.998 -1.064 . . . . 0.0 113.132 -179.165 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.436 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.7 Cg_endo -76.66 -35.97 1.81 Allowed 'Trans proline' 0 N--CA 1.486 1.043 0 O-C-N 122.584 0.781 . . . . 0.0 111.869 -178.263 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 61.8 m -61.48 -47.16 86.92 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 120.893 -1.129 . . . . 0.0 110.015 -179.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.9 mt -61.19 -38.07 85.21 Favored 'General case' 0 N--CA 1.509 2.487 0 C-N-CA 119.476 -0.89 . . . . 0.0 109.701 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.7 m -56.88 -35.43 68.93 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.07 -1.018 . . . . 0.0 110.278 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -56.82 -37.64 71.51 Favored 'General case' 0 N--CA 1.512 2.653 0 O-C-N 121.125 -0.985 . . . . 0.0 110.192 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.424 ' CE2' ' HD3' ' A' ' 59' ' ' ARG . 21.7 m-85 -58.92 -40.28 84.11 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.134 -0.979 . . . . 0.0 110.17 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -60.86 -23.16 64.94 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.269 -0.895 . . . . 0.0 111.471 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 2.7 mp -81.14 -34.59 13.65 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.313 0 O-C-N 120.829 -1.169 . . . . 0.0 109.719 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 57.5 tp60 -81.24 -37.03 29.23 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.898 -1.127 . . . . 0.0 109.211 178.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.43 -32.43 64.38 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.115 -0.991 . . . . 0.0 110.12 178.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.7 ptm180 -69.92 -36.7 75.57 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 120.842 -1.161 . . . . 0.0 109.742 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -64.82 -39.78 94.14 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.081 -1.012 . . . . 0.0 109.504 179.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.409 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -68.97 -41.7 77.56 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.15 -0.969 . . . . 0.0 109.369 179.18 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 9.2 mm-40 -61.64 -34.34 75.52 Favored 'General case' 0 N--CA 1.506 2.343 0 C-N-CA 119.568 -0.853 . . . . 0.0 110.449 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.2 mttt -94.02 -36.16 12.27 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 120.991 -1.068 . . . . 0.0 110.921 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -57.53 -38.38 74.61 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.031 -1.043 . . . . 0.0 110.238 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.1 ttpt -56.28 -40.32 74.09 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.045 -1.034 . . . . 0.0 110.147 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 52.11 -173.18 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.995 -1.066 . . . . 0.0 110.849 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.6 p -114.99 109.8 18.65 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.263 -0.898 . . . . 0.0 110.121 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 55.3 tttt 52.75 82.84 0.07 Allowed 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.069 -1.019 . . . . 0.0 110.714 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 44.1 tp -144.19 -58.95 0.38 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.292 -0.88 . . . . 0.0 110.436 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -120.53 -165.77 1.24 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.155 -0.966 . . . . 0.0 110.309 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -116.87 42.09 2.57 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.119 -0.988 . . . . 0.0 110.19 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.9 mtpt -144.02 64.48 1.32 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.391 -0.818 . . . . 0.0 110.118 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 m -104.58 -48.15 3.88 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.23 -0.919 . . . . 0.0 110.576 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.5 m-80 -57.55 -39.0 75.69 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.12 -0.988 . . . . 0.0 110.186 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -64.63 -44.24 91.14 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.141 -0.974 . . . . 0.0 109.61 179.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.8 tp60 -64.17 -41.41 97.15 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.224 -0.923 . . . . 0.0 109.481 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.9 mt -61.08 -36.94 81.0 Favored 'General case' 0 N--CA 1.507 2.412 0 C-N-CA 119.487 -0.885 . . . . 0.0 110.044 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.441 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 53.6 m0 -58.51 -38.43 77.67 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 120.993 -1.067 . . . . 0.0 110.105 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -62.17 -30.13 70.84 Favored 'General case' 0 N--CA 1.505 2.315 0 C-N-CA 119.147 -1.021 . . . . 0.0 109.802 178.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.409 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 77.6 mt -71.21 -57.58 7.24 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.288 0 O-C-N 120.886 -1.134 . . . . 0.0 109.284 179.41 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 ptm -62.44 -30.0 70.91 Favored 'General case' 0 N--CA 1.508 2.466 0 C-N-CA 118.621 -1.232 . . . . 0.0 109.77 179.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -67.34 -38.34 84.7 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 120.808 -1.182 . . . . 0.0 109.116 178.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.419 HD23 ' CD2' ' A' ' 26' ' ' PHE . 10.9 mt -53.13 -31.02 40.14 Favored 'General case' 0 N--CA 1.511 2.608 0 O-C-N 121.028 -1.045 . . . . 0.0 110.248 179.002 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.454 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 5.3 t60 -56.48 -38.35 71.61 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.007 -1.058 . . . . 0.0 109.965 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.427 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 5.4 m170 -60.38 -50.59 73.0 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.122 -0.986 . . . . 0.0 109.284 179.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.6 tp60 -59.38 -34.83 72.9 Favored 'General case' 0 N--CA 1.507 2.394 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.402 178.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.424 ' HD3' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -66.52 -52.04 50.2 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.145 -0.972 . . . . 0.0 109.175 178.912 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.0 p -63.01 -38.37 90.91 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.208 -0.932 . . . . 0.0 109.2 179.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.428 ' O ' ' OG1' ' A' ' 65' ' ' THR . 1.5 ttt85 -64.59 -40.46 95.56 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.134 -0.979 . . . . 0.0 109.046 178.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -62.19 -51.28 68.44 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.194 -0.941 . . . . 0.0 109.284 179.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 78.8 mt -69.41 -39.27 78.56 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.439 0 C-N-CA 119.453 -0.899 . . . . 0.0 109.247 179.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 12.6 t80 -65.12 -43.12 93.03 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.249 -0.907 . . . . 0.0 109.162 179.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.428 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 88.4 m -60.88 -41.8 96.69 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.083 -1.01 . . . . 0.0 110.468 -179.53 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.407 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -83.35 -32.59 26.17 Favored 'General case' 0 N--CA 1.503 2.207 0 C-N-CA 118.887 -1.125 . . . . 0.0 112.541 -178.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.421 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 46.7 t80 -86.38 -32.24 21.06 Favored 'General case' 0 N--CA 1.512 2.666 0 O-C-N 120.605 -1.31 . . . . 0.0 111.851 -179.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -98.27 -19.09 18.02 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 120.814 -1.179 . . . . 0.0 112.622 -178.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 7.8 mtpt -121.18 -58.41 1.79 Allowed 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.501 -1.375 . . . . 0.0 110.916 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.9 ttm180 -64.71 -31.13 72.21 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.19 -0.944 . . . . 0.0 110.774 -179.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 57.93 43.16 21.82 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.814 -1.179 . . . . 0.0 110.019 -179.607 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.64 35.78 3.71 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.443 -0.785 . . . . 0.0 109.824 179.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.429 HG21 HD11 ' A' ' 73' ' ' ILE . 13.9 tt -154.52 162.67 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.26 -0.9 . . . . 0.0 109.98 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 4.6 t -109.31 146.46 34.29 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.128 -0.982 . . . . 0.0 110.192 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -45.03 -32.69 1.78 Allowed 'General case' 0 N--CA 1.516 2.851 0 O-C-N 121.316 -0.865 . . . . 0.0 111.728 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -61.53 -50.92 70.72 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 120.841 -1.162 . . . . 0.0 109.227 179.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 40.4 tp -66.8 -43.64 83.35 Favored 'General case' 0 N--CA 1.505 2.309 0 C-N-CA 119.252 -0.979 . . . . 0.0 108.46 178.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.421 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 16.9 t80 -60.38 -38.0 82.54 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.349 -0.844 . . . . 0.0 109.465 179.038 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -74.8 -41.91 59.08 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.028 -1.045 . . . . 0.0 108.891 178.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.443 ' CH2' ' HB3' ' A' ' 12' ' ' ALA . 88.6 t90 -58.99 -38.92 80.29 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.168 -0.958 . . . . 0.0 109.245 178.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.451 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 13.9 mt -65.58 -54.88 21.74 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.226 -0.921 . . . . 0.0 109.244 179.056 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -55.81 -27.43 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.512 0 O-C-N 121.077 -1.014 . . . . 0.0 110.751 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.6 ttpm? -87.77 -21.99 24.81 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 120.943 -1.098 . . . . 0.0 111.582 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.427 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 27.4 mm-40 -99.87 23.44 9.73 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.684 -1.26 . . . . 0.0 111.866 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.412 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 7.8 ttpt 75.99 72.49 0.08 Allowed 'General case' 0 N--CA 1.512 2.64 0 O-C-N 121.177 -0.952 . . . . 0.0 111.743 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.451 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 32.0 m-85 -134.54 -62.55 0.74 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.516 -0.74 . . . . 0.0 109.218 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -129.67 -179.7 5.33 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.424 -0.798 . . . . 0.0 109.6 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.454 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 7.3 t0 -131.09 127.82 38.95 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.075 -1.016 . . . . 0.0 110.627 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 8.9 mttp -75.09 -37.44 61.54 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.242 -0.911 . . . . 0.0 109.835 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.8 tp -60.27 -42.33 95.18 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.079 -1.013 . . . . 0.0 109.932 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.405 HD21 ' CD2' ' A' ' 57' ' ' HIS . 53.6 tp -69.02 -50.05 52.2 Favored 'General case' 0 N--CA 1.505 2.277 0 C-N-CA 119.151 -1.02 . . . . 0.0 108.849 179.24 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.46 HG22 HD13 ' A' ' 92' ' ' ILE . 60.7 mt -59.37 -36.56 64.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.426 0 C-N-CA 119.142 -1.023 . . . . 0.0 108.693 178.282 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.88 -39.32 90.58 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.145 -0.972 . . . . 0.0 109.068 178.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.411 ' HD2' ' CE1' ' A' ' 100' ' ' TYR . 9.8 mmtm -57.1 -45.3 83.49 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.105 -0.997 . . . . 0.0 109.268 179.142 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.7 m0 -62.62 -36.68 83.57 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.402 -0.811 . . . . 0.0 110.003 179.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.59 -33.4 60.58 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.063 -1.023 . . . . 0.0 110.649 179.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.6 mmtt -53.65 -176.99 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.743 0 O-C-N 121.032 -1.042 . . . . 0.0 110.613 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 31.2 m -103.14 133.52 48.11 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.26 -0.9 . . . . 0.0 109.748 179.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.84 11.29 53.71 Favored Glycine 0 N--CA 1.494 2.52 0 C-N-CA 120.233 -0.984 . . . . 0.0 111.043 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.411 ' CE1' ' HD2' ' A' ' 94' ' ' LYS . 53.6 m-85 -118.71 71.02 0.83 Allowed 'General case' 0 N--CA 1.494 1.731 0 CA-C-N 119.463 1.631 . . . . 0.0 109.68 179.6 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -98.23 -33.87 10.94 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.065 -1.022 . . . . 0.0 111.336 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.58 60.59 1.08 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.99 -1.069 . . . . 0.0 111.088 -179.321 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.4 pp -108.91 151.76 25.84 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.906 -1.121 . . . . 0.0 109.618 179.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.427 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.5 p -112.72 -28.1 7.91 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.173 -0.954 . . . . 0.0 113.521 -178.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.555 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.7 m -144.05 -168.5 2.88 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 120.094 -1.629 . . . . 0.0 109.955 179.217 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 12.5 mt -95.62 -38.76 10.24 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.219 -0.926 . . . . 0.0 109.884 178.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 32.6 ttm-85 -102.22 29.63 5.01 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.032 -1.042 . . . . 0.0 110.129 178.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.555 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.8 t -127.67 17.23 6.91 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.053 -1.03 . . . . 0.0 108.935 -179.533 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.1 pt -158.07 38.68 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.264 0 O-C-N 120.863 -1.148 . . . . 0.0 110.179 -178.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.427 ' O ' ' OG1' ' A' ' 119' ' ' THR . 7.8 mt-30 -94.48 96.62 9.61 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.884 -1.135 . . . . 0.0 110.829 -178.756 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -110.01 -57.14 2.23 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.236 -0.915 . . . . 0.0 110.012 179.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 52.08 -174.14 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.025 -1.047 . . . . 0.0 110.903 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -117.47 40.8 2.97 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.211 -0.931 . . . . 0.0 110.215 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.78 -174.53 3.39 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.137 -0.977 . . . . 0.0 110.042 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -116.37 44.93 1.88 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.162 -0.961 . . . . 0.0 110.209 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -121.4 142.13 50.3 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.235 -0.915 . . . . 0.0 110.21 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 65.18 -163.37 38.43 Favored Glycine 0 N--CA 1.494 2.511 0 N-CA-C 109.471 -1.451 . . . . 0.0 109.471 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 29.4 m -144.34 170.97 15.0 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.209 -1.171 . . . . 0.0 110.398 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.427 ' OG1' ' O ' ' A' ' 110' ' ' GLN . 1.5 m -116.76 171.37 7.93 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.155 -0.966 . . . . 0.0 110.155 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 48.8 t -94.48 154.17 17.55 Favored 'General case' 0 N--CA 1.495 1.807 0 C-N-CA 119.505 -0.878 . . . . 0.0 108.853 178.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.456 ' CD1' ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -74.9 -31.2 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.445 0 O-C-N 121.051 -1.03 . . . . 0.0 111.606 -178.803 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.49 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.2 p -59.12 -35.73 73.97 Favored 'General case' 0 N--CA 1.512 2.625 0 O-C-N 120.663 -1.273 . . . . 0.0 110.594 -179.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 13.4 ttt-85 -57.31 -33.34 67.58 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.997 -1.065 . . . . 0.0 109.979 178.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.3 t -79.58 123.97 83.95 Favored Pre-proline 0 N--CA 1.506 2.372 0 O-C-N 121.092 -1.005 . . . . 0.0 110.117 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -67.01 178.72 2.72 Favored 'Trans proline' 0 N--CA 1.489 1.212 0 O-C-N 123.164 1.086 . . . . 0.0 110.801 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 25.1 mmm-85 -75.14 -37.39 61.4 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.238 -0.914 . . . . 0.0 110.422 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.36 -40.91 79.07 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.048 -1.033 . . . . 0.0 110.062 -179.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -69.64 -41.95 74.9 Favored 'General case' 0 N--CA 1.504 2.267 0 C-N-CA 119.31 -0.956 . . . . 0.0 109.193 179.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 5.5 mt -66.56 -39.1 88.36 Favored 'General case' 0 N--CA 1.504 2.269 0 C-N-CA 119.41 -0.916 . . . . 0.0 109.422 178.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -60.86 -38.54 85.94 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.168 -0.957 . . . . 0.0 109.936 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -59.64 -38.98 82.85 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.163 -0.96 . . . . 0.0 110.203 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -61.54 -46.46 89.85 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.126 -0.984 . . . . 0.0 109.722 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.12 -43.88 97.86 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.209 -0.932 . . . . 0.0 109.651 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.29 -32.65 70.24 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.171 -0.955 . . . . 0.0 110.358 179.533 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 40.4 mttt -80.72 -30.03 36.3 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.988 -1.07 . . . . 0.0 111.136 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 46.5 mttt -99.05 25.04 7.09 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 120.817 -1.177 . . . . 0.0 111.593 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.16 46.97 50.78 Favored Glycine 0 N--CA 1.5 2.951 0 O-C-N 120.702 -1.249 . . . . 0.0 110.82 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.6 t -149.54 -165.65 2.34 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.114 -1.227 . . . . 0.0 110.604 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -133.64 153.38 51.72 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.179 -0.951 . . . . 0.0 110.396 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.8 p -133.21 161.57 41.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 121.215 -0.928 . . . . 0.0 110.161 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 34.3 t -167.43 99.1 0.5 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.195 -0.94 . . . . 0.0 111.149 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.49 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 81.5 t80 -103.49 160.06 15.05 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.184 -0.947 . . . . 0.0 110.67 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 6.5 m80 -138.23 -60.3 0.62 Allowed 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -143.97 148.69 35.67 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.446 -0.784 . . . . 0.0 109.184 178.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . 0.403 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.8 p -90.21 154.35 19.81 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.997 -1.064 . . . . 0.0 111.131 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.7 p -73.01 -24.71 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.457 0 C-N-CA 119.788 -0.765 . . . . 0.0 111.474 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -49.9 -60.54 2.82 Favored 'General case' 0 N--CA 1.516 2.871 0 O-C-N 120.933 -1.104 . . . . 0.0 110.047 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.441 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.7 p -126.41 -164.7 1.36 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.313 -0.867 . . . . 0.0 110.291 179.262 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . 0.412 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -101.34 65.72 0.49 Allowed Glycine 0 N--CA 1.493 2.481 0 N-CA-C 107.831 -2.108 . . . . 0.0 107.831 178.296 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 31.8 t -103.64 142.78 33.72 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.397 -1.06 . . . . 0.0 109.965 -178.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 26.4 mtt-85 -98.55 49.04 0.98 Allowed 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.247 -0.908 . . . . 0.0 109.42 179.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 71.56 99.01 0.06 OUTLIER Glycine 0 N--CA 1.486 2.007 0 N-CA-C 109.749 -1.34 . . . . 0.0 109.749 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 p -110.63 126.02 54.04 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.31 -1.112 . . . . 0.0 110.335 179.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -146.3 146.42 30.7 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.087 -1.008 . . . . 0.0 110.141 -179.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -103.02 -46.9 4.51 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.171 -0.955 . . . . 0.0 110.506 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 1.8 m -63.86 -40.51 96.73 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.056 -1.027 . . . . 0.0 110.012 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 . . . . . 0 N--CA 1.495 1.824 0 CA-C-O 118.039 -0.981 . . . . 0.0 110.56 179.947 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.235 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 120.41 -102.16 0.85 Allowed Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 35.4 p -129.96 163.01 50.25 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.207 -1.172 . . . . 0.0 110.288 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.88 117.44 5.12 Favored 'Trans proline' 0 C--N 1.317 -1.092 0 O-C-N 123.399 1.21 . . . . 0.0 110.49 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.88 53.04 1.22 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.126 -0.984 . . . . 0.0 110.051 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 69.7 mt -117.5 161.38 16.36 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.236 -0.915 . . . . 0.0 110.068 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.8 mmtp -132.36 133.95 44.58 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.205 -0.934 . . . . 0.0 110.17 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.7 t -149.16 -171.06 3.79 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.151 -0.968 . . . . 0.0 110.576 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 82.4 mtt85 -115.72 86.0 2.39 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.245 -0.909 . . . . 0.0 110.068 179.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.1 mmt85 -99.97 -39.65 8.04 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.159 -0.963 . . . . 0.0 110.791 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.3 t -111.33 158.48 18.99 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 120.989 -1.069 . . . . 0.0 110.399 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.06 162.91 53.92 Favored Pre-proline 0 N--CA 1.495 1.822 0 O-C-N 121.166 -0.959 . . . . 0.0 110.219 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.11 157.69 56.94 Favored 'Trans proline' 0 C--N 1.316 -1.134 0 O-C-N 123.42 1.221 . . . . 0.0 110.717 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.425 ' HB3' ' CE3' ' A' ' 80' ' ' TRP . . . 62.52 142.33 0.06 OUTLIER Pre-proline 0 N--CA 1.502 2.158 0 O-C-N 121.332 -0.855 . . . . 0.0 110.704 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -73.97 162.5 38.98 Favored 'Trans proline' 0 C--N 1.318 -1.038 0 O-C-N 123.152 1.08 . . . . 0.0 110.599 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -49.26 -31.68 9.34 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 121.351 -0.843 . . . . 0.0 111.329 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.04 -33.95 45.55 Favored Glycine 0 N--CA 1.498 2.808 0 O-C-N 120.961 -1.087 . . . . 0.0 110.695 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -54.65 -32.92 59.92 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 120.862 -1.375 . . . . 0.0 110.734 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -54.33 -38.16 65.69 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 121.083 -1.011 . . . . 0.0 110.256 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -58.15 -35.07 70.99 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.294 -0.879 . . . . 0.0 110.341 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pt -117.62 35.71 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.157 -0.965 . . . . 0.0 110.604 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.427 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -83.36 -43.73 0.84 Allowed Pre-proline 0 N--CA 1.509 2.492 0 O-C-N 121.037 -1.039 . . . . 0.0 113.186 -179.286 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.9 Cg_endo -75.48 -36.9 2.03 Favored 'Trans proline' 0 N--CA 1.486 1.087 0 O-C-N 122.656 0.819 . . . . 0.0 111.666 -178.151 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 69.9 m -61.04 -44.91 96.69 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 121.036 -1.04 . . . . 0.0 109.879 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.412 HD23 ' CD2' ' A' ' 86' ' ' TYR . 2.5 mt -62.77 -38.31 90.12 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.428 -0.909 . . . . 0.0 109.676 179.461 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.8 m -56.85 -35.04 68.4 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.096 -1.002 . . . . 0.0 110.371 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -56.9 -38.68 73.17 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.054 -1.029 . . . . 0.0 110.001 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.427 ' CD2' ' HD2' ' A' ' 59' ' ' ARG . 22.3 m-85 -59.05 -40.08 84.02 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.228 -0.92 . . . . 0.0 110.028 179.678 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -61.05 -22.59 64.72 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.266 -0.896 . . . . 0.0 111.501 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 2.9 mp -80.84 -36.1 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.465 0 O-C-N 120.836 -1.165 . . . . 0.0 109.571 179.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -80.77 -37.11 30.92 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.028 -1.045 . . . . 0.0 108.9 178.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.21 -33.51 67.67 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.18 -0.95 . . . . 0.0 110.135 178.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.0 ptm180 -70.71 -37.3 73.52 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.884 -1.135 . . . . 0.0 109.791 179.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.1 -39.14 92.74 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.04 -1.038 . . . . 0.0 109.54 179.199 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.402 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -66.65 -40.77 88.82 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.218 -0.927 . . . . 0.0 109.516 179.344 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -59.14 -35.77 74.07 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.213 -0.93 . . . . 0.0 110.475 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.9 mttt -94.96 -36.17 11.69 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 121.068 -1.02 . . . . 0.0 110.925 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -57.09 -37.37 71.82 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.007 -1.058 . . . . 0.0 110.379 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -56.61 -39.79 74.21 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.028 -1.045 . . . . 0.0 110.368 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.2 m 52.52 -166.25 0.06 Allowed 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.002 -1.061 . . . . 0.0 110.715 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.2 t -142.87 121.89 12.84 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.202 -0.936 . . . . 0.0 110.291 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.6 tmtm? 52.34 66.27 1.26 Allowed 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.07 -1.019 . . . . 0.0 110.866 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 tt -144.58 -59.14 0.37 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.094 -1.004 . . . . 0.0 110.29 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -130.29 -164.9 1.47 Allowed 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.189 -0.944 . . . . 0.0 110.088 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -113.52 -170.17 1.64 Allowed 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.207 -0.933 . . . . 0.0 110.176 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt 53.06 47.31 24.87 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.123 -0.985 . . . . 0.0 110.742 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -97.32 -39.48 9.2 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.219 -0.925 . . . . 0.0 110.655 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -57.35 -36.54 71.32 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.112 -0.993 . . . . 0.0 110.34 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.419 ' HA ' ' CE3' ' A' ' 50' ' ' TRP . 16.9 mt-10 -58.11 -39.77 79.51 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.137 -0.977 . . . . 0.0 110.201 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 43.4 tp60 -63.22 -43.05 99.21 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.385 -0.926 . . . . 0.0 109.643 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -58.76 -37.78 77.02 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.109 -0.995 . . . . 0.0 110.166 179.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.437 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.8 m0 -59.81 -37.54 79.44 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.17 -0.956 . . . . 0.0 109.955 179.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -60.65 -29.77 69.48 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.012 -1.055 . . . . 0.0 109.705 178.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.402 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 77.2 mt -70.63 -60.42 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.289 0 O-C-N 121.024 -1.048 . . . . 0.0 108.918 179.157 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.6 ptm -61.24 -29.94 70.14 Favored 'General case' 0 N--CA 1.509 2.478 0 C-N-CA 118.691 -1.204 . . . . 0.0 109.778 178.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -68.06 -37.6 81.49 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.909 -1.12 . . . . 0.0 109.208 178.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.41 HD22 ' CE2' ' A' ' 26' ' ' PHE . 11.4 mt -53.22 -33.26 52.1 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.959 -1.088 . . . . 0.0 110.211 179.069 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.444 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 8.2 t60 -55.12 -36.79 66.1 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.057 -1.027 . . . . 0.0 110.178 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.427 ' NE2' HD22 ' A' ' 91' ' ' LEU . 5.8 m170 -59.86 -49.62 77.0 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.086 -1.008 . . . . 0.0 109.365 179.167 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 -61.06 -37.7 83.57 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.324 -0.95 . . . . 0.0 109.17 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.427 ' HD2' ' CD2' ' A' ' 26' ' ' PHE . 6.9 mtp85 -62.23 -49.16 76.83 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.213 -0.929 . . . . 0.0 109.167 178.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 87.5 p -63.34 -39.02 93.39 Favored 'General case' 0 N--CA 1.504 2.233 0 C-N-CA 119.415 -0.914 . . . . 0.0 109.257 179.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.414 ' O ' ' OG1' ' A' ' 65' ' ' THR . 33.6 ttp85 -64.67 -40.49 95.51 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.145 -0.972 . . . . 0.0 109.117 178.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -63.05 -50.88 68.88 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.192 -0.942 . . . . 0.0 109.319 179.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.407 HG21 HD12 ' A' ' 63' ' ' ILE . 84.0 mt -69.65 -38.16 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.436 0 C-N-CA 119.386 -0.926 . . . . 0.0 109.341 179.27 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 12.4 t80 -66.42 -42.83 87.18 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.103 -0.998 . . . . 0.0 108.989 179.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.414 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 91.2 m -60.83 -40.64 93.55 Favored 'General case' 0 N--CA 1.502 2.173 0 C-N-CA 119.335 -0.946 . . . . 0.0 110.482 -179.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.404 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -83.22 -34.55 25.85 Favored 'General case' 0 N--CA 1.504 2.245 0 C-N-CA 118.796 -1.162 . . . . 0.0 112.54 -178.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.417 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 33.5 t80 -86.52 -32.2 20.87 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 120.622 -1.299 . . . . 0.0 112.184 -179.212 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -98.35 -18.06 18.52 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.774 -1.203 . . . . 0.0 113.152 -178.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.6 mtpp -115.85 -57.24 2.25 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 120.46 -1.4 . . . . 0.0 110.993 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.5 mtt85 -76.02 -30.11 58.35 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.173 -0.954 . . . . 0.0 110.761 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.3 tptt 59.96 45.08 12.65 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 120.827 -1.17 . . . . 0.0 109.969 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -107.68 34.97 3.27 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.372 -0.83 . . . . 0.0 109.48 178.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.406 HD13 HG22 ' A' ' 73' ' ' ILE . 13.0 tt -151.82 162.68 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.239 -0.913 . . . . 0.0 109.742 -179.683 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 78.3 p -107.23 145.52 32.57 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.088 -1.008 . . . . 0.0 110.02 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -45.36 -32.84 2.23 Favored 'General case' 0 N--CA 1.518 2.932 0 O-C-N 121.328 -0.858 . . . . 0.0 111.455 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -60.94 -48.69 80.66 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 120.93 -1.106 . . . . 0.0 109.32 179.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 47.3 tp -68.26 -44.41 75.68 Favored 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 119.171 -1.011 . . . . 0.0 108.337 178.532 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.417 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 15.3 t80 -59.51 -37.29 77.92 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.389 -0.819 . . . . 0.0 109.557 179.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -76.08 -41.67 49.81 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.125 -0.985 . . . . 0.0 108.842 178.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.429 ' CE2' ' HG3' ' A' ' 84' ' ' GLU . 82.9 t90 -58.82 -37.96 77.56 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.135 -0.978 . . . . 0.0 109.198 178.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.442 HD22 ' CD2' ' A' ' 86' ' ' TYR . 11.9 mt -66.95 -58.04 5.75 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.223 -0.923 . . . . 0.0 108.984 178.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -56.19 -27.19 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 121.223 -0.923 . . . . 0.0 110.767 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.6 ttpm? -89.13 -16.69 30.85 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 120.915 -1.115 . . . . 0.0 111.905 179.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.429 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 43.4 mm-40 -105.46 25.63 10.47 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 120.622 -1.299 . . . . 0.0 111.982 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.403 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 0.8 OUTLIER 76.47 68.37 0.06 Allowed 'General case' 0 N--CA 1.512 2.67 0 O-C-N 121.265 -0.897 . . . . 0.0 111.959 179.413 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.442 ' CD2' HD22 ' A' ' 81' ' ' LEU . 27.3 m-85 -131.12 -62.71 0.88 Allowed 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -134.84 168.4 19.12 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.476 -0.765 . . . . 0.0 109.303 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.444 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 15.3 t0 -116.09 109.92 18.16 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.093 -1.004 . . . . 0.0 110.555 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.8 mttt -58.95 -38.04 78.12 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.208 -0.933 . . . . 0.0 109.927 179.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 18.0 tp -58.51 -38.22 77.22 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.131 -0.981 . . . . 0.0 110.033 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.427 HD22 ' NE2' ' A' ' 57' ' ' HIS . 58.4 tp -69.46 -47.23 64.64 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 120.996 -1.065 . . . . 0.0 108.856 179.299 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.426 HG23 HD12 ' A' ' 92' ' ' ILE . 72.8 mt -59.65 -39.16 78.85 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.42 0 O-C-N 121.155 -0.966 . . . . 0.0 108.527 178.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.17 -39.68 93.24 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.139 -0.976 . . . . 0.0 109.196 178.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 6.1 mmtm -56.74 -41.82 78.19 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.069 -1.019 . . . . 0.0 109.578 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.4 m0 -64.48 -33.65 76.37 Favored 'General case' 0 N--CA 1.507 2.41 0 C-N-CA 119.514 -0.875 . . . . 0.0 110.355 179.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -81.81 -34.51 30.23 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.089 -1.007 . . . . 0.0 110.586 179.523 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 25.3 mmtt -50.72 175.11 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.787 0 O-C-N 120.973 -1.079 . . . . 0.0 110.833 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 13.1 t -100.65 141.39 33.59 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.181 -0.949 . . . . 0.0 109.695 179.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.72 -24.96 30.09 Favored Glycine 0 N--CA 1.494 2.556 0 C-N-CA 119.888 -1.149 . . . . 0.0 110.523 -179.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -91.82 58.11 3.36 Favored 'General case' 0 N--CA 1.503 2.206 0 CA-C-N 119.171 1.486 . . . . 0.0 110.225 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -71.96 -37.19 69.98 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.029 -1.044 . . . . 0.0 110.141 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -124.81 85.38 2.4 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.127 -0.983 . . . . 0.0 110.361 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -126.05 150.1 48.38 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.149 -0.97 . . . . 0.0 110.35 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.426 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 27.0 p -114.37 -31.35 6.29 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.227 -0.92 . . . . 0.0 113.144 -179.651 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.558 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.0 m -142.59 -167.94 2.63 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.171 -1.581 . . . . 0.0 109.928 179.215 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 15.3 mt -96.09 -39.56 9.66 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.266 -0.896 . . . . 0.0 109.943 179.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 46.7 ttt-85 -101.98 29.68 4.89 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 120.961 -1.087 . . . . 0.0 110.134 178.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.558 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.296 1.8 t -126.07 16.63 7.88 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.025 -1.047 . . . . 0.0 108.925 -179.784 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.5 pt -156.29 34.56 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.17 0 O-C-N 120.791 -1.193 . . . . 0.0 110.776 -178.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -156.52 160.47 39.53 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 120.795 -1.191 . . . . 0.0 111.122 -179.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.437 ' HB3' ' OG1' ' A' ' 119' ' ' THR . 0.0 OUTLIER -116.81 -174.51 2.59 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.214 -0.929 . . . . 0.0 110.361 179.945 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 27.9 t30 -125.77 -57.66 1.43 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.248 -0.908 . . . . 0.0 110.364 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -140.79 -163.56 1.56 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.111 -0.993 . . . . 0.0 110.072 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -94.98 -42.13 8.8 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.125 -0.984 . . . . 0.0 109.916 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -118.34 39.22 3.49 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.15 -0.969 . . . . 0.0 110.113 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -165.75 49.87 0.09 Allowed 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.167 -0.958 . . . . 0.0 110.797 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 139.03 154.73 6.46 Favored Glycine 0 N--CA 1.493 2.455 0 N-CA-C 109.396 -1.482 . . . . 0.0 109.396 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 11.1 m -145.2 -166.12 2.34 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.208 -1.172 . . . . 0.0 110.406 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.437 ' OG1' ' HB3' ' A' ' 111' ' ' LYS . 0.2 OUTLIER -111.32 155.32 23.24 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.263 -0.898 . . . . 0.0 109.983 179.871 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 41.6 t -62.56 152.93 33.49 Favored 'General case' 0 N--CA 1.505 2.275 0 C-N-CA 118.962 -1.095 . . . . 0.0 108.985 179.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.448 ' CG2' ' CE1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -75.57 -36.1 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 121.022 -1.049 . . . . 0.0 111.39 -178.803 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.484 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 10.8 p -53.46 -32.34 49.6 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 120.785 -1.197 . . . . 0.0 111.362 -178.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.91 -34.28 73.0 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 120.842 -1.161 . . . . 0.0 109.526 178.316 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 56.1 t -82.34 125.42 76.62 Favored Pre-proline 0 N--CA 1.503 2.22 0 O-C-N 121.053 -1.03 . . . . 0.0 109.647 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -65.56 179.85 1.51 Allowed 'Trans proline' 0 N--CA 1.489 1.226 0 O-C-N 123.159 1.084 . . . . 0.0 110.721 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 2.6 tpp85 -75.18 -35.93 61.52 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.201 -0.937 . . . . 0.0 110.953 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.42 -47.38 86.35 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.023 -1.048 . . . . 0.0 109.797 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -64.62 -41.53 96.13 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.219 -0.926 . . . . 0.0 109.263 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 52.3 mt -62.59 -39.26 93.18 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.285 -0.884 . . . . 0.0 109.672 179.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -59.26 -39.62 83.44 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.102 -0.999 . . . . 0.0 110.059 179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -57.98 -36.53 72.74 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.145 -0.972 . . . . 0.0 110.467 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -59.74 -39.55 85.13 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.169 -0.957 . . . . 0.0 110.27 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.89 -44.91 96.47 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.082 -1.011 . . . . 0.0 109.93 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 10.4 mmt85 -59.72 -38.78 82.62 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.142 -0.974 . . . . 0.0 109.886 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 76.1 mttt -58.9 -36.35 74.55 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.147 -0.971 . . . . 0.0 110.554 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 22.6 mtmt -107.37 21.53 17.36 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.002 -1.061 . . . . 0.0 111.797 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.76 46.04 60.18 Favored Glycine 0 N--CA 1.5 2.918 0 O-C-N 120.648 -1.282 . . . . 0.0 110.545 179.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.9 t -140.6 -165.18 1.88 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.105 -1.232 . . . . 0.0 110.154 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -127.41 173.59 9.69 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.154 -0.966 . . . . 0.0 110.354 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.2 p -159.1 160.71 1.8 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.975 0 O-C-N 121.225 -0.922 . . . . 0.0 110.774 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 28.3 t -168.95 85.18 0.15 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.215 -0.928 . . . . 0.0 110.995 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.484 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 50.9 t80 -95.61 160.92 14.27 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.243 -0.911 . . . . 0.0 110.538 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 38.0 m80 -140.49 -60.54 0.51 Allowed 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.007 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -131.78 151.83 51.39 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.404 -0.81 . . . . 0.0 109.095 178.84 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 28.8 p -95.57 153.65 17.6 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.027 -1.045 . . . . 0.0 110.96 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 27.3 m -71.98 -25.49 23.97 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.461 0 O-C-N 121.432 -0.793 . . . . 0.0 111.595 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -50.34 -61.67 2.04 Favored 'General case' 0 N--CA 1.514 2.748 0 O-C-N 120.888 -1.133 . . . . 0.0 110.336 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.437 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.3 p -124.56 -164.46 1.27 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.183 -0.948 . . . . 0.0 110.544 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.0 60.45 0.72 Allowed Glycine 0 N--CA 1.492 2.431 0 N-CA-C 108.13 -1.988 . . . . 0.0 108.13 178.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 28.4 t -102.26 142.44 33.48 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.333 -1.098 . . . . 0.0 109.818 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 6.2 mtt85 -99.04 49.04 0.96 Allowed 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.272 -0.892 . . . . 0.0 109.613 179.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 73.15 96.55 0.08 OUTLIER Glycine 0 N--CA 1.488 2.163 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.0 p -108.68 126.22 52.74 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.205 -1.174 . . . . 0.0 110.32 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -152.77 148.93 27.81 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.098 -1.001 . . . . 0.0 110.467 -179.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 3.5 m -97.16 -38.35 9.75 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.328 -0.857 . . . . 0.0 110.572 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 5.5 m -55.05 -38.9 68.59 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 120.993 -1.067 . . . . 0.0 110.511 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.494 1.74 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.239 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.331 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 69.16 68.08 1.75 Allowed Glycine 0 N--CA 1.493 2.449 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -142.29 173.01 5.07 Favored Pre-proline 0 N--CA 1.494 1.736 0 O-C-N 121.231 -1.158 . . . . 0.0 110.214 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -72.19 -38.34 3.85 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.431 1.227 . . . . 0.0 110.672 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 16.5 ttt-85 53.69 88.59 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.076 -1.015 . . . . 0.0 110.689 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.0 pt -139.27 -172.78 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.189 -0.945 . . . . 0.0 110.264 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -130.28 105.01 7.62 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.132 -0.98 . . . . 0.0 110.233 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.0 p -120.2 -176.67 3.25 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.194 -0.941 . . . . 0.0 110.218 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.0 ttt85 -120.96 147.4 45.52 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.214 -0.929 . . . . 0.0 110.211 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.5 mtt85 -117.92 -174.92 2.73 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.235 -0.916 . . . . 0.0 110.249 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.42 ' OG ' ' N ' ' A' ' 10' ' ' LYS . 81.7 p -139.67 -62.38 0.52 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.171 -0.956 . . . . 0.0 110.197 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.42 ' N ' ' OG ' ' A' ' 9' ' ' SER . 5.2 mptt -129.08 82.93 67.5 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.217 -0.927 . . . . 0.0 110.209 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -73.84 159.77 44.59 Favored 'Trans proline' 0 C--N 1.317 -1.108 0 O-C-N 123.393 1.207 . . . . 0.0 110.696 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.447 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -67.83 135.72 92.24 Favored Pre-proline 0 N--CA 1.512 2.631 0 C-N-CA 119.511 -0.876 . . . . 0.0 109.009 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -84.36 82.68 1.8 Allowed 'Trans proline' 0 C--N 1.32 -0.922 0 O-C-N 123.129 1.068 . . . . 0.0 112.422 -178.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 48.73 92.67 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.258 -0.901 . . . . 0.0 111.737 178.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.73 -39.05 0.51 Allowed Glycine 0 N--CA 1.499 2.886 0 C-N-CA 119.792 -1.194 . . . . 0.0 110.538 179.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -57.03 -29.74 63.63 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.063 -1.257 . . . . 0.0 110.462 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -52.86 -34.53 54.84 Favored 'General case' 0 N--CA 1.511 2.608 0 O-C-N 120.889 -1.132 . . . . 0.0 110.156 179.259 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.1 mtpp -58.73 -38.61 78.75 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.181 -0.949 . . . . 0.0 110.144 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pt -116.74 36.58 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.17 -0.956 . . . . 0.0 110.43 179.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.423 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -84.08 -43.24 0.76 Allowed Pre-proline 0 N--CA 1.511 2.579 0 O-C-N 121.056 -1.028 . . . . 0.0 113.531 -178.804 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.2 Cg_endo -74.27 -34.55 4.66 Favored 'Trans proline' 0 N--CA 1.487 1.09 0 O-C-N 122.587 0.783 . . . . 0.0 112.043 -177.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.42 HG21 ' CE2' ' A' ' 62' ' ' TYR . 84.1 m -60.91 -43.56 98.4 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 120.973 -1.08 . . . . 0.0 110.071 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.46 -39.11 93.59 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.224 -0.923 . . . . 0.0 109.792 179.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -57.42 -35.04 69.55 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.102 -0.999 . . . . 0.0 110.29 179.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -57.31 -35.94 70.47 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.038 -1.039 . . . . 0.0 110.311 179.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.434 ' CD1' ' HD3' ' A' ' 59' ' ' ARG . 16.1 m-85 -57.67 -39.35 76.89 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.094 -1.003 . . . . 0.0 110.48 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -58.66 -39.69 81.36 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.223 -0.923 . . . . 0.0 110.487 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.1 mp -65.72 -41.1 89.68 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 C-N-CA 119.221 -0.992 . . . . 0.0 108.83 179.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -70.49 -49.59 46.81 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.198 -1.001 . . . . 0.0 108.619 178.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.84 -34.46 73.13 Favored 'General case' 0 N--CA 1.507 2.42 0 C-N-CA 119.376 -0.929 . . . . 0.0 109.558 178.508 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 3.7 mtt85 -56.91 -39.63 74.78 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.041 -1.037 . . . . 0.0 110.071 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.48 -47.86 77.37 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.206 -0.997 . . . . 0.0 109.754 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.406 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -69.6 -37.93 77.08 Favored 'General case' 0 N--CA 1.504 2.265 0 C-N-CA 119.225 -0.99 . . . . 0.0 109.512 179.121 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 13.5 mt-30 -66.63 -32.73 74.25 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.222 -0.924 . . . . 0.0 110.277 179.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.1 mttp -95.05 -35.03 12.09 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 120.962 -1.086 . . . . 0.0 110.921 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -56.4 -37.77 70.6 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 120.988 -1.07 . . . . 0.0 110.261 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -58.43 -50.62 73.05 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.15 -0.969 . . . . 0.0 110.075 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 52.05 -166.55 0.05 Allowed 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.094 -1.004 . . . . 0.0 110.754 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.6 m -117.99 103.05 9.54 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.161 -0.962 . . . . 0.0 110.208 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 46.6 mttm 52.71 61.54 3.14 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.082 -1.011 . . . . 0.0 110.807 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.5 tp -121.46 -57.59 1.82 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.085 -1.01 . . . . 0.0 110.32 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -125.88 -164.92 1.36 Allowed 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.155 -0.966 . . . . 0.0 110.271 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -112.45 -169.75 1.53 Allowed 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.218 -0.926 . . . . 0.0 110.154 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 48.5 tttt 53.0 50.15 18.59 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.062 -1.024 . . . . 0.0 110.609 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -97.04 -40.68 8.73 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.236 -0.915 . . . . 0.0 110.488 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -58.63 -39.67 81.16 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.109 -0.994 . . . . 0.0 110.048 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -62.73 -42.5 99.69 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.266 -0.896 . . . . 0.0 109.829 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 58.1 tp60 -60.42 -39.26 86.78 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.168 -0.957 . . . . 0.0 109.872 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -57.85 -38.43 75.65 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.122 -0.986 . . . . 0.0 110.062 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.431 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.1 m0 -58.01 -36.12 72.24 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.157 -0.964 . . . . 0.0 109.989 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -61.95 -29.28 70.13 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.064 -1.022 . . . . 0.0 109.79 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.406 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 22.1 mt -72.26 -59.28 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.201 0 O-C-N 120.942 -1.099 . . . . 0.0 109.181 179.429 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.6 ptm -58.85 -27.89 65.56 Favored 'General case' 0 N--CA 1.511 2.6 0 C-N-CA 118.45 -1.3 . . . . 0.0 109.827 178.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.5 mm100 -69.86 -37.66 76.18 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 120.823 -1.173 . . . . 0.0 109.05 177.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.41 HD23 ' CD2' ' A' ' 26' ' ' PHE . 11.2 mt -53.36 -32.61 50.09 Favored 'General case' 0 N--CA 1.512 2.65 0 O-C-N 120.951 -1.093 . . . . 0.0 110.128 179.007 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.436 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 23.0 t60 -55.83 -36.82 67.9 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.145 -0.972 . . . . 0.0 110.198 179.73 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.426 ' NE2' HD21 ' A' ' 91' ' ' LEU . 7.4 m170 -59.64 -48.9 79.86 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.095 -1.003 . . . . 0.0 109.387 179.237 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.2 tp60 -58.37 -34.19 70.42 Favored 'General case' 0 N--CA 1.508 2.435 0 C-N-CA 119.461 -0.896 . . . . 0.0 109.573 178.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.434 ' HD3' ' CD1' ' A' ' 26' ' ' PHE . 38.8 mmm-85 -64.77 -52.87 54.64 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.031 -1.043 . . . . 0.0 109.28 179.066 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 84.5 p -64.02 -40.04 95.44 Favored 'General case' 0 N--CA 1.503 2.187 0 C-N-CA 119.3 -0.96 . . . . 0.0 108.997 179.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.431 ' O ' ' OG1' ' A' ' 65' ' ' THR . 0.1 OUTLIER -63.11 -40.17 96.84 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.197 -0.939 . . . . 0.0 109.051 178.856 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.42 ' CE2' HG21 ' A' ' 22' ' ' THR . 30.5 t80 -63.58 -53.33 53.33 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.098 -1.001 . . . . 0.0 109.009 179.212 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 75.8 mt -65.64 -37.18 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.333 0 C-N-CA 119.223 -0.991 . . . . 0.0 109.19 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.421 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 8.1 t80 -66.03 -41.55 90.77 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.059 -1.026 . . . . 0.0 108.778 178.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.431 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 91.7 m -59.28 -41.44 88.92 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.211 -0.931 . . . . 0.0 110.806 -179.453 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.7 pp -83.06 -34.9 26.1 Favored 'General case' 0 N--CA 1.505 2.282 0 C-N-CA 118.764 -1.174 . . . . 0.0 112.823 -178.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.435 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 52.0 t80 -86.27 -32.02 21.32 Favored 'General case' 0 N--CA 1.514 2.751 0 O-C-N 120.564 -1.335 . . . . 0.0 111.961 -179.345 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.421 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 11.8 m-85 -97.05 -16.82 20.36 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 120.729 -1.232 . . . . 0.0 112.584 -178.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 5.8 mttt -124.74 -59.6 1.43 Allowed 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.495 -1.378 . . . . 0.0 110.996 179.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.2 ttt85 -59.94 -30.38 69.03 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.03 -1.044 . . . . 0.0 110.906 -179.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 27.2 tptt 57.1 41.2 27.69 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.803 -1.185 . . . . 0.0 110.131 -179.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.06 37.47 3.66 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.399 -0.813 . . . . 0.0 109.725 179.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.443 HG22 HD13 ' A' ' 73' ' ' ILE . 13.7 tt -154.23 162.77 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 121.249 -0.907 . . . . 0.0 109.904 -179.73 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 4.9 p -110.08 149.7 29.65 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.092 -1.005 . . . . 0.0 110.354 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 71.5 tttt -45.79 -32.35 2.5 Favored 'General case' 0 N--CA 1.515 2.799 0 O-C-N 121.338 -0.851 . . . . 0.0 111.596 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -65.49 -47.02 77.48 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 120.846 -1.159 . . . . 0.0 109.51 179.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.48 -41.61 84.27 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.183 -0.948 . . . . 0.0 108.727 179.02 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.435 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 14.6 t80 -67.85 -41.07 83.51 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.265 -0.897 . . . . 0.0 109.188 179.135 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -72.11 -40.7 67.98 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.19 -0.944 . . . . 0.0 108.795 178.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.447 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 80.5 t90 -55.11 -37.92 67.49 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.265 -0.897 . . . . 0.0 109.532 178.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.464 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 17.1 mt -69.69 -48.84 58.27 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 119.344 -0.942 . . . . 0.0 108.561 178.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.405 HG23 HD11 ' A' ' 82' ' ' ILE . 35.4 mm -57.4 -32.72 42.1 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.573 0 O-C-N 121.281 -0.887 . . . . 0.0 109.904 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.8 tttt -86.87 -23.9 25.09 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.952 -1.092 . . . . 0.0 111.589 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.413 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 16.7 mm-40 -97.39 19.4 13.31 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 120.707 -1.246 . . . . 0.0 111.948 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 28.2 tttt 73.38 80.53 0.13 Allowed 'General case' 0 N--CA 1.51 2.565 0 O-C-N 120.914 -1.116 . . . . 0.0 111.327 179.268 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.464 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 29.3 m-85 -137.24 -64.03 0.58 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.546 -0.722 . . . . 0.0 109.932 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -118.31 -172.55 2.29 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.419 -0.8 . . . . 0.0 109.593 179.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.436 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 7.1 t0 -122.56 102.77 8.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.058 -1.026 . . . . 0.0 110.373 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 12.0 mtpt -64.35 -40.19 95.38 Favored 'General case' 0 N--CA 1.508 2.429 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.63 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 32.4 tp -59.78 -37.21 78.44 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.23 -0.918 . . . . 0.0 110.056 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.426 HD21 ' NE2' ' A' ' 57' ' ' HIS . 34.3 tp -71.73 -48.16 48.86 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.005 -1.059 . . . . 0.0 108.756 179.142 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.412 HD13 HG21 ' A' ' 92' ' ' ILE . 50.7 mt -58.86 -36.19 60.01 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 C-N-CA 119.378 -0.929 . . . . 0.0 108.7 178.293 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.94 -39.48 83.44 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.128 -0.983 . . . . 0.0 109.062 178.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.402 ' HB3' ' CD2' ' A' ' 103' ' ' LEU . 7.1 mmtt -58.49 -44.35 89.34 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.139 -0.975 . . . . 0.0 109.364 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.412 ' CH2' HD21 ' A' ' 91' ' ' LEU . 7.8 m0 -65.72 -41.19 92.58 Favored 'General case' 0 N--CA 1.507 2.406 0 C-N-CA 119.557 -0.857 . . . . 0.0 109.506 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.71 -33.29 75.53 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.283 -0.885 . . . . 0.0 110.425 179.479 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.1 mmtp -54.31 -176.78 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.646 0 O-C-N 121.056 -1.028 . . . . 0.0 110.535 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 32.1 m -105.87 132.75 51.61 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.172 -0.955 . . . . 0.0 109.85 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 98.57 10.92 49.23 Favored Glycine 0 N--CA 1.492 2.427 0 C-N-CA 120.213 -0.994 . . . . 0.0 111.087 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -115.97 69.51 0.74 Allowed 'General case' 0 N--CA 1.495 1.778 0 CA-C-N 119.487 1.644 . . . . 0.0 110.117 179.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -92.08 -38.95 11.89 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.221 -0.924 . . . . 0.0 109.96 179.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -110.15 78.5 1.13 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.151 -0.968 . . . . 0.0 109.61 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.402 ' CD2' ' HB3' ' A' ' 94' ' ' LYS . 8.9 tp -122.23 137.87 54.69 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.242 -0.911 . . . . 0.0 109.823 -179.24 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.424 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 28.1 p -111.61 -38.6 4.86 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.234 -0.916 . . . . 0.0 112.483 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.598 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 6.9 m -138.76 -168.49 2.42 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.17 -1.581 . . . . 0.0 109.85 179.077 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 13.9 mt -97.48 -38.15 9.7 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.177 -0.952 . . . . 0.0 110.295 179.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -102.2 31.34 4.02 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 120.953 -1.092 . . . . 0.0 109.804 178.221 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.598 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.7 t -125.86 16.28 8.01 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.131 -0.981 . . . . 0.0 108.929 -179.592 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.402 ' CG2' ' O ' ' A' ' 108' ' ' CYS . 1.1 pt -159.01 38.01 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.38 0 O-C-N 120.922 -1.111 . . . . 0.0 110.4 -178.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.415 ' O ' ' OG1' ' A' ' 119' ' ' THR . 2.0 tt0 -117.86 134.54 54.83 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.739 -1.226 . . . . 0.0 111.698 -178.273 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.441 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 0.4 OUTLIER -138.73 155.56 48.12 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.372 -0.83 . . . . 0.0 110.122 179.357 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -135.95 165.9 24.59 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.171 -0.956 . . . . 0.0 110.185 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 52.86 -165.17 0.07 Allowed 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.035 -1.041 . . . . 0.0 110.55 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 31.8 m -109.29 110.76 22.03 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.085 -1.009 . . . . 0.0 109.989 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.5 m120 52.86 38.09 25.89 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.062 -1.024 . . . . 0.0 110.803 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -159.09 50.49 0.36 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.173 -0.954 . . . . 0.0 110.832 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -136.6 -158.0 7.9 Favored Glycine 0 N--CA 1.494 2.514 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 4.0 m -120.21 107.71 13.32 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.16 -1.2 . . . . 0.0 110.247 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.441 ' OG1' ' HA ' ' A' ' 111' ' ' LYS . 4.4 m -138.01 166.71 23.4 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.223 -0.923 . . . . 0.0 110.249 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 48.6 t -87.17 154.15 20.95 Favored 'General case' 0 N--CA 1.499 2.017 0 C-N-CA 119.499 -0.88 . . . . 0.0 109.202 179.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.447 ' CG2' ' CE1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -72.64 -36.11 52.46 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.433 0 O-C-N 121.16 -0.962 . . . . 0.0 111.012 -179.225 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.47 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 7.9 p -55.46 -34.32 64.42 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 120.846 -1.158 . . . . 0.0 110.911 -178.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 16.8 ttt-85 -59.32 -36.43 75.62 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 120.995 -1.066 . . . . 0.0 109.681 178.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 61.0 t -76.19 125.42 87.87 Favored Pre-proline 0 N--CA 1.504 2.24 0 O-C-N 121.171 -0.956 . . . . 0.0 109.795 179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -64.02 178.2 1.59 Allowed 'Trans proline' 0 N--CA 1.49 1.283 0 O-C-N 123.228 1.12 . . . . 0.0 110.791 179.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.09 -37.27 61.61 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.22 -0.925 . . . . 0.0 110.635 -179.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.41 -41.64 85.4 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.013 -1.054 . . . . 0.0 109.929 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 37.3 tp60 -68.8 -41.44 78.69 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 119.395 -0.922 . . . . 0.0 109.103 179.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 3.9 mt -62.54 -38.69 90.99 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.288 -0.883 . . . . 0.0 109.757 179.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -60.2 -39.83 87.97 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.193 -0.942 . . . . 0.0 109.971 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -58.08 -35.88 72.03 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.151 -0.968 . . . . 0.0 110.475 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -59.98 -40.99 91.03 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.152 -0.968 . . . . 0.0 110.164 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.72 -45.02 95.76 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.144 -0.972 . . . . 0.0 109.798 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 15.2 mtp85 -58.69 -38.7 78.82 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.208 -0.932 . . . . 0.0 109.929 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -58.01 -36.38 72.59 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.17 -0.956 . . . . 0.0 110.486 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 2.6 mtpm? -107.82 21.08 17.94 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.008 -1.057 . . . . 0.0 111.806 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 53.88 45.87 69.62 Favored Glycine 0 N--CA 1.499 2.85 0 O-C-N 120.572 -1.33 . . . . 0.0 110.467 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.7 t -141.68 -164.36 1.76 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.217 -1.167 . . . . 0.0 110.145 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -130.46 155.1 47.01 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.12 -0.988 . . . . 0.0 110.237 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 8.4 p -131.51 161.52 41.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.213 -0.929 . . . . 0.0 110.148 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 31.2 t -165.53 86.01 0.37 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.24 -0.913 . . . . 0.0 111.087 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.47 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 52.0 t80 -97.26 159.57 14.84 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.216 -0.927 . . . . 0.0 110.382 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 22.5 m80 -138.08 -61.13 0.62 Allowed 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 179.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -133.73 151.01 51.5 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.418 -0.801 . . . . 0.0 108.93 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 31.6 p -91.98 152.53 19.97 Favored 'General case' 0 N--CA 1.505 2.285 0 C-N-CA 119.063 -1.055 . . . . 0.0 111.142 -179.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 23.2 m -69.71 -26.46 30.69 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.449 0 C-N-CA 119.748 -0.781 . . . . 0.0 111.347 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.1 m-70 -50.91 -60.18 3.35 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 120.84 -1.163 . . . . 0.0 110.142 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.431 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 25.7 p -126.82 -167.41 1.72 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.3 -0.875 . . . . 0.0 110.797 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -98.98 58.17 0.89 Allowed Glycine 0 N--CA 1.491 2.346 0 N-CA-C 108.04 -2.024 . . . . 0.0 108.04 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 16.8 t -99.67 145.97 27.01 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.442 -1.034 . . . . 0.0 109.755 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 4.9 ttm-85 -97.83 50.79 1.04 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.226 -0.922 . . . . 0.0 109.318 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.31 97.33 0.03 OUTLIER Glycine 0 N--CA 1.486 2.019 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.1 p -109.09 128.23 54.81 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.293 -1.122 . . . . 0.0 110.327 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -143.02 130.23 20.87 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.069 -1.02 . . . . 0.0 110.099 -179.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -96.04 -38.33 10.25 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.17 -0.957 . . . . 0.0 110.606 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 3.1 m -54.36 -38.43 66.07 Favored 'General case' 0 N--CA 1.512 2.66 0 O-C-N 121.02 -1.05 . . . . 0.0 110.614 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.216 179.98 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.333 0 N-CA-C 109.551 -1.419 . . . . 0.0 109.551 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -107.55 -97.08 2.49 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.4 t -117.5 148.84 43.69 Favored Pre-proline 0 N--CA 1.494 1.733 0 O-C-N 121.158 -1.201 . . . . 0.0 110.293 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -72.74 138.81 29.67 Favored 'Trans proline' 0 C--N 1.317 -1.114 0 O-C-N 123.392 1.206 . . . . 0.0 110.432 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.85 169.5 9.81 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.166 -0.958 . . . . 0.0 110.237 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 37.2 pt -143.26 157.86 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 O-C-N 121.163 -0.961 . . . . 0.0 110.289 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.9 mtmm -118.53 146.46 44.54 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.174 -0.954 . . . . 0.0 110.14 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.7 m -129.61 119.42 23.56 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.143 -0.973 . . . . 0.0 110.246 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.5 tpp85 -140.9 76.16 1.54 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.19 -0.944 . . . . 0.0 110.168 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.05 -164.43 1.89 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.229 -0.919 . . . . 0.0 110.156 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 45.9 t -112.24 -174.91 2.56 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.123 -0.985 . . . . 0.0 110.153 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.6 mmmm -140.02 155.47 70.78 Favored Pre-proline 0 N--CA 1.494 1.763 0 O-C-N 121.164 -0.96 . . . . 0.0 110.333 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.43 162.64 40.91 Favored 'Trans proline' 0 C--N 1.318 -1.069 0 O-C-N 123.543 1.286 . . . . 0.0 110.672 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.444 ' HB3' ' CH2' ' A' ' 80' ' ' TRP . . . -84.17 143.73 42.89 Favored Pre-proline 0 N--CA 1.504 2.269 0 O-C-N 121.416 -0.802 . . . . 0.0 109.655 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -71.95 166.41 29.65 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 O-C-N 123.308 1.162 . . . . 0.0 110.835 -179.667 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -47.97 -31.93 5.87 Favored 'General case' 0 N--CA 1.515 2.825 0 O-C-N 121.507 -0.745 . . . . 0.0 111.529 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.49 -34.46 34.74 Favored Glycine 0 N--CA 1.5 2.931 0 O-C-N 120.96 -1.087 . . . . 0.0 110.585 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -55.56 -33.27 63.72 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 120.938 -1.33 . . . . 0.0 110.555 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -54.32 -37.8 65.26 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.046 -1.034 . . . . 0.0 110.167 179.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.5 mtpt -57.4 -36.56 71.44 Favored 'General case' 0 N--CA 1.511 2.585 0 O-C-N 121.298 -0.877 . . . . 0.0 110.117 179.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.418 HG23 ' OH ' ' A' ' 62' ' ' TYR . 2.8 pt -118.69 35.28 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.2 -0.937 . . . . 0.0 110.388 179.453 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -83.73 -43.37 0.8 Allowed Pre-proline 0 N--CA 1.508 2.457 0 O-C-N 120.976 -1.077 . . . . 0.0 113.105 -179.087 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.8 Cg_endo -76.27 -36.4 1.85 Allowed 'Trans proline' 0 N--CA 1.487 1.113 0 O-C-N 122.583 0.78 . . . . 0.0 111.506 -178.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 78.5 m -59.8 -42.92 94.5 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.02 -1.05 . . . . 0.0 110.092 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.416 HD21 ' CD2' ' A' ' 86' ' ' TYR . 2.7 mt -64.37 -39.84 94.66 Favored 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.672 179.601 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -57.97 -35.27 70.93 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.107 -0.996 . . . . 0.0 110.228 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -56.22 -34.52 66.4 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.127 -0.983 . . . . 0.0 110.528 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.436 ' CD2' ' HD3' ' A' ' 59' ' ' ARG . 13.9 m-85 -58.52 -40.35 82.65 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.037 -1.04 . . . . 0.0 110.642 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -60.41 -39.93 89.16 Favored 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.653 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.2 mp -66.08 -39.96 85.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.381 0 C-N-CA 119.195 -1.002 . . . . 0.0 109.126 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -70.34 -49.15 52.32 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.081 -1.012 . . . . 0.0 108.689 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.91 -32.94 74.33 Favored 'General case' 0 N--CA 1.508 2.433 0 C-N-CA 119.229 -0.988 . . . . 0.0 108.926 178.186 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 23.1 mtt180 -56.9 -40.31 76.04 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.009 -1.057 . . . . 0.0 110.018 179.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -62.9 -51.09 68.32 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.252 -0.979 . . . . 0.0 109.417 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.419 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -65.75 -40.35 92.0 Favored 'General case' 0 N--CA 1.504 2.263 0 C-N-CA 119.227 -0.989 . . . . 0.0 109.11 179.038 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -62.74 -38.59 91.13 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.178 -0.951 . . . . 0.0 109.641 179.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.0 mmtm -60.5 -39.26 87.1 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.134 -0.979 . . . . 0.0 110.02 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -58.09 -38.67 76.86 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.142 -0.973 . . . . 0.0 110.114 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 35.2 tttm -56.33 -37.38 69.9 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.131 -0.981 . . . . 0.0 110.422 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 83.1 p -109.6 39.41 2.11 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.222 -0.924 . . . . 0.0 110.275 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.7 m -148.56 -59.37 0.23 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.22 -0.925 . . . . 0.0 110.217 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -137.69 101.49 4.48 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.294 -0.879 . . . . 0.0 109.924 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.6 tp -113.53 50.21 0.92 Allowed 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.21 -0.931 . . . . 0.0 110.244 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -118.04 -57.36 2.1 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.242 -0.911 . . . . 0.0 110.193 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -121.85 149.85 42.77 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.137 -0.977 . . . . 0.0 110.178 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.7 mtmt 52.47 49.01 21.39 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.993 -1.067 . . . . 0.0 110.819 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.9 p -111.15 -52.71 2.77 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.195 -0.941 . . . . 0.0 110.553 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -55.91 -37.97 69.62 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.163 -0.96 . . . . 0.0 110.142 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -61.01 -40.96 95.55 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.17 -0.957 . . . . 0.0 109.823 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -62.64 -40.23 96.37 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.195 -0.941 . . . . 0.0 109.82 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -59.46 -38.03 79.69 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.203 -0.935 . . . . 0.0 110.26 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.429 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.5 m0 -58.36 -36.67 73.81 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.038 -1.039 . . . . 0.0 110.127 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -62.33 -30.34 71.09 Favored 'General case' 0 N--CA 1.506 2.327 0 C-N-CA 119.204 -0.998 . . . . 0.0 109.983 178.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.419 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 69.6 mt -71.91 -57.09 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.269 0 O-C-N 120.913 -1.117 . . . . 0.0 109.466 179.526 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.5 ptm -61.13 -29.48 69.8 Favored 'General case' 0 N--CA 1.509 2.49 0 C-N-CA 118.414 -1.314 . . . . 0.0 109.704 178.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -67.82 -37.42 81.93 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.841 -1.162 . . . . 0.0 109.09 178.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.406 HD21 ' CD1' ' A' ' 26' ' ' PHE . 11.0 mt -53.15 -31.87 44.72 Favored 'General case' 0 N--CA 1.512 2.636 0 O-C-N 120.965 -1.084 . . . . 0.0 110.169 178.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.439 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 70.6 t60 -54.79 -39.3 68.29 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.038 -1.038 . . . . 0.0 109.828 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.428 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 5.7 m170 -59.49 -46.61 88.31 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.158 -0.964 . . . . 0.0 109.404 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.9 tp-100 -59.44 -34.93 73.11 Favored 'General case' 0 N--CA 1.506 2.349 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.489 178.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.436 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 8.2 mmm-85 -65.39 -53.33 44.86 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.041 -1.037 . . . . 0.0 109.194 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 12.3 p -61.65 -38.58 88.23 Favored 'General case' 0 N--CA 1.505 2.277 0 C-N-CA 119.3 -0.96 . . . . 0.0 109.357 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.436 ' O ' ' OG1' ' A' ' 65' ' ' THR . 6.3 ttt85 -65.1 -41.37 95.02 Favored 'General case' 0 N--CA 1.504 2.259 0 C-N-CA 119.216 -0.993 . . . . 0.0 109.221 179.064 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.418 ' OH ' HG23 ' A' ' 19' ' ' ILE . 40.1 t80 -62.62 -49.54 74.8 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.17 -0.956 . . . . 0.0 109.547 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.45 ' CG2' ' CD1' ' A' ' 78' ' ' TYR . 85.4 mt -71.85 -38.85 66.62 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.327 0 O-C-N 121.204 -0.935 . . . . 0.0 109.448 179.564 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 9.4 t80 -66.03 -42.25 89.86 Favored 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.107 -0.996 . . . . 0.0 108.832 178.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.436 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 91.6 m -60.97 -42.17 97.78 Favored 'General case' 0 N--CA 1.504 2.239 0 C-N-CA 119.253 -0.979 . . . . 0.0 110.171 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.4 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -83.1 -33.11 26.42 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.962 -1.086 . . . . 0.0 112.474 -178.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -86.33 -32.86 20.78 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 120.554 -1.341 . . . . 0.0 111.896 -179.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -97.54 -21.1 17.29 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 120.878 -1.138 . . . . 0.0 112.527 -178.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -118.3 -59.65 1.87 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 120.56 -1.337 . . . . 0.0 110.808 179.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.3 ttt85 -62.16 -29.7 70.54 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.129 -0.982 . . . . 0.0 110.865 -179.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.2 mtpt 56.27 42.32 28.06 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.938 -1.102 . . . . 0.0 110.171 -179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.51 35.6 3.95 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.444 -0.785 . . . . 0.0 110.0 179.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.461 HD11 HG22 ' A' ' 73' ' ' ILE . 14.1 tt -153.87 162.27 2.14 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.202 -0.936 . . . . 0.0 109.974 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 50.4 m -110.0 148.29 31.94 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.181 -0.95 . . . . 0.0 110.136 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.2 tttm -46.77 -31.72 3.18 Favored 'General case' 0 N--CA 1.515 2.781 0 O-C-N 121.302 -0.874 . . . . 0.0 111.55 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -62.88 -52.01 64.74 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 120.836 -1.165 . . . . 0.0 109.261 179.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 22.4 tp -64.76 -45.68 85.36 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 119.232 -0.987 . . . . 0.0 108.469 178.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.45 ' CD1' ' CG2' ' A' ' 63' ' ' ILE . 11.8 t80 -59.3 -40.84 87.47 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.337 -0.852 . . . . 0.0 109.424 179.177 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -71.65 -43.14 66.61 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.178 -0.951 . . . . 0.0 108.506 178.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.444 ' CH2' ' HB3' ' A' ' 12' ' ' ALA . 88.7 t90 -57.0 -34.68 68.38 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.229 -0.92 . . . . 0.0 109.353 178.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.442 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 11.3 mt -67.11 -59.89 3.08 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.115 -0.991 . . . . 0.0 108.889 179.012 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.419 HD11 ' CE1' ' A' ' 78' ' ' TYR . 5.4 mt -57.97 -26.51 28.86 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.555 0 O-C-N 120.941 -1.1 . . . . 0.0 110.035 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.9 tttp -80.03 -19.07 48.53 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 120.869 -1.144 . . . . 0.0 110.853 178.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.422 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 8.3 mm-40 -108.47 23.11 14.99 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 120.752 -1.217 . . . . 0.0 111.984 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.415 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 1.5 tmtt? 76.83 69.82 0.06 Allowed 'General case' 0 N--CA 1.515 2.794 0 O-C-N 121.148 -0.97 . . . . 0.0 111.882 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.442 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 21.8 m-85 -130.95 -62.34 0.9 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.488 -0.758 . . . . 0.0 109.215 179.354 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -127.75 166.99 17.11 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.458 -0.776 . . . . 0.0 109.812 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.439 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 19.1 t0 -115.41 109.45 17.89 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.231 -0.918 . . . . 0.0 110.156 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.44 -38.09 73.87 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.216 -0.927 . . . . 0.0 110.171 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.2 tp -59.52 -38.77 81.85 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.178 -0.951 . . . . 0.0 110.179 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.42 HD21 ' CD2' ' A' ' 57' ' ' HIS . 55.6 tp -68.32 -50.02 56.3 Favored 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 119.17 -1.012 . . . . 0.0 109.164 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.45 HD13 HG23 ' A' ' 92' ' ' ILE . 68.9 mt -60.94 -37.57 77.32 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 C-N-CA 119.117 -1.033 . . . . 0.0 108.817 178.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.81 -38.67 86.92 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.082 -1.011 . . . . 0.0 109.086 178.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 9.7 mmtm -58.3 -44.85 88.74 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.105 -0.997 . . . . 0.0 109.565 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 3.2 m0 -60.68 -35.86 77.31 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.317 -0.865 . . . . 0.0 110.053 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.83 -32.79 40.64 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.105 -0.997 . . . . 0.0 110.491 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 10.3 mmtp -51.66 177.93 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.728 0 O-C-N 120.952 -1.092 . . . . 0.0 110.841 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 3.5 m -105.4 141.77 36.33 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.22 -0.925 . . . . 0.0 109.39 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 103.68 -29.15 12.78 Favored Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.896 -1.282 . . . . 0.0 109.896 -179.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -92.98 57.76 2.84 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 120.906 -1.349 . . . . 0.0 109.986 179.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.408 ' HB2' ' OG ' ' A' ' 155' ' ' SER . 5.4 mt-10 -63.02 -37.73 88.34 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 120.972 -1.08 . . . . 0.0 110.287 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -131.91 83.25 2.07 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.071 -1.018 . . . . 0.0 110.636 -179.781 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.2 pp -114.49 147.51 39.23 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.243 -0.911 . . . . 0.0 109.951 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.428 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.4 p -109.22 -27.63 9.45 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.215 -0.928 . . . . 0.0 113.003 -179.383 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.571 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 11.5 m -143.73 -167.72 2.66 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.202 -1.562 . . . . 0.0 109.789 179.107 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 13.2 mt -95.97 -38.54 10.19 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.149 -0.97 . . . . 0.0 110.098 178.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 22.6 ttt180 -103.37 31.73 4.18 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 120.972 -1.08 . . . . 0.0 109.876 178.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.571 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.7 t -128.38 19.44 6.32 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.266 -0.897 . . . . 0.0 108.733 -179.632 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.4 pt -158.34 39.01 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.345 0 O-C-N 120.974 -1.079 . . . . 0.0 110.064 -178.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.411 ' O ' ' OG1' ' A' ' 119' ' ' THR . 0.0 OUTLIER -93.11 101.12 13.42 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 120.95 -1.094 . . . . 0.0 111.004 -178.633 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.43 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 19.1 ttmt -103.31 -50.61 3.42 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.31 -0.869 . . . . 0.0 110.029 179.381 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -120.4 118.17 29.62 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.196 -0.94 . . . . 0.0 110.179 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -153.32 -173.03 4.43 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.219 -0.926 . . . . 0.0 110.72 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 75.9 p -116.21 43.89 2.07 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.221 -0.924 . . . . 0.0 110.168 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -133.18 -165.16 1.58 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.187 -0.946 . . . . 0.0 110.151 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -115.85 64.8 0.7 Allowed 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.198 -0.939 . . . . 0.0 110.19 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -133.92 -155.27 7.56 Favored Glycine 0 N--CA 1.493 2.454 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 10.0 m -143.9 -165.18 2.05 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.171 -1.193 . . . . 0.0 110.237 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.43 ' OG1' ' HA ' ' A' ' 111' ' ' LYS . 0.9 OUTLIER -114.52 158.05 22.16 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.249 -0.907 . . . . 0.0 110.175 179.953 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 49.9 t -82.19 153.9 25.73 Favored 'General case' 0 N--CA 1.499 2.005 0 C-N-CA 119.213 -0.995 . . . . 0.0 108.705 178.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.456 ' CG2' ' CE1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -75.52 -30.62 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.52 0 O-C-N 121.053 -1.03 . . . . 0.0 111.759 -178.702 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.506 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 14.2 p -58.94 -35.41 73.07 Favored 'General case' 0 N--CA 1.511 2.61 0 O-C-N 120.692 -1.255 . . . . 0.0 110.869 -179.037 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.12 -30.41 64.37 Favored 'General case' 0 N--CA 1.51 2.557 0 O-C-N 120.917 -1.114 . . . . 0.0 110.261 179.034 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.4 t -83.06 124.35 76.59 Favored Pre-proline 0 N--CA 1.505 2.298 0 O-C-N 121.061 -1.024 . . . . 0.0 110.147 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . 0.404 ' HB3' ' CB ' ' A' ' 154' ' ' ALA . 38.4 Cg_endo -66.17 174.8 5.51 Favored 'Trans proline' 0 N--CA 1.49 1.27 0 O-C-N 123.138 1.072 . . . . 0.0 110.774 179.462 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 31.1 mmm-85 -75.08 -37.0 61.7 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.216 -0.927 . . . . 0.0 110.57 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.36 -40.65 78.56 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 120.996 -1.065 . . . . 0.0 110.044 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 38.6 tp60 -69.35 -41.98 75.87 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.338 -0.945 . . . . 0.0 109.128 179.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 8.0 mt -65.23 -39.47 92.77 Favored 'General case' 0 N--CA 1.505 2.304 0 C-N-CA 119.461 -0.895 . . . . 0.0 109.407 179.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -59.84 -39.0 83.67 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.17 -0.956 . . . . 0.0 109.994 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -59.78 -40.07 87.01 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.127 -0.983 . . . . 0.0 110.054 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -61.62 -44.29 97.27 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.189 -0.944 . . . . 0.0 109.819 179.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.94 -41.41 96.21 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.209 -0.932 . . . . 0.0 109.953 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 18.3 ttt-85 -63.44 -33.13 74.88 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.111 -0.993 . . . . 0.0 110.492 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 24.5 mtmt -79.95 -30.85 39.95 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.014 -1.054 . . . . 0.0 111.197 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.37 23.51 8.35 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 120.836 -1.165 . . . . 0.0 111.739 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.89 46.6 49.17 Favored Glycine 0 N--CA 1.5 2.923 0 O-C-N 120.645 -1.284 . . . . 0.0 110.882 179.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.3 t -147.8 -164.01 1.91 Allowed 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.136 -1.214 . . . . 0.0 110.383 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -136.25 151.42 49.64 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.135 -0.978 . . . . 0.0 110.224 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.8 p -132.12 161.07 41.99 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.123 -0.985 . . . . 0.0 110.222 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 34.7 t -168.33 92.99 0.34 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.249 -0.907 . . . . 0.0 111.001 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.506 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 78.3 t80 -100.53 159.97 14.73 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.161 -0.962 . . . . 0.0 110.57 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -138.27 -60.92 0.61 Allowed 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -142.46 149.57 39.4 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.48 -0.762 . . . . 0.0 109.079 178.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . 0.403 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.6 p -90.32 153.82 20.16 Favored 'General case' 0 N--CA 1.506 2.368 0 C-N-CA 119.102 -1.039 . . . . 0.0 111.195 -179.439 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 27.0 m -72.11 -24.96 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.439 0 O-C-N 121.445 -0.785 . . . . 0.0 111.396 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -50.06 -61.31 2.23 Favored 'General case' 0 N--CA 1.515 2.802 0 O-C-N 120.837 -1.164 . . . . 0.0 110.036 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.429 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.3 p -125.93 -166.13 1.52 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.273 -0.892 . . . . 0.0 110.459 179.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -99.43 64.52 0.67 Allowed Glycine 0 N--CA 1.492 2.376 0 N-CA-C 107.987 -2.045 . . . . 0.0 107.987 178.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 29.9 t -104.73 137.32 42.71 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.359 -1.083 . . . . 0.0 110.007 -179.074 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 18.7 ttt85 -95.3 53.79 1.55 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.306 -0.871 . . . . 0.0 109.419 178.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 68.95 98.09 0.04 OUTLIER Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.986 -1.245 . . . . 0.0 109.986 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 29.8 p -105.56 119.01 38.04 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.279 -1.13 . . . . 0.0 110.248 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . 0.404 ' CB ' ' HB3' ' A' ' 125' ' ' PRO . . . -145.86 154.64 42.2 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.141 -0.975 . . . . 0.0 110.063 -179.215 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' SER . . . . . 0.408 ' OG ' ' HB2' ' A' ' 101' ' ' GLU . 0.7 OUTLIER -83.52 -35.17 25.03 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.29 -0.881 . . . . 0.0 110.693 -179.897 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 81.8 p -79.41 -39.07 33.32 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.976 -1.078 . . . . 0.0 110.132 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 . . . . . 0 N--CA 1.493 1.711 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.22 179.894 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -81.98 -125.58 0.84 Allowed Glycine 0 N--CA 1.493 2.479 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.0 t -128.92 147.68 65.68 Favored Pre-proline 0 N--CA 1.493 1.705 0 O-C-N 121.192 -1.181 . . . . 0.0 110.236 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -73.23 149.99 46.62 Favored 'Trans proline' 0 C--N 1.316 -1.15 0 O-C-N 123.454 1.239 . . . . 0.0 110.399 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 13.1 ptp180 -143.13 139.43 30.39 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.278 -0.889 . . . . 0.0 110.308 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 63.5 mt -119.64 91.59 1.88 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 O-C-N 121.249 -0.907 . . . . 0.0 109.957 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 79.6 mttt -122.05 129.2 52.21 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.246 -0.909 . . . . 0.0 110.186 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 29.2 m -122.98 152.22 41.09 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.222 -0.924 . . . . 0.0 110.227 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 28.0 mtm-85 -128.28 142.11 51.24 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.23 -0.919 . . . . 0.0 110.231 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 52.57 85.86 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.039 -1.038 . . . . 0.0 110.776 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 34.3 t -121.33 141.73 50.65 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.211 -0.93 . . . . 0.0 110.222 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -136.73 87.06 20.81 Favored Pre-proline 0 N--CA 1.495 1.809 0 O-C-N 121.272 -0.893 . . . . 0.0 110.246 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -73.97 158.92 45.56 Favored 'Trans proline' 0 C--N 1.316 -1.144 0 O-C-N 123.518 1.272 . . . . 0.0 110.596 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.422 ' HB3' ' CE3' ' A' ' 80' ' ' TRP . . . -90.15 146.18 34.37 Favored Pre-proline 0 N--CA 1.504 2.236 0 O-C-N 121.335 -0.853 . . . . 0.0 109.741 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -71.13 160.69 48.35 Favored 'Trans proline' 0 C--N 1.317 -1.097 0 O-C-N 123.358 1.188 . . . . 0.0 110.852 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -49.05 -31.72 8.25 Favored 'General case' 0 N--CA 1.515 2.791 0 O-C-N 121.411 -0.805 . . . . 0.0 111.361 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.8 -33.93 43.76 Favored Glycine 0 N--CA 1.498 2.826 0 O-C-N 120.957 -1.089 . . . . 0.0 110.503 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -55.66 -33.28 63.96 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.029 -1.277 . . . . 0.0 110.673 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -53.62 -38.29 63.89 Favored 'General case' 0 N--CA 1.513 2.687 0 O-C-N 121.047 -1.033 . . . . 0.0 110.2 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.7 mtmt -60.29 -37.42 80.47 Favored 'General case' 0 N--CA 1.509 2.482 0 C-N-CA 119.559 -0.856 . . . . 0.0 109.999 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.45 ' CG2' ' OH ' ' A' ' 62' ' ' TYR . 1.3 pt -115.41 33.64 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.193 -0.942 . . . . 0.0 110.61 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 2.5 tttt -84.64 -43.08 0.71 Allowed Pre-proline 0 N--CA 1.51 2.557 0 O-C-N 120.936 -1.102 . . . . 0.0 113.393 -179.03 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.6 Cg_endo -75.57 -35.09 2.94 Favored 'Trans proline' 0 N--CA 1.487 1.094 0 O-C-N 122.604 0.792 . . . . 0.0 111.797 -178.093 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 82.9 m -60.43 -43.76 96.46 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 120.955 -1.091 . . . . 0.0 110.019 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.2 mt -65.33 -39.49 92.49 Favored 'General case' 0 N--CA 1.507 2.377 0 C-N-CA 119.337 -0.945 . . . . 0.0 109.466 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.1 m -57.62 -35.54 70.6 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.085 -1.009 . . . . 0.0 110.185 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -56.81 -36.14 69.57 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.067 -1.021 . . . . 0.0 110.438 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.424 ' CE2' ' HD3' ' A' ' 59' ' ' ARG . 14.7 m-85 -58.46 -38.98 78.67 Favored 'General case' 0 N--CA 1.51 2.526 0 O-C-N 121.114 -0.991 . . . . 0.0 110.51 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -60.47 -38.48 84.35 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.185 -0.947 . . . . 0.0 110.711 -179.253 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.2 mp -66.9 -40.97 86.94 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.397 0 C-N-CA 119.238 -0.985 . . . . 0.0 109.089 179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 29.2 tp60 -67.76 -47.17 69.99 Favored 'General case' 0 N--CA 1.506 2.354 0 C-N-CA 119.178 -1.009 . . . . 0.0 108.785 179.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.58 -36.23 83.13 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 121.225 -0.922 . . . . 0.0 109.001 178.474 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.2 mtt85 -57.88 -41.41 82.46 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.026 -1.046 . . . . 0.0 109.874 179.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.86 -46.3 88.54 Favored 'General case' 0 N--CA 1.506 2.334 0 C-N-CA 119.27 -0.972 . . . . 0.0 109.602 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.42 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -66.91 -41.66 86.72 Favored 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 119.262 -0.975 . . . . 0.0 109.202 179.194 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -60.29 -34.24 73.49 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.566 -0.854 . . . . 0.0 110.191 179.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -92.72 -32.79 14.58 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.05 -1.031 . . . . 0.0 110.824 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -55.73 -36.58 67.39 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 120.933 -1.105 . . . . 0.0 110.357 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 11.6 ttpt -55.52 -43.47 75.75 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 120.973 -1.079 . . . . 0.0 110.355 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 52.09 -165.53 0.06 Allowed 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.05 -1.031 . . . . 0.0 110.846 179.79 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -108.87 -52.2 2.79 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.209 -0.932 . . . . 0.0 110.304 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.8 tttp -111.08 69.6 0.69 Allowed 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.104 -0.997 . . . . 0.0 110.16 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.6 tp -110.19 -50.19 2.99 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.21 -0.931 . . . . 0.0 110.625 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 54.5 34.04 20.2 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.961 -1.087 . . . . 0.0 110.963 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -143.72 109.55 5.24 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.23 -0.919 . . . . 0.0 110.158 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.8 mttt 52.72 70.62 0.55 Allowed 'General case' 0 N--CA 1.501 2.118 0 O-C-N 120.937 -1.102 . . . . 0.0 110.644 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.415 ' OG ' ' N ' ' A' ' 46' ' ' ASN . 24.0 p -112.16 -54.94 2.57 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.203 -0.936 . . . . 0.0 110.368 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.415 ' N ' ' OG ' ' A' ' 45' ' ' SER . 1.3 m-80 -57.0 -38.79 73.58 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.281 -0.887 . . . . 0.0 109.966 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -64.58 -40.09 94.91 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.213 -0.93 . . . . 0.0 109.687 179.548 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.8 tp60 -62.33 -41.05 98.24 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.207 -0.933 . . . . 0.0 109.765 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -60.5 -39.87 89.31 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.212 -0.93 . . . . 0.0 109.993 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.434 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 52.9 m0 -60.83 -37.63 82.68 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.132 -0.98 . . . . 0.0 110.041 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -61.15 -31.07 70.8 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.038 -1.039 . . . . 0.0 109.916 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.42 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 70.6 mt -71.57 -58.41 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.244 0 O-C-N 120.864 -1.148 . . . . 0.0 109.286 179.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.2 ptm -60.62 -28.28 68.41 Favored 'General case' 0 N--CA 1.509 2.52 0 C-N-CA 118.503 -1.279 . . . . 0.0 109.847 178.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -68.45 -37.26 80.05 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.756 -1.215 . . . . 0.0 109.24 178.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.404 HD21 ' CE2' ' A' ' 26' ' ' PHE . 11.3 mt -52.78 -32.5 44.02 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 120.967 -1.083 . . . . 0.0 110.175 179.044 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.451 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 10.4 t60 -54.61 -37.82 66.04 Favored 'General case' 0 N--CA 1.511 2.579 0 O-C-N 121.049 -1.032 . . . . 0.0 110.178 179.562 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.437 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 5.2 m170 -62.06 -51.84 66.33 Favored 'General case' 0 N--CA 1.508 2.443 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.472 179.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 19.6 tp60 -57.74 -34.67 69.76 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.273 -0.892 . . . . 0.0 109.831 179.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.424 ' HD3' ' CE2' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -68.81 -49.94 54.36 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.005 -1.06 . . . . 0.0 109.142 178.938 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 65.5 p -61.78 -37.45 84.38 Favored 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.162 -0.961 . . . . 0.0 109.432 179.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.41 ' O ' ' OG1' ' A' ' 65' ' ' THR . 0.1 OUTLIER -63.84 -39.0 93.17 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.068 -1.02 . . . . 0.0 109.546 179.34 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.45 ' OH ' ' CG2' ' A' ' 19' ' ' ILE . 36.8 t80 -61.7 -49.82 74.92 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.182 -0.949 . . . . 0.0 109.379 179.578 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 85.1 mt -73.61 -41.47 55.47 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 C-N-CA 119.398 -0.921 . . . . 0.0 109.137 179.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.431 ' CE1' HG21 ' A' ' 92' ' ' ILE . 45.9 t80 -60.81 -33.07 72.44 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.289 -0.882 . . . . 0.0 110.135 179.125 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.41 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 40.7 m -79.25 -35.82 40.9 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.886 -1.133 . . . . 0.0 110.748 -179.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.409 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -82.93 -33.69 26.74 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.836 -1.165 . . . . 0.0 112.412 -179.035 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.431 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 64.2 t80 -86.6 -34.94 19.71 Favored 'General case' 0 N--CA 1.511 2.617 0 O-C-N 120.674 -1.266 . . . . 0.0 112.047 -179.35 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -98.55 -20.73 16.88 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.778 -1.201 . . . . 0.0 112.862 -178.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.418 ' HE2' ' CD2' ' A' ' 64' ' ' TYR . 0.6 OUTLIER -118.75 -56.65 2.1 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.552 -1.343 . . . . 0.0 111.198 -179.523 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.9 ttt85 -66.2 -30.84 71.38 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 121.085 -1.01 . . . . 0.0 110.706 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.2 ttpt 58.64 44.0 18.13 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.785 -1.197 . . . . 0.0 110.133 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.65 38.12 3.56 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.367 -0.833 . . . . 0.0 109.701 179.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.439 HG22 HD12 ' A' ' 73' ' ' ILE . 14.2 tt -155.32 162.97 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.92 0 O-C-N 121.25 -0.906 . . . . 0.0 110.206 -179.604 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.8 m -108.11 146.05 33.2 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.118 -0.989 . . . . 0.0 109.978 179.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -45.99 -32.9 3.02 Favored 'General case' 0 N--CA 1.516 2.835 0 O-C-N 121.269 -0.894 . . . . 0.0 111.598 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -61.42 -49.63 76.08 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 120.947 -1.095 . . . . 0.0 109.324 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 34.5 tp -67.31 -43.01 82.73 Favored 'General case' 0 N--CA 1.504 2.26 0 C-N-CA 119.25 -0.98 . . . . 0.0 108.593 178.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.431 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 17.6 t80 -61.3 -38.69 87.72 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 121.352 -0.842 . . . . 0.0 109.35 178.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -74.73 -41.2 60.57 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.171 -0.956 . . . . 0.0 108.954 178.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.422 ' CE3' ' HB3' ' A' ' 12' ' ' ALA . 81.6 t90 -59.73 -38.33 81.38 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.175 -0.953 . . . . 0.0 109.291 178.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.447 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 16.6 mt -66.01 -55.69 15.4 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.179 -0.951 . . . . 0.0 109.278 179.144 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -56.48 -27.43 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 O-C-N 121.104 -0.997 . . . . 0.0 110.831 -179.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 10.2 tppt? -89.26 -15.37 33.71 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 120.918 -1.114 . . . . 0.0 111.868 179.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.422 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 75.0 mm-40 -107.48 25.04 11.95 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.564 -1.335 . . . . 0.0 111.927 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.408 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 7.0 ttmt 76.69 67.89 0.06 Allowed 'General case' 0 N--CA 1.514 2.741 0 O-C-N 121.252 -0.905 . . . . 0.0 112.022 179.278 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.447 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 27.2 m-85 -131.28 -62.58 0.88 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.406 -0.809 . . . . 0.0 108.977 178.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -132.89 168.53 18.26 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.388 -0.82 . . . . 0.0 109.391 179.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.451 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.7 t70 -121.29 111.88 17.91 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.132 -0.98 . . . . 0.0 110.546 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 7.8 mttt -58.61 -35.26 72.16 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.229 -0.919 . . . . 0.0 110.259 179.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.3 tp -57.61 -40.55 79.36 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 120.992 -1.067 . . . . 0.0 110.069 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 63.1 tp -71.03 -49.85 40.43 Favored 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 119.195 -1.002 . . . . 0.0 108.723 179.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.431 HG21 ' CE1' ' A' ' 64' ' ' TYR . 63.8 mt -60.76 -30.3 46.84 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.289 0 C-N-CA 119.32 -0.952 . . . . 0.0 109.377 178.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.9 -45.39 78.13 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 120.964 -1.085 . . . . 0.0 109.423 178.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.413 ' CD ' ' CD2' ' A' ' 106' ' ' LEU . 11.9 mttp -59.47 -44.27 93.05 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.003 -1.061 . . . . 0.0 109.859 179.282 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 3.3 m0 -57.49 -33.52 68.11 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.077 -1.014 . . . . 0.0 110.367 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.29 -35.58 35.6 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.129 -0.982 . . . . 0.0 110.282 179.418 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.8 mmtm -53.57 -178.62 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.641 0 O-C-N 120.953 -1.092 . . . . 0.0 110.62 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.87 140.18 39.3 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.257 -0.902 . . . . 0.0 109.472 179.143 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 102.52 -27.55 19.81 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 -178.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -92.62 59.05 3.24 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 120.859 -1.377 . . . . 0.0 109.734 179.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -81.37 -35.98 30.16 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.064 -1.022 . . . . 0.0 110.456 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.17 66.71 0.83 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.049 -1.032 . . . . 0.0 110.694 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -109.59 149.46 29.64 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 120.967 -1.083 . . . . 0.0 109.82 179.43 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.437 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 27.0 p -111.62 -27.88 8.37 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.193 -0.942 . . . . 0.0 113.264 -179.186 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.597 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 12.4 m -144.86 -168.77 3.01 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 120.168 -1.582 . . . . 0.0 109.865 179.207 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.413 ' CD2' ' CD ' ' A' ' 94' ' ' LYS . 17.3 mt -97.01 -37.34 10.2 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.165 -0.959 . . . . 0.0 110.234 179.002 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 7.9 ttp180 -104.07 33.32 3.51 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.93 -1.106 . . . . 0.0 109.675 178.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.597 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.304 1.7 t -128.37 20.84 6.19 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 108.388 -0.968 . . . . 0.0 108.388 -179.629 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.6 pt -157.29 38.34 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.298 0 O-C-N 121.017 -1.052 . . . . 0.0 110.211 -178.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.431 ' O ' ' OG1' ' A' ' 119' ' ' THR . 83.4 mt-30 -77.57 72.73 4.13 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 120.953 -1.092 . . . . 0.0 110.675 -178.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 27.1 ttmt -96.43 -36.8 10.69 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.174 -0.954 . . . . 0.0 110.791 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -99.47 -43.12 6.65 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.994 -1.066 . . . . 0.0 110.558 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -113.29 128.29 56.42 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.067 -1.02 . . . . 0.0 110.365 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 62.3 m -142.3 142.2 32.51 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.177 -0.952 . . . . 0.0 110.166 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -121.17 -66.22 1.07 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.173 -0.954 . . . . 0.0 110.255 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -124.09 91.94 3.56 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.16 -0.963 . . . . 0.0 110.197 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 138.11 -146.06 17.75 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 12.2 m -144.68 -164.06 1.83 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.251 -1.146 . . . . 0.0 110.173 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.431 ' OG1' ' O ' ' A' ' 110' ' ' GLN . 1.7 m -91.32 165.32 13.49 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.156 -0.965 . . . . 0.0 110.056 179.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 39.6 t -92.62 154.2 18.54 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 119.386 -0.926 . . . . 0.0 108.962 178.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.455 ' CD1' ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -77.29 -30.15 17.28 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.443 0 O-C-N 121.025 -1.047 . . . . 0.0 111.775 -178.711 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.493 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.7 p -59.02 -35.55 73.47 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 120.676 -1.265 . . . . 0.0 110.75 -179.156 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.08 -32.57 64.25 Favored 'General case' 0 N--CA 1.512 2.629 0 O-C-N 120.94 -1.1 . . . . 0.0 110.001 178.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 62.5 t -81.3 124.76 80.36 Favored Pre-proline 0 N--CA 1.503 2.212 0 O-C-N 121.051 -1.031 . . . . 0.0 109.681 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.97 178.81 2.15 Favored 'Trans proline' 0 N--CA 1.488 1.174 0 O-C-N 123.114 1.06 . . . . 0.0 110.762 179.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -75.12 -38.44 61.07 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.308 -0.87 . . . . 0.0 110.355 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.2 -40.88 82.73 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.089 -1.007 . . . . 0.0 110.029 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -67.41 -42.2 83.64 Favored 'General case' 0 N--CA 1.506 2.368 0 C-N-CA 119.432 -0.907 . . . . 0.0 109.217 179.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 9.5 mt -63.59 -39.78 95.26 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.155 -0.966 . . . . 0.0 109.547 179.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -58.82 -37.79 77.21 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.096 -1.002 . . . . 0.0 110.059 179.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -57.42 -37.18 72.35 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.098 -1.001 . . . . 0.0 110.381 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 62.7 mt-10 -61.43 -47.59 85.05 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.144 -0.972 . . . . 0.0 109.695 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -59.81 -37.97 80.67 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.171 -0.956 . . . . 0.0 109.877 179.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 23.6 ttm-85 -61.69 -38.72 88.89 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.155 -0.966 . . . . 0.0 110.318 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 49.5 mttm -87.08 -39.66 15.38 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.105 -0.997 . . . . 0.0 110.212 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 67.7 mttt -69.13 -26.0 64.67 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.21 -0.931 . . . . 0.0 111.17 179.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 90.0 33.54 8.88 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.7 t -144.31 -161.41 1.28 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.049 -1.266 . . . . 0.0 109.946 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -125.74 150.86 47.37 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.089 -1.007 . . . . 0.0 109.979 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 8.0 p -132.14 160.72 42.29 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.17 -0.956 . . . . 0.0 110.434 -179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 46.9 t -170.26 98.04 0.27 Allowed 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.237 -0.915 . . . . 0.0 110.892 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.493 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 81.6 t80 -103.93 159.97 15.2 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.124 -0.985 . . . . 0.0 110.85 -179.608 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -138.75 -61.06 0.58 Allowed 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -141.69 148.51 39.21 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.536 -0.728 . . . . 0.0 109.155 178.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . 0.416 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 29.8 p -89.81 154.13 20.14 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.073 -1.051 . . . . 0.0 111.069 -179.467 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.2 p -72.34 -25.77 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.386 0 O-C-N 121.385 -0.822 . . . . 0.0 111.463 -179.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -49.78 -59.34 3.92 Favored 'General case' 0 N--CA 1.516 2.844 0 O-C-N 120.853 -1.154 . . . . 0.0 110.208 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.434 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.6 p -126.96 -165.23 1.44 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.278 -0.889 . . . . 0.0 110.333 179.289 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . 0.419 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -101.55 63.18 0.52 Allowed Glycine 0 N--CA 1.492 2.387 0 N-CA-C 107.879 -2.088 . . . . 0.0 107.879 178.377 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 20.6 t -101.49 141.26 34.62 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.347 -1.09 . . . . 0.0 109.819 -179.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 23.9 mtt85 -97.55 50.19 1.05 Allowed 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.246 -0.909 . . . . 0.0 109.546 179.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 71.42 98.37 0.06 OUTLIER Glycine 0 N--CA 1.486 2.017 0 N-CA-C 109.975 -1.25 . . . . 0.0 109.975 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.4 p -109.43 126.04 53.05 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.244 -1.15 . . . . 0.0 110.173 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -150.17 151.75 33.58 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.077 -1.015 . . . . 0.0 110.434 -179.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -104.28 -47.62 4.08 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.217 -0.927 . . . . 0.0 110.583 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 6.3 p -54.61 -38.67 67.07 Favored 'General case' 0 N--CA 1.512 2.67 0 O-C-N 121.004 -1.06 . . . . 0.0 110.644 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 . . . . . 0 N--CA 1.494 1.749 0 CA-C-O 117.987 -1.006 . . . . 0.0 110.192 179.96 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.336 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 110.18 85.48 1.63 Allowed Glycine 0 N--CA 1.493 2.48 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 55.34 175.52 0.04 OUTLIER Pre-proline 0 N--CA 1.503 2.182 0 O-C-N 121.117 -1.225 . . . . 0.0 110.432 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -73.43 -171.94 0.94 Allowed 'Trans proline' 0 C--N 1.318 -1.069 0 O-C-N 123.308 1.162 . . . . 0.0 110.365 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.3 ttt85 -115.16 -56.62 2.35 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.182 -0.949 . . . . 0.0 110.28 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 5.1 tp -131.29 145.06 35.9 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 O-C-N 121.304 -0.872 . . . . 0.0 110.193 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.4 tttm -147.4 173.8 12.28 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.114 -0.991 . . . . 0.0 110.355 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.7 m -121.12 41.6 3.28 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.167 -0.958 . . . . 0.0 110.151 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -142.68 121.75 12.89 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.265 -0.897 . . . . 0.0 110.243 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 10' ' ' LYS . 14.5 ttt85 -140.37 100.61 3.93 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.22 -0.925 . . . . 0.0 110.156 -179.909 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.01 -71.75 0.06 Allowed 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.232 -0.917 . . . . 0.0 110.791 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.401 ' N ' ' O ' ' A' ' 8' ' ' ARG . 5.3 mtmp? -117.2 148.96 43.57 Favored Pre-proline 0 N--CA 1.494 1.763 0 O-C-N 120.931 -1.106 . . . . 0.0 110.184 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.86 158.46 50.02 Favored 'Trans proline' 0 C--N 1.316 -1.138 0 O-C-N 123.408 1.215 . . . . 0.0 110.598 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.438 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . 61.77 150.52 0.1 OUTLIER Pre-proline 0 N--CA 1.504 2.24 0 O-C-N 121.366 -0.834 . . . . 0.0 110.539 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.45 165.05 33.82 Favored 'Trans proline' 0 C--N 1.317 -1.115 0 O-C-N 123.296 1.156 . . . . 0.0 110.514 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -48.18 -32.25 6.8 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 121.5 -0.75 . . . . 0.0 111.368 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.99 -33.99 51.47 Favored Glycine 0 N--CA 1.499 2.833 0 O-C-N 120.984 -1.072 . . . . 0.0 110.514 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.413 ' CE2' ' HG3' ' A' ' 20' ' ' LYS . 28.5 t80 -54.98 -31.63 60.94 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.039 -1.271 . . . . 0.0 110.689 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -53.27 -37.03 61.79 Favored 'General case' 0 N--CA 1.512 2.662 0 O-C-N 120.982 -1.074 . . . . 0.0 110.236 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp -59.0 -37.7 77.46 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.24 -0.913 . . . . 0.0 110.116 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.428 HG21 ' OH ' ' A' ' 62' ' ' TYR . 1.9 pt -119.51 35.07 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.223 -0.923 . . . . 0.0 110.537 179.77 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.42 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 3.0 tttt -84.9 -43.3 0.68 Allowed Pre-proline 0 N--CA 1.509 2.481 0 O-C-N 120.992 -1.067 . . . . 0.0 113.42 -178.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.42 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.7 Cg_endo -75.74 -35.45 2.64 Favored 'Trans proline' 0 N--CA 1.486 1.085 0 O-C-N 122.559 0.768 . . . . 0.0 111.867 -177.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.418 HG22 ' CE2' ' A' ' 62' ' ' TYR . 59.8 m -61.5 -45.62 93.45 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.985 -1.072 . . . . 0.0 110.061 -179.585 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.0 mt -63.53 -40.36 96.83 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.509 -0.877 . . . . 0.0 109.694 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.09 -35.34 73.23 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.157 -0.964 . . . . 0.0 110.087 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -57.92 -36.05 71.93 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.009 -1.057 . . . . 0.0 110.272 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.452 ' CE2' HD23 ' A' ' 55' ' ' LEU . 10.4 m-85 -55.46 -40.95 72.25 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 120.879 -1.138 . . . . 0.0 109.978 179.598 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -58.58 -25.1 62.2 Favored 'General case' 0 N--CA 1.505 2.323 0 C-N-CA 119.484 -0.887 . . . . 0.0 110.711 179.284 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 11.3 mm -70.53 -49.01 55.76 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.31 0 O-C-N 120.894 -1.129 . . . . 0.0 109.136 179.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.77 -43.35 72.39 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.154 -0.967 . . . . 0.0 108.867 179.155 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.43 -34.68 78.75 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.249 -0.98 . . . . 0.0 109.215 178.544 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.58 -40.86 84.37 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.014 -1.054 . . . . 0.0 109.957 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -62.43 -48.19 80.77 Favored 'General case' 0 N--CA 1.508 2.45 0 C-N-CA 119.28 -0.968 . . . . 0.0 109.541 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.414 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -67.68 -41.05 84.28 Favored 'General case' 0 N--CA 1.505 2.292 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.245 179.124 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -66.28 -34.21 77.49 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.309 -0.869 . . . . 0.0 110.159 179.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt -85.87 -34.32 21.04 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.033 -1.042 . . . . 0.0 110.631 179.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -55.89 -37.34 68.72 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.002 -1.062 . . . . 0.0 110.209 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.1 tttm -54.37 -37.57 65.11 Favored 'General case' 0 N--CA 1.512 2.648 0 O-C-N 121.196 -0.94 . . . . 0.0 110.493 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -110.29 -174.49 2.5 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.141 -0.974 . . . . 0.0 110.039 179.792 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 65.25 -68.17 0.12 Allowed 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.046 -1.033 . . . . 0.0 110.979 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.4 mmmt -113.46 142.31 46.07 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.786 -1.196 . . . . 0.0 110.116 179.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.9 tp -145.88 83.03 1.63 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.216 -0.928 . . . . 0.0 110.377 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -114.92 -66.26 1.1 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.203 -0.935 . . . . 0.0 110.179 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -150.76 -179.48 7.3 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.18 -0.95 . . . . 0.0 110.608 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.0 tttp 52.7 72.13 0.43 Allowed 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.122 -0.986 . . . . 0.0 110.785 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 27.9 t -116.04 -56.66 2.29 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.187 -0.946 . . . . 0.0 110.363 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -56.96 -39.45 74.62 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 121.169 -0.957 . . . . 0.0 109.911 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -63.07 -39.35 94.45 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.153 -0.967 . . . . 0.0 109.763 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 46.4 tp60 -62.15 -41.02 97.88 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.167 -0.958 . . . . 0.0 109.855 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -60.05 -39.99 87.87 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.225 -0.922 . . . . 0.0 110.169 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.432 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.3 m0 -59.13 -36.38 75.11 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.214 -0.929 . . . . 0.0 110.276 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -60.99 -29.86 69.93 Favored 'General case' 0 N--CA 1.507 2.378 0 C-N-CA 119.164 -1.014 . . . . 0.0 110.173 179.136 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.414 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 71.7 mt -72.58 -58.16 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.269 0 O-C-N 120.936 -1.103 . . . . 0.0 109.196 179.461 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.4 ptm -60.53 -29.96 69.45 Favored 'General case' 0 N--CA 1.51 2.548 0 C-N-CA 118.609 -1.237 . . . . 0.0 109.861 178.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.9 mt-30 -69.81 -37.66 76.35 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.894 -1.129 . . . . 0.0 109.075 178.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.452 HD23 ' CE2' ' A' ' 26' ' ' PHE . 12.5 mt -54.26 -32.65 56.69 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.003 -1.06 . . . . 0.0 110.211 178.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.439 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 6.2 t60 -55.0 -37.13 66.2 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.008 -1.057 . . . . 0.0 110.111 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.436 ' NE2' HD22 ' A' ' 91' ' ' LEU . 5.1 m170 -59.61 -48.3 82.19 Favored 'General case' 0 N--CA 1.509 2.508 0 C-N-CA 119.313 -0.955 . . . . 0.0 109.538 179.05 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -60.58 -36.15 77.81 Favored 'General case' 0 N--CA 1.506 2.327 0 C-N-CA 119.396 -0.921 . . . . 0.0 109.505 179.036 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.437 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -67.59 -49.58 62.46 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.182 -0.949 . . . . 0.0 109.304 179.073 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.6 p -61.26 -38.11 85.54 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.146 -0.971 . . . . 0.0 109.586 179.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.0 ttt85 -65.7 -39.0 90.77 Favored 'General case' 0 N--CA 1.507 2.392 0 C-N-CA 119.164 -1.014 . . . . 0.0 109.406 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.428 ' OH ' HG21 ' A' ' 19' ' ' ILE . 40.5 t80 -59.88 -47.13 86.98 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.21 -0.931 . . . . 0.0 109.561 179.496 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.442 HG22 HD11 ' A' ' 63' ' ' ILE . 86.2 mt -78.01 -44.06 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 O-C-N 121.186 -0.946 . . . . 0.0 108.947 179.212 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.439 ' CE1' HG23 ' A' ' 92' ' ' ILE . 37.7 t80 -59.17 -25.62 64.08 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.326 -0.859 . . . . 0.0 110.289 178.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 71.2 m -87.47 -37.12 17.25 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.774 -1.204 . . . . 0.0 110.283 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.6 pp -83.14 -31.82 26.99 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.005 -1.059 . . . . 0.0 112.485 -179.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.43 ' CD1' ' HB2' ' A' ' 78' ' ' TYR . 73.5 t80 -86.27 -36.2 19.5 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 120.697 -1.252 . . . . 0.0 111.482 -179.192 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -94.36 -17.11 22.87 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 120.889 -1.132 . . . . 0.0 112.726 -178.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -125.0 -60.48 1.35 Allowed 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.53 -1.356 . . . . 0.0 111.264 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -59.82 -29.89 68.56 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 120.986 -1.071 . . . . 0.0 110.825 -179.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.2 tttt 58.55 43.86 18.64 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.885 -1.134 . . . . 0.0 110.058 -179.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -114.07 36.63 3.62 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.366 -0.834 . . . . 0.0 109.798 179.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.429 HD12 HG22 ' A' ' 73' ' ' ILE . 13.8 tt -159.43 162.36 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.202 -0.936 . . . . 0.0 110.119 -179.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.05 149.44 29.26 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.048 -1.032 . . . . 0.0 110.199 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.9 tttp -46.09 -32.7 3.03 Favored 'General case' 0 N--CA 1.515 2.804 0 O-C-N 121.375 -0.828 . . . . 0.0 111.588 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -62.46 -51.37 67.74 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 120.961 -1.087 . . . . 0.0 109.224 179.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 29.6 tp -65.92 -42.35 90.26 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.192 -1.003 . . . . 0.0 108.659 178.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.43 ' HB2' ' CD1' ' A' ' 67' ' ' TYR . 17.6 t80 -61.86 -40.13 94.29 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.302 -0.874 . . . . 0.0 109.244 179.022 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -70.84 -42.21 70.45 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.14 -0.975 . . . . 0.0 108.868 178.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.438 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 81.5 t90 -57.57 -36.84 72.21 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.248 -0.907 . . . . 0.0 109.65 179.049 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.462 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 15.8 mt -67.99 -51.37 47.99 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.059 -1.025 . . . . 0.0 109.082 179.176 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.8 mm -56.77 -29.27 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.53 0 O-C-N 121.208 -0.932 . . . . 0.0 110.209 179.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 25.2 tttt -89.1 -20.33 24.44 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 120.873 -1.142 . . . . 0.0 111.93 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.42 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 29.0 mm-40 -102.91 22.9 13.04 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 120.635 -1.291 . . . . 0.0 112.077 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? 73.81 77.65 0.13 Allowed 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.02 -1.05 . . . . 0.0 111.685 179.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.462 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 31.8 m-85 -135.9 -62.39 0.68 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.51 -0.743 . . . . 0.0 109.342 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -127.96 171.67 11.61 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.478 -0.763 . . . . 0.0 109.41 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.439 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 25.8 t0 -114.35 104.94 12.56 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.144 -0.973 . . . . 0.0 110.246 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 20.5 mttm -58.83 -39.91 82.6 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.219 -0.926 . . . . 0.0 109.934 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 27.5 tp -61.52 -38.59 87.95 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.135 -0.978 . . . . 0.0 109.924 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.436 HD22 ' NE2' ' A' ' 57' ' ' HIS . 57.0 tp -71.47 -47.25 56.86 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.056 -1.028 . . . . 0.0 108.702 179.241 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.439 HG23 ' CE1' ' A' ' 64' ' ' TYR . 23.1 mt -58.02 -36.44 56.49 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 O-C-N 121.16 -0.962 . . . . 0.0 108.627 178.305 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.99 -38.91 86.88 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 121.154 -0.966 . . . . 0.0 109.137 178.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.415 ' HD2' ' CZ ' ' A' ' 100' ' ' TYR . 4.9 mmtt -57.64 -42.91 84.41 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.152 -0.967 . . . . 0.0 109.474 179.288 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.5 m0 -64.79 -37.46 87.7 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.56 -0.856 . . . . 0.0 110.055 179.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.3 mtp85 -75.68 -32.81 60.29 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.194 -0.941 . . . . 0.0 110.543 179.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -54.06 -176.59 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.7 0 O-C-N 121.065 -1.022 . . . . 0.0 110.657 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -104.03 136.14 44.23 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.129 -0.982 . . . . 0.0 109.694 179.228 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 95.63 11.3 55.63 Favored Glycine 0 N--CA 1.494 2.553 0 C-N-CA 120.172 -1.013 . . . . 0.0 111.023 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.415 ' CZ ' ' HD2' ' A' ' 94' ' ' LYS . 48.2 m-85 -119.28 71.95 0.88 Allowed 'General case' 0 N--CA 1.493 1.715 0 CA-C-N 119.403 1.602 . . . . 0.0 109.777 179.703 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -96.73 -36.26 10.72 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.177 -0.952 . . . . 0.0 110.807 -179.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.33 66.98 0.99 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.015 -1.053 . . . . 0.0 110.822 -179.598 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.2 pp -114.5 153.04 30.72 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.035 -1.041 . . . . 0.0 109.78 179.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.433 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.7 p -114.36 -29.92 6.74 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.172 -0.955 . . . . 0.0 113.569 -178.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.565 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.8 m -142.92 -167.99 2.67 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 120.051 -1.656 . . . . 0.0 109.907 179.263 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 15.0 mt -95.69 -39.04 10.09 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.2 -0.937 . . . . 0.0 109.937 179.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 5.7 ttm-85 -102.83 30.74 4.55 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.026 -1.046 . . . . 0.0 109.933 178.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.565 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.299 1.8 t -128.14 17.98 6.59 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.12 -0.988 . . . . 0.0 108.947 -179.554 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.2 pt -158.28 37.83 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.275 0 O-C-N 120.864 -1.147 . . . . 0.0 110.571 -178.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -71.04 76.24 0.66 Allowed 'General case' 0 N--CA 1.51 2.559 0 O-C-N 120.854 -1.154 . . . . 0.0 110.509 -178.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.58 -166.17 1.06 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.196 -0.94 . . . . 0.0 110.106 179.562 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 1.4 m120 53.28 -171.91 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.986 -1.071 . . . . 0.0 110.575 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -115.14 100.09 7.91 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.183 -0.948 . . . . 0.0 110.276 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -144.84 -58.81 0.36 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.137 -0.977 . . . . 0.0 110.453 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -117.26 -172.48 2.23 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.188 -0.945 . . . . 0.0 110.212 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -116.64 161.62 18.9 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.174 -0.954 . . . . 0.0 110.165 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 134.25 -144.99 17.1 Favored Glycine 0 N--CA 1.493 2.457 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 4.1 m -125.79 163.26 23.27 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.214 -1.168 . . . . 0.0 110.129 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 2.7 m -112.61 168.44 9.65 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.261 -0.899 . . . . 0.0 110.127 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 41.7 t -102.74 155.28 18.42 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.247 -0.908 . . . . 0.0 109.698 179.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.455 HG21 HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -72.96 -36.34 51.13 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.457 0 O-C-N 121.114 -0.991 . . . . 0.0 111.052 -179.36 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.501 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 11.9 p -53.65 -33.17 54.33 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 120.84 -1.163 . . . . 0.0 111.253 -178.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.32 -32.57 70.2 Favored 'General case' 0 N--CA 1.512 2.65 0 O-C-N 120.952 -1.092 . . . . 0.0 109.666 178.392 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 49.3 t -82.84 125.41 75.45 Favored Pre-proline 0 N--CA 1.505 2.297 0 O-C-N 121.06 -1.025 . . . . 0.0 109.85 179.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.64 175.29 4.49 Favored 'Trans proline' 0 N--CA 1.488 1.189 0 O-C-N 123.155 1.082 . . . . 0.0 110.797 179.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.11 -36.71 61.66 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.256 -0.902 . . . . 0.0 110.73 -179.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.65 -40.22 78.8 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 121.031 -1.043 . . . . 0.0 110.105 -179.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -69.84 -41.35 75.02 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 119.356 -0.938 . . . . 0.0 109.288 179.316 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.9 mt -65.04 -38.45 90.87 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.246 -0.909 . . . . 0.0 109.648 179.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -61.22 -40.46 94.08 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.088 -1.008 . . . . 0.0 109.842 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -59.8 -37.49 79.29 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.144 -0.973 . . . . 0.0 110.294 179.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -61.53 -43.44 98.86 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.169 -0.957 . . . . 0.0 110.071 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.29 -40.89 92.09 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.186 -0.946 . . . . 0.0 110.015 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.94 -33.82 69.22 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.183 -0.948 . . . . 0.0 110.401 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 25.1 mttt -76.88 -30.93 56.44 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.065 -1.022 . . . . 0.0 110.949 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 14.8 mtpp -98.42 22.33 9.9 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 120.916 -1.115 . . . . 0.0 111.688 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.67 39.38 46.13 Favored Glycine 0 N--CA 1.5 2.964 0 O-C-N 120.691 -1.255 . . . . 0.0 110.727 179.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 7.0 t -143.55 -166.64 2.38 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.089 -1.242 . . . . 0.0 110.338 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -132.94 155.05 49.81 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.245 -0.91 . . . . 0.0 110.248 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 8.2 p -130.63 161.36 40.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.152 -0.968 . . . . 0.0 109.961 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 42.2 t -166.41 85.52 0.3 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.138 -0.976 . . . . 0.0 111.285 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.501 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 55.1 t80 -97.43 159.94 14.62 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.207 -0.933 . . . . 0.0 110.136 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 9.8 m-70 -136.82 -61.47 0.67 Allowed 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 179.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -136.7 151.0 48.76 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.45 -0.781 . . . . 0.0 108.928 178.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 29.0 p -91.49 154.48 19.09 Favored 'General case' 0 N--CA 1.506 2.331 0 C-N-CA 119.121 -1.032 . . . . 0.0 111.093 -179.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.5 m -72.7 -25.1 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.462 0 C-N-CA 119.742 -0.783 . . . . 0.0 111.541 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -50.43 -60.81 2.63 Favored 'General case' 0 N--CA 1.516 2.856 0 O-C-N 120.906 -1.121 . . . . 0.0 110.022 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.432 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.9 p -126.43 -165.39 1.44 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.215 -0.928 . . . . 0.0 110.393 179.263 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . 0.421 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.39 63.52 0.61 Allowed Glycine 0 N--CA 1.492 2.42 0 N-CA-C 108.053 -2.019 . . . . 0.0 108.053 178.543 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 30.5 t -103.69 138.89 39.69 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.357 -1.084 . . . . 0.0 110.074 -179.191 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -95.03 54.38 1.68 Allowed 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.266 -0.896 . . . . 0.0 109.444 179.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.66 97.93 0.03 OUTLIER Glycine 0 N--CA 1.486 2.024 0 N-CA-C 109.819 -1.312 . . . . 0.0 109.819 -179.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.5 p -107.22 126.23 52.14 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.219 -1.165 . . . . 0.0 110.391 179.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -150.29 148.5 28.93 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.193 -0.942 . . . . 0.0 110.343 -179.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -98.01 -38.72 9.27 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.248 -0.907 . . . . 0.0 110.772 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.34 -40.42 74.1 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.037 -1.04 . . . . 0.0 110.101 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 . . . . . 0 N--CA 1.495 1.8 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.348 179.937 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.366 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 111.86 -53.36 0.59 Allowed Glycine 0 N--CA 1.493 2.464 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -134.68 80.82 49.19 Favored Pre-proline 0 N--CA 1.493 1.703 0 O-C-N 121.219 -1.165 . . . . 0.0 110.2 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.87 86.86 1.04 Allowed 'Trans proline' 0 C--N 1.316 -1.179 0 O-C-N 123.443 1.233 . . . . 0.0 110.363 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 9.0 mtp85 -140.79 151.86 44.73 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.243 -0.911 . . . . 0.0 110.246 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.3 pt -142.95 79.34 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 121.161 -0.962 . . . . 0.0 110.35 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 11.5 tttt -113.77 139.09 49.4 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.078 -1.014 . . . . 0.0 110.166 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 86.8 m -140.84 105.51 4.91 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.261 -0.899 . . . . 0.0 110.25 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.05 123.77 14.16 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.282 -0.886 . . . . 0.0 110.123 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 22.7 ttt180 -145.11 99.67 3.36 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.142 -0.974 . . . . 0.0 110.356 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 85.0 p -145.72 139.59 26.61 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.203 -0.936 . . . . 0.0 110.387 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -137.68 73.4 47.84 Favored Pre-proline 0 N--CA 1.494 1.731 0 O-C-N 121.169 -0.957 . . . . 0.0 110.309 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -73.13 159.69 46.96 Favored 'Trans proline' 0 C--N 1.317 -1.124 0 O-C-N 123.388 1.204 . . . . 0.0 110.568 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.426 ' HB3' ' CZ2' ' A' ' 80' ' ' TRP . . . -81.35 142.51 50.62 Favored Pre-proline 0 N--CA 1.507 2.405 0 C-N-CA 119.591 -0.844 . . . . 0.0 109.648 179.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -71.82 162.1 43.01 Favored 'Trans proline' 0 C--N 1.318 -1.072 0 O-C-N 123.281 1.148 . . . . 0.0 110.896 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -48.82 -31.96 7.94 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 121.464 -0.773 . . . . 0.0 111.344 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.35 -33.91 40.28 Favored Glycine 0 N--CA 1.498 2.827 0 O-C-N 120.992 -1.067 . . . . 0.0 110.584 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -54.89 -32.6 61.08 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 120.972 -1.311 . . . . 0.0 110.634 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -54.44 -37.94 65.73 Favored 'General case' 0 N--CA 1.512 2.659 0 O-C-N 121.04 -1.037 . . . . 0.0 110.251 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.8 mttm -57.94 -37.14 73.58 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.27 -0.894 . . . . 0.0 110.115 179.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.6 pt -116.1 35.31 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.206 -0.934 . . . . 0.0 110.402 179.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.432 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -83.59 -43.09 0.81 Allowed Pre-proline 0 N--CA 1.51 2.529 0 O-C-N 121.082 -1.011 . . . . 0.0 113.17 -179.179 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.432 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.2 Cg_endo -76.12 -35.79 2.23 Favored 'Trans proline' 0 N--CA 1.487 1.123 0 O-C-N 122.632 0.806 . . . . 0.0 111.66 -178.392 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 88.6 m -60.5 -44.96 95.44 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 120.946 -1.096 . . . . 0.0 109.828 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.4 mt -65.01 -39.36 93.33 Favored 'General case' 0 N--CA 1.505 2.321 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.416 179.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 20.2 m -58.5 -35.41 72.19 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.076 -1.015 . . . . 0.0 110.051 179.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -56.37 -35.87 68.18 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 121.037 -1.039 . . . . 0.0 110.394 179.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.416 ' CD2' HD23 ' A' ' 55' ' ' LEU . 12.9 m-85 -56.82 -36.4 69.9 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.075 -1.016 . . . . 0.0 110.475 179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -57.79 -38.61 75.8 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.069 -1.02 . . . . 0.0 110.499 -179.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.1 mp -65.96 -41.01 88.98 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.412 0 C-N-CA 119.31 -0.956 . . . . 0.0 109.033 179.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 8.7 tp60 -68.97 -46.75 67.31 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.108 -0.995 . . . . 0.0 108.826 179.044 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.4 tp -61.89 -36.97 82.86 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.205 -0.935 . . . . 0.0 109.235 178.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.1 mtt85 -57.24 -36.46 70.96 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.138 -0.976 . . . . 0.0 110.298 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -62.93 -51.78 65.59 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.072 -1.017 . . . . 0.0 109.503 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.41 ' HB1' ' CG1' ' A' ' 52' ' ' ILE . . . -69.08 -42.27 76.43 Favored 'General case' 0 N--CA 1.504 2.274 0 C-N-CA 119.045 -1.062 . . . . 0.0 108.614 178.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -61.26 -33.19 73.13 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 119.455 -0.898 . . . . 0.0 110.297 179.369 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.8 mmtt -94.25 -29.23 15.19 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 120.897 -1.127 . . . . 0.0 111.289 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -53.92 -36.16 62.47 Favored 'General case' 0 N--CA 1.513 2.69 0 O-C-N 120.79 -1.194 . . . . 0.0 110.473 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.6 tptt -55.01 -38.81 68.38 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 121.1 -1.0 . . . . 0.0 110.428 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.5 m -117.63 41.8 2.76 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.203 -0.936 . . . . 0.0 110.208 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.07 -58.37 1.56 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.259 -0.901 . . . . 0.0 110.36 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -98.3 -41.07 8.02 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.199 -0.938 . . . . 0.0 110.446 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.1 tt 54.16 71.07 0.54 Allowed 'General case' 0 N--CA 1.502 2.135 0 O-C-N 120.988 -1.07 . . . . 0.0 110.616 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -144.9 -65.56 0.33 Allowed 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.224 -0.923 . . . . 0.0 110.228 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -149.6 -177.72 6.03 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.209 -0.932 . . . . 0.0 110.553 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 52.76 85.27 0.05 OUTLIER 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.056 -1.027 . . . . 0.0 110.963 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.8 m -115.19 -56.92 2.32 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.19 -0.944 . . . . 0.0 110.168 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -56.81 -39.07 73.5 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 121.226 -0.921 . . . . 0.0 109.763 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -58.54 -35.16 71.88 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.243 -0.911 . . . . 0.0 110.137 179.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.406 ' HG2' ' CB ' ' A' ' 33' ' ' ALA . 0.3 OUTLIER -58.72 -46.31 87.63 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 120.974 -1.079 . . . . 0.0 109.585 179.72 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 92.1 mt -63.28 -37.78 88.58 Favored 'General case' 0 N--CA 1.508 2.463 0 C-N-CA 119.305 -0.958 . . . . 0.0 109.916 179.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.445 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 38.3 m0 -59.36 -33.99 71.84 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.153 -0.967 . . . . 0.0 109.405 179.413 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -68.03 -33.49 74.68 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 120.727 -1.233 . . . . 0.0 109.326 178.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.41 ' CG1' ' HB1' ' A' ' 33' ' ' ALA . 11.2 mt -70.82 -53.64 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.245 0 O-C-N 121.03 -1.044 . . . . 0.0 109.491 179.222 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.472 ' CE ' ' HB2' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -59.83 -33.1 71.32 Favored 'General case' 0 N--CA 1.51 2.538 0 C-N-CA 118.764 -1.174 . . . . 0.0 109.718 179.169 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.36 -39.59 91.18 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 120.91 -1.119 . . . . 0.0 109.44 179.129 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.416 HD23 ' CD2' ' A' ' 26' ' ' PHE . 18.0 mt -54.46 -34.31 61.27 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.158 -0.964 . . . . 0.0 110.097 179.235 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.439 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 4.8 t60 -58.55 -39.21 79.6 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 120.983 -1.073 . . . . 0.0 109.85 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.439 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 7.6 m170 -59.95 -48.39 81.91 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.086 -1.009 . . . . 0.0 109.064 179.24 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.88 -38.51 88.59 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.55 -0.86 . . . . 0.0 109.397 179.065 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.23 -44.71 96.83 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.246 -0.909 . . . . 0.0 109.502 179.478 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 52.7 p -66.34 -39.96 89.56 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.091 -1.006 . . . . 0.0 109.151 179.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.421 ' O ' ' OG1' ' A' ' 65' ' ' THR . 60.3 ttt-85 -63.04 -40.24 97.11 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.117 -0.989 . . . . 0.0 109.298 179.086 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -62.2 -50.58 71.23 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.151 -0.968 . . . . 0.0 109.383 179.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 82.3 mt -70.59 -37.56 70.19 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 C-N-CA 119.289 -0.964 . . . . 0.0 109.332 179.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -66.56 -41.65 88.28 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.146 -0.971 . . . . 0.0 108.996 178.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.421 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 86.3 m -60.84 -41.82 96.54 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.112 -0.992 . . . . 0.0 110.098 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.403 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -83.18 -35.65 25.32 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 120.958 -1.089 . . . . 0.0 112.716 -178.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.424 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 41.8 t80 -86.58 -33.56 20.17 Favored 'General case' 0 N--CA 1.514 2.751 0 O-C-N 120.614 -1.304 . . . . 0.0 112.044 -179.066 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -98.25 -3.35 37.56 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.854 -1.153 . . . . 0.0 113.308 -178.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -136.32 -57.52 0.75 Allowed 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.374 -1.454 . . . . 0.0 111.134 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.3 mtp85 -69.19 -28.58 66.51 Favored 'General case' 0 N--CA 1.51 2.557 0 O-C-N 120.949 -1.094 . . . . 0.0 110.731 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.0 tttp 60.22 44.78 12.27 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.781 -1.199 . . . . 0.0 109.985 -179.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.54 35.73 3.71 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.343 -0.848 . . . . 0.0 109.817 179.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.463 HD13 HG23 ' A' ' 73' ' ' ILE . 14.3 tt -155.99 162.69 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 O-C-N 121.151 -0.968 . . . . 0.0 110.052 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.7 p -109.5 147.08 33.53 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.085 -1.009 . . . . 0.0 110.095 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.3 tttt -45.87 -32.23 2.52 Favored 'General case' 0 N--CA 1.515 2.809 0 O-C-N 121.309 -0.869 . . . . 0.0 111.621 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -61.8 -50.54 71.93 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.955 -1.091 . . . . 0.0 109.274 179.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 38.5 tp -66.68 -44.44 81.78 Favored 'General case' 0 N--CA 1.505 2.295 0 C-N-CA 119.241 -0.984 . . . . 0.0 108.442 178.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.424 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 18.5 t80 -60.43 -38.74 85.06 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.327 -0.858 . . . . 0.0 109.564 179.208 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -73.39 -41.92 62.77 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.059 -1.026 . . . . 0.0 109.016 178.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.437 ' CE2' ' HG3' ' A' ' 84' ' ' GLU . 84.1 t90 -57.65 -37.3 73.13 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.219 -0.926 . . . . 0.0 109.756 179.143 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.475 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 60.9 mt -69.28 -47.86 63.35 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.209 -0.932 . . . . 0.0 108.949 179.217 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.449 HD11 HG23 ' A' ' 82' ' ' ILE . 33.1 mm -56.23 -31.72 32.96 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.64 0 O-C-N 121.264 -0.897 . . . . 0.0 109.975 179.383 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 8.3 ttmt -89.24 -16.55 30.99 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 120.868 -1.145 . . . . 0.0 112.136 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.437 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 15.5 mm-40 -104.53 22.73 14.46 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 120.583 -1.323 . . . . 0.0 112.158 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.6 tptt 75.75 71.44 0.08 Allowed 'General case' 0 N--CA 1.512 2.643 0 O-C-N 121.149 -0.969 . . . . 0.0 111.903 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.475 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 33.2 m-85 -134.1 -63.03 0.74 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.42 -0.8 . . . . 0.0 109.019 179.198 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -128.36 164.08 23.44 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.485 -0.759 . . . . 0.0 109.26 179.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.439 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 3.3 t0 -112.04 107.33 16.24 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.102 -0.999 . . . . 0.0 110.468 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.6 mttt -58.82 -39.59 81.64 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.13 -0.981 . . . . 0.0 109.914 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 16.2 tp -60.61 -39.3 87.65 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.233 -0.917 . . . . 0.0 110.05 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.416 ' HG ' ' CZ3' ' A' ' 95' ' ' TRP . 61.0 tp -70.11 -48.2 58.58 Favored 'General case' 0 N--CA 1.507 2.4 0 C-N-CA 119.203 -0.999 . . . . 0.0 108.669 179.229 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.434 HG23 HD11 ' A' ' 92' ' ' ILE . 62.9 mt -61.34 -38.22 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.434 0 C-N-CA 119.32 -0.952 . . . . 0.0 108.552 178.285 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.99 -39.06 83.31 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.146 -0.971 . . . . 0.0 109.087 178.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 5.8 mmtt -57.7 -41.85 82.5 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.043 -1.036 . . . . 0.0 109.43 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.416 ' CZ3' ' HG ' ' A' ' 91' ' ' LEU . 4.7 m0 -68.11 -40.21 82.62 Favored 'General case' 0 N--CA 1.506 2.352 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.475 179.296 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.16 -36.0 81.95 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.274 -0.891 . . . . 0.0 110.229 179.503 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.2 mmtp -53.84 -179.41 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.637 0 O-C-N 121.075 -1.016 . . . . 0.0 110.471 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -106.03 141.26 37.7 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.308 -0.87 . . . . 0.0 109.58 179.428 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.36 -20.49 49.62 Favored Glycine 0 N--CA 1.491 2.366 0 C-N-CA 119.854 -1.165 . . . . 0.0 110.608 -179.298 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -92.55 57.06 2.85 Favored 'General case' 0 N--CA 1.504 2.233 0 CA-C-N 119.313 1.556 . . . . 0.0 110.282 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -74.93 -38.57 61.76 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.009 -1.057 . . . . 0.0 109.66 179.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -111.91 83.95 1.88 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.239 -0.913 . . . . 0.0 109.602 179.583 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 9.3 tp -121.02 137.39 54.67 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.268 -0.895 . . . . 0.0 110.017 -179.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.439 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.8 p -111.6 -38.54 4.88 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.208 -0.932 . . . . 0.0 112.327 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.597 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 5.5 m -139.65 -168.71 2.54 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 120.25 -1.531 . . . . 0.0 109.884 178.939 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 12.4 mt -97.59 -37.98 9.72 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.006 -1.059 . . . . 0.0 110.557 179.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.8 ttt-85 -101.89 32.2 3.54 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.939 -1.101 . . . . 0.0 109.464 178.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.597 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.306 1.7 t -127.36 16.22 7.13 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.231 -0.918 . . . . 0.0 109.119 -179.21 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.406 ' CG2' ' O ' ' A' ' 108' ' ' CYS . 1.1 pt -159.77 39.21 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 O-C-N 120.905 -1.122 . . . . 0.0 110.1 -178.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.428 ' O ' ' OG1' ' A' ' 119' ' ' THR . 1.7 tt0 -104.52 105.26 15.29 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.813 -1.179 . . . . 0.0 111.124 -178.518 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 2.9 tttt -116.1 176.01 5.29 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.217 -0.927 . . . . 0.0 109.809 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 8.6 m-20 -165.81 -54.61 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.078 -1.014 . . . . 0.0 110.965 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -140.66 -160.2 1.05 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.178 -0.951 . . . . 0.0 109.701 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 1.4 p -90.09 -35.75 15.26 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 120.792 -1.193 . . . . 0.0 110.788 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 20.0 p30 -111.2 165.0 12.28 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.021 -1.049 . . . . 0.0 110.535 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 53.26 -174.22 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.994 -1.066 . . . . 0.0 110.609 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 91.8 -179.23 41.31 Favored Glycine 0 N--CA 1.494 2.521 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 65.1 m -146.07 96.87 2.86 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.177 -1.19 . . . . 0.0 110.531 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.428 ' OG1' ' O ' ' A' ' 110' ' ' GLN . 0.3 OUTLIER -125.16 171.97 9.88 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.26 -0.9 . . . . 0.0 110.198 179.866 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 42.5 t -106.59 155.49 19.57 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.25 -0.906 . . . . 0.0 109.282 178.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.448 ' CG2' ' CE1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -71.22 -36.81 63.66 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.336 0 O-C-N 121.098 -1.001 . . . . 0.0 110.757 -179.637 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.466 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 5.1 p -54.92 -32.68 61.44 Favored 'General case' 0 N--CA 1.512 2.636 0 O-C-N 120.84 -1.163 . . . . 0.0 110.968 -179.161 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.5 -35.59 72.47 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.914 -1.116 . . . . 0.0 109.378 178.171 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 55.8 t -79.92 125.42 82.01 Favored Pre-proline 0 N--CA 1.503 2.187 0 O-C-N 121.21 -0.931 . . . . 0.0 109.478 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -64.94 167.94 14.78 Favored 'Trans proline' 0 N--CA 1.488 1.173 0 O-C-N 123.145 1.076 . . . . 0.0 110.662 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.03 -36.86 61.86 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.259 -0.901 . . . . 0.0 110.794 -179.529 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.11 -40.37 81.02 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.045 -1.035 . . . . 0.0 110.077 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -68.14 -41.52 81.5 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.201 -0.937 . . . . 0.0 109.323 179.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 10.9 mt -62.49 -38.48 90.05 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.496 -0.882 . . . . 0.0 109.859 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -59.98 -40.32 88.73 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.081 -1.012 . . . . 0.0 109.958 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -64.3 -38.96 92.88 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.174 -0.954 . . . . 0.0 109.822 179.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -60.61 -39.94 89.99 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.24 -0.913 . . . . 0.0 109.99 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.08 -45.06 95.18 Favored 'General case' 0 N--CA 1.508 2.452 0 C-N-CA 119.351 -0.94 . . . . 0.0 109.85 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 10.2 ttp85 -60.83 -39.05 87.58 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.203 -0.936 . . . . 0.0 109.789 179.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 27.8 mtmt -61.86 -34.38 75.89 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.144 -0.973 . . . . 0.0 110.602 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 29.4 mttt -102.49 18.48 21.06 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.005 -1.059 . . . . 0.0 111.921 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 55.35 45.45 83.34 Favored Glycine 0 N--CA 1.498 2.792 0 O-C-N 120.607 -1.308 . . . . 0.0 110.38 179.491 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.8 t -140.67 -163.44 1.53 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.171 -1.194 . . . . 0.0 110.079 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -138.51 145.41 40.73 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.184 -0.948 . . . . 0.0 110.253 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.6 p -132.03 160.85 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 O-C-N 121.147 -0.971 . . . . 0.0 110.109 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 41.4 t -168.8 80.68 0.14 Allowed 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.22 -0.925 . . . . 0.0 111.149 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.466 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 49.6 t80 -94.4 159.8 14.95 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.222 -0.924 . . . . 0.0 110.195 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 28.8 m170 -136.16 -61.13 0.71 Allowed 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 178.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -136.79 152.6 50.48 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.459 -0.776 . . . . 0.0 109.357 179.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 26.2 p -94.74 155.65 16.74 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.156 -0.965 . . . . 0.0 110.904 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.8 p -74.15 -25.28 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.532 0 O-C-N 121.344 -0.848 . . . . 0.0 111.583 -179.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -50.59 -46.68 58.04 Favored 'General case' 0 N--CA 1.517 2.896 0 O-C-N 120.755 -1.216 . . . . 0.0 109.594 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.472 ' HB2' ' CE ' ' A' ' 53' ' ' MET . 29.5 p -141.5 -178.58 5.7 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.411 -0.806 . . . . 0.0 110.411 179.315 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -91.02 62.21 2.93 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 107.781 -2.128 . . . . 0.0 107.781 178.116 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.5 t -105.68 138.77 41.33 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.382 -1.069 . . . . 0.0 109.626 -178.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 3.7 tpt85 -92.65 57.05 2.81 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.276 -0.89 . . . . 0.0 109.727 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 61.82 96.25 0.01 OUTLIER Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.739 -1.344 . . . . 0.0 109.739 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.3 p -104.71 128.51 52.82 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.308 -1.113 . . . . 0.0 110.401 179.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -138.44 142.67 39.5 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.168 -0.957 . . . . 0.0 109.85 -179.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -110.54 -58.18 2.12 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.205 -0.934 . . . . 0.0 110.174 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 7.8 t -158.53 39.71 0.24 Allowed 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.149 -0.969 . . . . 0.0 110.824 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 . . . . . 0 N--CA 1.494 1.746 0 CA-C-O 118.065 -0.969 . . . . 0.0 110.394 -179.98 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.233 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -81.62 158.54 39.38 Favored Glycine 0 N--CA 1.493 2.438 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.2 m -125.6 154.42 72.86 Favored Pre-proline 0 N--CA 1.493 1.718 0 O-C-N 121.129 -1.218 . . . . 0.0 110.235 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.8 103.45 1.58 Allowed 'Trans proline' 0 C--N 1.317 -1.111 0 O-C-N 123.325 1.171 . . . . 0.0 110.433 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.1 mtt85 -125.64 57.41 1.34 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.287 -0.883 . . . . 0.0 110.13 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.8 mm -115.49 -57.39 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.161 -0.962 . . . . 0.0 110.105 -179.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 41.0 tttp -131.64 154.9 48.44 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.313 -0.867 . . . . 0.0 110.291 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 16.1 p -118.03 176.16 5.34 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.133 -0.979 . . . . 0.0 110.209 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 10.0 mtt85 -142.14 173.89 11.11 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.221 -0.924 . . . . 0.0 110.218 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.5 ttt-85 -127.01 133.22 50.58 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.231 -0.918 . . . . 0.0 110.259 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 34.6 t -130.84 137.71 49.51 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.134 -0.979 . . . . 0.0 110.137 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.4 mtpp -124.7 150.74 66.32 Favored Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.153 -0.967 . . . . 0.0 110.278 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -73.06 158.08 49.97 Favored 'Trans proline' 0 C--N 1.317 -1.118 0 O-C-N 123.437 1.23 . . . . 0.0 110.655 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.431 ' HB1' ' CH2' ' A' ' 80' ' ' TRP . . . 61.96 147.79 0.09 OUTLIER Pre-proline 0 N--CA 1.503 2.183 0 O-C-N 121.307 -0.871 . . . . 0.0 110.691 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.56 162.63 40.83 Favored 'Trans proline' 0 C--N 1.318 -1.039 0 O-C-N 123.245 1.129 . . . . 0.0 110.675 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -48.77 -32.14 8.13 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 121.466 -0.771 . . . . 0.0 111.325 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -54.31 -33.42 52.73 Favored Glycine 0 N--CA 1.499 2.847 0 O-C-N 121.067 -1.021 . . . . 0.0 110.572 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -53.51 -31.48 46.27 Favored 'General case' 0 N--CA 1.512 2.662 0 O-C-N 120.903 -1.351 . . . . 0.0 110.818 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -54.37 -36.97 64.45 Favored 'General case' 0 N--CA 1.513 2.711 0 O-C-N 121.038 -1.039 . . . . 0.0 110.33 179.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.6 mmmt -57.14 -35.02 69.0 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.262 -0.899 . . . . 0.0 110.406 179.424 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 3.2 pt -117.32 37.55 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.137 -0.977 . . . . 0.0 110.366 179.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.435 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 2.7 tmtt? -83.79 -42.91 0.79 Allowed Pre-proline 0 N--CA 1.507 2.394 0 O-C-N 121.142 -0.974 . . . . 0.0 113.254 -179.155 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.435 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.4 Cg_endo -75.85 -39.68 0.89 Allowed 'Trans proline' 0 N--CA 1.487 1.118 0 O-C-N 122.615 0.797 . . . . 0.0 111.853 -178.306 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 90.7 m -59.39 -43.25 92.96 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 120.906 -1.121 . . . . 0.0 109.952 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.422 HD21 ' CE2' ' A' ' 86' ' ' TYR . 3.6 mt -63.48 -37.8 88.67 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 119.425 -0.91 . . . . 0.0 109.506 179.304 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.3 m -56.63 -34.82 67.65 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.058 -1.026 . . . . 0.0 110.353 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.11 -38.81 73.95 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.004 -1.06 . . . . 0.0 110.014 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.433 ' CD1' ' HD3' ' A' ' 59' ' ' ARG . 22.6 m-85 -57.85 -40.09 79.28 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.121 -0.987 . . . . 0.0 110.025 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -57.02 -27.64 61.8 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.267 -0.896 . . . . 0.0 111.066 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 2.7 mp -78.09 -35.7 20.53 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.386 0 O-C-N 120.996 -1.065 . . . . 0.0 109.423 179.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.1 tp60 -79.78 -39.85 30.0 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 120.985 -1.072 . . . . 0.0 108.61 178.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.415 ' CD1' ' CG2' ' A' ' 52' ' ' ILE . 6.6 tp -69.6 -34.31 73.93 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.235 -0.916 . . . . 0.0 110.369 179.103 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -71.01 -35.54 72.07 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 120.885 -1.134 . . . . 0.0 109.953 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -65.44 -38.58 90.29 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.062 -1.024 . . . . 0.0 110.006 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.408 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -73.81 -42.02 61.51 Favored 'General case' 0 N--CA 1.504 2.251 0 C-N-CA 118.975 -1.09 . . . . 0.0 109.097 179.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -63.76 -33.19 75.1 Favored 'General case' 0 N--CA 1.505 2.322 0 C-N-CA 119.471 -0.892 . . . . 0.0 110.129 179.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.1 mttm -82.16 -31.35 30.53 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 120.857 -1.152 . . . . 0.0 110.893 179.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -54.0 -32.73 55.05 Favored 'General case' 0 N--CA 1.512 2.653 0 O-C-N 120.97 -1.081 . . . . 0.0 110.709 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 31.2 tttt -91.72 -47.15 7.52 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.117 -0.989 . . . . 0.0 110.062 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 71.0 m 52.21 45.37 28.52 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.033 -1.042 . . . . 0.0 110.974 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.1 t 52.88 84.29 0.06 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.049 -1.032 . . . . 0.0 110.854 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 32.6 ttmt 52.49 90.02 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.099 -1.0 . . . . 0.0 110.96 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.7 tt -148.22 -58.34 0.24 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.205 -0.935 . . . . 0.0 110.486 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -115.01 -164.08 0.92 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.205 -0.934 . . . . 0.0 110.08 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -103.95 -170.7 1.81 Allowed 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.103 -0.998 . . . . 0.0 110.054 179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 52.82 73.49 0.35 Allowed 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.001 -1.062 . . . . 0.0 110.422 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.3 m -105.97 -50.89 3.08 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.227 -0.92 . . . . 0.0 110.434 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.416 ' O ' ' CG ' ' A' ' 50' ' ' TRP . 35.7 m120 -57.92 -40.01 79.36 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.168 -0.958 . . . . 0.0 109.924 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -66.13 -42.88 88.55 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.163 -0.96 . . . . 0.0 109.59 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 49.5 tp60 -68.51 -40.58 80.78 Favored 'General case' 0 N--CA 1.505 2.278 0 C-N-CA 119.293 -0.963 . . . . 0.0 109.347 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 13.1 mt -63.41 -36.85 85.1 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.238 -0.914 . . . . 0.0 109.924 179.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.449 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 53.6 m0 -58.04 -37.28 74.06 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 120.955 -1.09 . . . . 0.0 109.908 179.663 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -30.17 71.32 Favored 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 119.125 -1.03 . . . . 0.0 109.516 178.181 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.415 ' CG2' ' CD1' ' A' ' 30' ' ' LEU . 17.7 mt -69.61 -58.66 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.268 0 O-C-N 120.875 -1.14 . . . . 0.0 109.181 179.371 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.8 ptm -61.48 -29.96 70.31 Favored 'General case' 0 N--CA 1.51 2.557 0 C-N-CA 118.462 -1.295 . . . . 0.0 109.779 179.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -65.92 -38.23 88.13 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 120.887 -1.133 . . . . 0.0 109.167 178.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.403 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.3 mt -53.3 -32.23 47.82 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 120.962 -1.086 . . . . 0.0 110.182 179.108 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.439 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 72.6 t60 -55.61 -38.23 69.17 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 120.982 -1.074 . . . . 0.0 110.113 179.634 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.422 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.3 m170 -58.57 -47.17 85.18 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.091 -1.006 . . . . 0.0 109.412 179.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 -61.26 -35.64 77.82 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 119.407 -0.917 . . . . 0.0 109.219 178.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.433 ' HD3' ' CD1' ' A' ' 26' ' ' PHE . 20.2 mmm-85 -63.9 -51.14 65.88 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.105 -0.997 . . . . 0.0 109.37 179.212 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 52.0 p -60.58 -39.63 88.74 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.22 -0.925 . . . . 0.0 109.661 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.416 ' O ' ' OG1' ' A' ' 65' ' ' THR . 13.3 ttt85 -65.18 -41.76 94.28 Favored 'General case' 0 N--CA 1.504 2.255 0 C-N-CA 119.115 -1.034 . . . . 0.0 109.012 179.142 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -63.37 -50.06 71.42 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.244 -0.91 . . . . 0.0 109.502 179.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.405 HG22 HD11 ' A' ' 63' ' ' ILE . 84.9 mt -70.2 -37.68 72.31 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.292 0 O-C-N 121.211 -0.931 . . . . 0.0 109.524 179.451 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -67.56 -42.17 83.04 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.168 -0.958 . . . . 0.0 108.995 179.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.416 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 90.0 m -61.19 -40.76 95.14 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.123 -0.986 . . . . 0.0 110.322 -179.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.401 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -83.35 -33.28 25.89 Favored 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 118.894 -1.122 . . . . 0.0 112.504 -178.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.416 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 45.6 t80 -86.35 -32.12 21.15 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 120.611 -1.305 . . . . 0.0 111.927 -179.295 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -98.34 -18.98 18.04 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 120.874 -1.141 . . . . 0.0 112.721 -178.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 13.5 mtpt -119.38 -58.77 1.89 Allowed 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.483 -1.385 . . . . 0.0 110.794 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.8 tpt180 -64.53 -30.59 71.62 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.11 -0.994 . . . . 0.0 110.99 -179.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt 57.51 41.8 25.36 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 120.815 -1.178 . . . . 0.0 110.056 -179.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.07 35.46 3.93 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.409 -0.807 . . . . 0.0 109.941 179.288 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.443 HG23 HD12 ' A' ' 73' ' ' ILE . 13.8 tt -152.83 162.19 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.145 -0.972 . . . . 0.0 109.874 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.0 m -109.64 147.58 32.82 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.038 -1.039 . . . . 0.0 110.133 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.7 ttmt -45.81 -32.42 2.56 Favored 'General case' 0 N--CA 1.514 2.774 0 O-C-N 121.317 -0.865 . . . . 0.0 111.556 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.75 -50.28 73.02 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 120.987 -1.071 . . . . 0.0 109.205 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 41.7 tp -67.24 -44.48 79.35 Favored 'General case' 0 N--CA 1.505 2.292 0 C-N-CA 119.208 -0.997 . . . . 0.0 108.354 178.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.416 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 14.3 t80 -59.97 -37.58 80.04 Favored 'General case' 0 N--CA 1.507 2.397 0 C-N-CA 119.628 -0.829 . . . . 0.0 109.511 179.117 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -75.22 -40.93 58.65 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.141 -0.974 . . . . 0.0 108.902 178.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.431 ' CH2' ' HB1' ' A' ' 12' ' ' ALA . 87.4 t90 -59.26 -37.83 78.6 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.05 -1.031 . . . . 0.0 109.263 178.744 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.438 HD23 ' CD2' ' A' ' 86' ' ' TYR . 11.4 mt -66.68 -57.28 7.48 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.188 -0.945 . . . . 0.0 109.057 178.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -56.01 -27.36 22.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.406 0 O-C-N 121.228 -0.92 . . . . 0.0 110.837 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.9 tttt -89.52 -16.75 30.02 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 120.938 -1.101 . . . . 0.0 111.919 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.429 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 76.3 mm-40 -104.89 25.72 10.1 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.516 -1.365 . . . . 0.0 111.98 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.403 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 18.8 ttmt 76.64 66.92 0.05 Allowed 'General case' 0 N--CA 1.511 2.623 0 O-C-N 121.198 -0.938 . . . . 0.0 112.053 179.274 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.438 ' CD2' HD23 ' A' ' 81' ' ' LEU . 26.1 m-85 -129.95 -63.31 0.92 Allowed 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 178.751 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -135.75 171.21 14.78 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.497 -0.752 . . . . 0.0 109.23 179.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.439 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 11.0 t0 -119.49 111.72 18.46 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.151 -0.968 . . . . 0.0 110.273 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 8.3 mtpt -57.58 -37.93 73.99 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.207 -0.933 . . . . 0.0 110.077 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 17.5 tp -59.08 -37.16 76.44 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.181 -0.949 . . . . 0.0 110.163 179.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.412 HD22 ' CD2' ' A' ' 57' ' ' HIS . 58.8 tp -70.03 -49.34 52.29 Favored 'General case' 0 N--CA 1.506 2.354 0 C-N-CA 119.231 -0.988 . . . . 0.0 108.764 179.275 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.417 HG21 HD12 ' A' ' 92' ' ' ILE . 68.1 mt -57.57 -38.51 64.37 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.52 0 O-C-N 121.148 -0.97 . . . . 0.0 108.693 178.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.04 -41.59 86.29 Favored 'General case' 0 N--CA 1.502 2.165 0 C-N-CA 119.356 -0.938 . . . . 0.0 108.742 178.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 8.3 mmtm -53.21 -39.84 64.02 Favored 'General case' 0 N--CA 1.512 2.669 0 O-C-N 121.162 -0.961 . . . . 0.0 109.892 179.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 3.6 m0 -68.85 -26.48 65.17 Favored 'General case' 0 N--CA 1.508 2.447 0 C-N-CA 119.436 -0.906 . . . . 0.0 110.723 179.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.49 -33.84 25.48 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 120.809 -1.182 . . . . 0.0 110.776 179.48 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? -53.26 -177.7 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.767 0 O-C-N 120.992 -1.068 . . . . 0.0 110.793 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -102.55 146.86 27.53 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.237 -0.914 . . . . 0.0 109.525 179.1 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 86.0 0.31 87.34 Favored Glycine 0 N--CA 1.495 2.619 0 C-N-CA 119.979 -1.105 . . . . 0.0 111.277 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -111.06 67.17 0.64 Allowed 'General case' 0 N--CA 1.498 1.936 0 CA-C-N 119.576 1.688 . . . . 0.0 109.593 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -96.17 -35.35 11.34 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.111 -0.993 . . . . 0.0 110.935 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.54 63.0 0.77 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.021 -1.049 . . . . 0.0 110.895 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.5 pp -111.95 154.61 25.0 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.932 -1.105 . . . . 0.0 109.798 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.422 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.4 p -115.6 -30.47 6.16 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -178.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.553 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.5 m -142.09 -167.45 2.47 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 120.052 -1.655 . . . . 0.0 110.087 179.399 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 13.6 mt -95.53 -40.13 9.61 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.142 -0.974 . . . . 0.0 109.89 179.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -101.15 28.51 5.3 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.044 -1.035 . . . . 0.0 110.067 178.189 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.553 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.8 t -126.92 15.6 7.4 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.047 -1.033 . . . . 0.0 109.112 -179.584 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.404 ' CG2' ' O ' ' A' ' 108' ' ' CYS . 1.0 OUTLIER -159.34 38.75 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 O-C-N 120.931 -1.106 . . . . 0.0 110.345 -178.783 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -110.11 117.44 33.73 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 120.79 -1.194 . . . . 0.0 111.452 -178.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.453 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 21.9 ttmt -107.82 -57.73 2.06 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.292 -0.88 . . . . 0.0 110.18 179.34 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 50.89 -174.59 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.092 0 O-C-N 120.974 -1.079 . . . . 0.0 110.934 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -167.87 84.61 0.2 Allowed 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.194 -0.941 . . . . 0.0 111.018 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 91.1 m -144.01 -59.27 0.39 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.226 -0.921 . . . . 0.0 110.411 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -154.45 -57.63 0.11 Allowed 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.098 -1.001 . . . . 0.0 110.676 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 53.3 t-20 -119.33 73.22 0.93 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.236 -0.915 . . . . 0.0 110.203 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -93.3 128.67 9.55 Favored Glycine 0 N--CA 1.493 2.457 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 14.1 m -117.27 124.54 49.26 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.202 -1.175 . . . . 0.0 110.141 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.453 ' OG1' ' HA ' ' A' ' 111' ' ' LYS . 0.2 OUTLIER -125.41 174.82 7.91 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.208 -0.932 . . . . 0.0 110.476 -179.931 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 48.5 t -109.25 155.48 21.07 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.359 -0.838 . . . . 0.0 109.116 178.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.456 ' CG2' ' CE1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -73.65 -30.83 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 121.026 -1.046 . . . . 0.0 111.475 -179.163 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.49 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.4 p -59.79 -35.85 75.51 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 120.598 -1.314 . . . . 0.0 110.486 -179.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.03 -33.13 66.88 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.041 -1.037 . . . . 0.0 109.961 178.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 61.6 t -79.78 123.93 83.65 Favored Pre-proline 0 N--CA 1.504 2.25 0 O-C-N 121.062 -1.024 . . . . 0.0 109.965 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -66.33 -178.22 1.08 Allowed 'Trans proline' 0 N--CA 1.488 1.149 0 O-C-N 123.112 1.059 . . . . 0.0 110.785 179.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -75.06 -38.0 61.48 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.208 -0.932 . . . . 0.0 110.413 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.1 -43.37 91.87 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.052 -1.03 . . . . 0.0 109.95 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 64.1 tp60 -67.3 -41.54 85.21 Favored 'General case' 0 N--CA 1.506 2.331 0 C-N-CA 119.296 -0.962 . . . . 0.0 109.298 179.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.6 mt -63.44 -38.95 93.11 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.274 -0.891 . . . . 0.0 109.508 179.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -59.07 -39.55 82.43 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.058 -1.026 . . . . 0.0 109.989 179.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -58.59 -38.04 77.08 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.122 -0.986 . . . . 0.0 110.212 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -59.98 -41.99 93.23 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.177 -0.952 . . . . 0.0 110.048 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.49 -45.12 95.57 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.17 -0.956 . . . . 0.0 109.809 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 14.2 mmt180 -59.58 -39.26 83.55 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.155 -0.966 . . . . 0.0 109.9 179.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 3.4 ttmt -58.82 -35.75 73.39 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.148 -0.97 . . . . 0.0 110.515 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 43.8 mttt -107.74 21.62 17.16 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 120.961 -1.087 . . . . 0.0 111.827 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.5 46.26 58.57 Favored Glycine 0 N--CA 1.499 2.888 0 O-C-N 120.695 -1.253 . . . . 0.0 110.656 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.0 t -141.03 -165.06 1.87 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.155 -1.203 . . . . 0.0 110.176 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -126.54 171.98 10.62 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.12 -0.988 . . . . 0.0 110.355 -179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 8.7 p -157.06 160.94 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.326 -0.859 . . . . 0.0 110.664 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 27.3 t -167.58 107.31 0.57 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.185 -0.947 . . . . 0.0 110.911 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.49 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 84.2 t80 -108.79 160.23 16.14 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.247 -0.908 . . . . 0.0 111.035 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -138.61 -61.03 0.59 Allowed 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.587 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -142.15 149.12 39.35 Favored 'General case' 0 N--CA 1.495 1.821 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 178.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . 0.412 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 29.6 p -89.88 153.88 20.3 Favored 'General case' 0 N--CA 1.506 2.342 0 C-N-CA 119.078 -1.049 . . . . 0.0 111.187 -179.372 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 19.6 m -72.54 -23.43 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 121.428 -0.795 . . . . 0.0 111.385 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -51.52 -62.6 1.52 Allowed 'General case' 0 N--CA 1.513 2.723 0 O-C-N 120.781 -1.2 . . . . 0.0 110.021 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.449 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 21.9 p -123.9 -164.5 1.24 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.27 -0.894 . . . . 0.0 110.321 179.255 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . 0.413 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -101.58 64.45 0.5 Allowed Glycine 0 N--CA 1.493 2.462 0 N-CA-C 107.897 -2.081 . . . . 0.0 107.897 178.501 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 28.4 t -104.36 141.42 36.35 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.314 -1.109 . . . . 0.0 109.965 -179.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 46.0 ttt180 -97.06 51.01 1.1 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.271 -0.893 . . . . 0.0 109.476 179.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.2 99.32 0.05 OUTLIER Glycine 0 N--CA 1.486 2.028 0 N-CA-C 109.969 -1.252 . . . . 0.0 109.969 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 26.2 p -110.19 126.37 54.04 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.269 -1.136 . . . . 0.0 110.148 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -150.33 148.44 28.82 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.038 -1.039 . . . . 0.0 110.472 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -102.24 -45.67 5.05 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.26 -0.9 . . . . 0.0 110.562 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.97 -38.7 68.11 Favored 'General case' 0 N--CA 1.511 2.607 0 O-C-N 121.061 -1.025 . . . . 0.0 110.543 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.494 1.744 0 CA-C-O 118.019 -0.991 . . . . 0.0 110.149 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.28 0 N-CA-C 109.511 -1.435 . . . . 0.0 109.511 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -74.76 155.21 47.95 Favored Glycine 0 N--CA 1.493 2.49 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.5 t -141.79 149.83 54.61 Favored Pre-proline 0 N--CA 1.494 1.747 0 O-C-N 121.154 -1.204 . . . . 0.0 110.245 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.05 -171.22 0.74 Allowed 'Trans proline' 0 C--N 1.317 -1.109 0 O-C-N 123.388 1.204 . . . . 0.0 110.425 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 52.65 95.17 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.098 -1.001 . . . . 0.0 110.845 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.3 tp -142.43 138.66 29.28 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.236 -0.915 . . . . 0.0 110.117 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.2 tttm -134.72 -169.66 2.39 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.216 -0.927 . . . . 0.0 110.023 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.2 p -119.03 75.73 1.06 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.149 -0.969 . . . . 0.0 110.297 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 21.5 mtt180 -141.21 142.84 33.94 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.141 -0.974 . . . . 0.0 110.082 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.8 mmt85 -116.4 107.74 15.17 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.282 -0.886 . . . . 0.0 110.288 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.6 m -129.28 81.02 2.0 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.184 -0.948 . . . . 0.0 110.221 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.12 175.39 0.04 OUTLIER Pre-proline 0 N--CA 1.502 2.146 0 O-C-N 121.102 -0.999 . . . . 0.0 110.687 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.57 158.92 50.06 Favored 'Trans proline' 0 C--N 1.315 -1.193 0 O-C-N 123.405 1.213 . . . . 0.0 110.484 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.447 ' HB1' ' CH2' ' A' ' 80' ' ' TRP . . . 61.86 152.1 0.11 Allowed Pre-proline 0 N--CA 1.504 2.235 0 O-C-N 121.221 -0.925 . . . . 0.0 110.394 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.01 163.77 38.09 Favored 'Trans proline' 0 C--N 1.317 -1.095 0 O-C-N 123.387 1.204 . . . . 0.0 110.718 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -48.27 -32.39 7.22 Favored 'General case' 0 N--CA 1.516 2.841 0 O-C-N 121.435 -0.791 . . . . 0.0 111.426 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.81 -34.89 51.77 Favored Glycine 0 N--CA 1.498 2.812 0 O-C-N 120.967 -1.083 . . . . 0.0 110.417 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -55.17 -33.14 62.72 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 121.039 -1.271 . . . . 0.0 110.739 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.7 tm-20 -54.4 -38.06 65.78 Favored 'General case' 0 N--CA 1.511 2.623 0 O-C-N 120.984 -1.073 . . . . 0.0 110.206 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.8 mttm -59.06 -35.62 73.65 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.257 -0.902 . . . . 0.0 110.21 179.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 1.9 pt -117.99 37.07 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 121.074 -1.016 . . . . 0.0 110.34 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.432 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 2.5 tmtt? -84.82 -43.35 0.69 Allowed Pre-proline 0 N--CA 1.509 2.488 0 O-C-N 121.12 -0.988 . . . . 0.0 113.379 -179.041 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.432 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.7 Cg_endo -76.3 -37.15 1.52 Allowed 'Trans proline' 0 N--CA 1.486 1.065 0 O-C-N 122.586 0.782 . . . . 0.0 111.892 -178.018 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 88.2 m -59.85 -42.07 92.84 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 120.919 -1.113 . . . . 0.0 110.131 -179.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.423 HD22 ' CD2' ' A' ' 86' ' ' TYR . 2.4 mt -64.85 -39.07 92.98 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 119.387 -0.925 . . . . 0.0 109.577 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.0 -35.59 69.4 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.159 -0.963 . . . . 0.0 110.247 179.502 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -57.24 -36.33 70.8 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.056 -1.027 . . . . 0.0 110.389 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.421 ' CE2' ' HG3' ' A' ' 59' ' ' ARG . 15.5 m-85 -59.05 -39.64 82.64 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.07 -1.019 . . . . 0.0 110.525 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -59.45 -39.43 83.6 Favored 'General case' 0 N--CA 1.508 2.427 0 C-N-CA 119.362 -0.935 . . . . 0.0 110.42 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.1 mp -65.37 -41.78 92.04 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.341 0 C-N-CA 119.204 -0.998 . . . . 0.0 108.764 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.66 -50.83 40.31 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.209 -0.997 . . . . 0.0 108.443 178.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.2 tp -58.9 -34.53 71.78 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.25 -0.906 . . . . 0.0 109.502 178.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.08 -39.8 79.47 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 121.061 -1.025 . . . . 0.0 110.194 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -63.03 -51.12 67.97 Favored 'General case' 0 N--CA 1.507 2.403 0 C-N-CA 119.27 -0.972 . . . . 0.0 109.57 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.402 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -68.26 -38.71 82.03 Favored 'General case' 0 N--CA 1.505 2.314 0 C-N-CA 119.249 -0.98 . . . . 0.0 109.262 179.031 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -67.41 -34.04 76.42 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.207 -0.933 . . . . 0.0 110.117 179.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 9.2 mmtt -78.79 -38.03 39.44 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.0 -1.063 . . . . 0.0 110.293 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -58.45 -39.09 78.93 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.06 -1.025 . . . . 0.0 110.162 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 72.9 tttt -56.72 -37.53 71.09 Favored 'General case' 0 N--CA 1.511 2.579 0 O-C-N 121.131 -0.98 . . . . 0.0 110.382 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.5 m -112.04 50.3 0.86 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.113 -0.992 . . . . 0.0 110.218 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.424 ' OG ' ' HD3' ' A' ' 40' ' ' LYS . 1.6 t -142.98 -62.08 0.42 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.205 -0.935 . . . . 0.0 110.19 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.424 ' HD3' ' OG ' ' A' ' 39' ' ' SER . 0.1 OUTLIER -114.07 -54.9 2.55 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.24 -0.912 . . . . 0.0 110.209 179.969 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 54.37 47.51 22.76 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.045 -1.035 . . . . 0.0 110.656 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -120.62 -58.17 1.85 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.212 -0.93 . . . . 0.0 110.148 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -129.85 153.6 48.11 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.252 -0.905 . . . . 0.0 110.138 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.9 mmmt 52.68 61.35 3.23 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.06 -1.025 . . . . 0.0 110.678 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -111.13 -53.46 2.7 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.227 -0.921 . . . . 0.0 110.406 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -56.87 -39.44 74.33 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 121.167 -0.958 . . . . 0.0 109.962 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -61.48 -40.53 94.86 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.238 -0.914 . . . . 0.0 109.766 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 49.7 tp60 -61.4 -40.54 94.74 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.147 -0.971 . . . . 0.0 109.848 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -60.01 -39.19 84.94 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.124 -0.985 . . . . 0.0 110.083 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.436 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.8 m0 -58.09 -37.03 73.74 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.011 -1.055 . . . . 0.0 110.023 179.603 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -60.59 -30.36 69.76 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.081 -1.012 . . . . 0.0 110.089 178.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.402 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 17.1 mt -72.27 -58.78 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.237 0 O-C-N 120.871 -1.143 . . . . 0.0 109.107 179.424 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.3 ptm -60.79 -29.53 69.5 Favored 'General case' 0 N--CA 1.509 2.515 0 C-N-CA 118.52 -1.272 . . . . 0.0 109.684 178.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -70.33 -38.91 74.98 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 120.904 -1.122 . . . . 0.0 108.931 177.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 11.3 mt -53.69 -31.53 48.29 Favored 'General case' 0 N--CA 1.512 2.642 0 O-C-N 121.058 -1.026 . . . . 0.0 110.3 178.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.445 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 3.9 t60 -57.13 -37.38 71.92 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.002 -1.062 . . . . 0.0 110.097 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.439 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 5.8 m170 -59.31 -48.67 80.77 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.006 -1.059 . . . . 0.0 109.457 179.044 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.6 tp60 -60.82 -37.27 81.43 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 119.34 -0.944 . . . . 0.0 109.071 178.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.421 ' HG3' ' CE2' ' A' ' 26' ' ' PHE . 11.5 mtp85 -66.36 -51.79 53.58 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.147 -0.971 . . . . 0.0 109.024 178.7 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 22.2 p -63.46 -38.78 92.45 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.241 -0.912 . . . . 0.0 109.177 179.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.405 ' O ' ' OG1' ' A' ' 65' ' ' THR . 9.6 ttm180 -65.18 -38.82 91.72 Favored 'General case' 0 N--CA 1.507 2.41 0 C-N-CA 119.242 -0.983 . . . . 0.0 109.25 178.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -60.99 -49.8 75.99 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.155 -0.966 . . . . 0.0 109.313 179.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 87.7 mt -74.3 -41.76 50.63 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 C-N-CA 119.42 -0.912 . . . . 0.0 109.128 179.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.497 ' CD1' ' CD2' ' A' ' 68' ' ' TYR . 45.8 t80 -60.51 -35.38 75.83 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.259 -0.901 . . . . 0.0 109.653 178.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.405 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 79.7 m -74.52 -38.24 62.85 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.926 -1.109 . . . . 0.0 110.422 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.403 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -83.08 -30.86 27.66 Favored 'General case' 0 N--CA 1.505 2.288 0 C-N-CA 119.028 -1.069 . . . . 0.0 112.512 -179.046 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.416 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 42.1 t80 -86.04 -33.25 21.07 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 120.634 -1.291 . . . . 0.0 111.724 -179.203 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.497 ' CD2' ' CD1' ' A' ' 64' ' ' TYR . 29.4 m-85 -97.4 -25.73 15.11 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.708 -1.245 . . . . 0.0 112.432 -178.774 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.6 mttt -113.37 -60.14 1.92 Allowed 'General case' 0 N--CA 1.501 2.078 0 O-C-N 120.659 -1.275 . . . . 0.0 111.131 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.0 ttt85 -62.68 -31.06 71.88 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.127 -0.983 . . . . 0.0 110.641 -179.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.1 tttt 58.29 44.33 18.78 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 120.813 -1.18 . . . . 0.0 110.001 -179.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.33 36.36 3.59 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.358 -0.839 . . . . 0.0 109.891 179.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.403 ' CG2' ' CD1' ' A' ' 66' ' ' LEU . 14.2 tt -157.32 162.53 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.206 -0.934 . . . . 0.0 110.175 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.56 149.49 29.57 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.164 -0.96 . . . . 0.0 110.232 179.848 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.9 tttt -46.29 -32.35 3.06 Favored 'General case' 0 N--CA 1.515 2.807 0 O-C-N 121.362 -0.836 . . . . 0.0 111.584 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -63.1 -51.96 64.49 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.925 -1.109 . . . . 0.0 109.274 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 40.5 tp -65.04 -43.48 92.2 Favored 'General case' 0 N--CA 1.506 2.347 0 C-N-CA 119.141 -1.024 . . . . 0.0 108.559 178.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.417 ' CE1' ' CD1' ' A' ' 82' ' ' ILE . 14.0 t80 -60.99 -41.72 97.03 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.301 -0.875 . . . . 0.0 109.242 179.151 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -70.57 -42.69 70.77 Favored 'General case' 0 N--CA 1.503 2.221 0 C-N-CA 119.321 -0.951 . . . . 0.0 108.518 178.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.447 ' CH2' ' HB1' ' A' ' 12' ' ' ALA . 86.6 t90 -56.99 -35.19 68.89 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.338 -0.851 . . . . 0.0 109.519 178.526 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.45 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 13.4 mt -67.53 -57.94 5.6 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.084 -1.01 . . . . 0.0 109.081 179.077 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.417 ' CD1' ' CE1' ' A' ' 78' ' ' TYR . 0.5 OUTLIER -57.24 -27.22 27.45 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.685 0 C-N-CA 119.044 -1.063 . . . . 0.0 109.897 179.218 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -83.34 -20.42 34.35 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 120.885 -1.134 . . . . 0.0 111.391 179.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.422 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 16.5 mm-40 -107.21 22.97 15.17 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 120.652 -1.28 . . . . 0.0 111.989 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 8.1 tttp 74.44 78.45 0.12 Allowed 'General case' 0 N--CA 1.511 2.61 0 O-C-N 121.072 -1.017 . . . . 0.0 111.37 179.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.45 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 28.4 m-85 -136.52 -63.79 0.61 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.622 -0.674 . . . . 0.0 109.707 -179.781 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -128.5 -173.42 2.95 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.349 -0.844 . . . . 0.0 109.755 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.445 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 7.8 t0 -126.18 102.57 7.26 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.151 -0.968 . . . . 0.0 110.53 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.6 mtmt -59.37 -38.48 80.57 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 121.184 -0.948 . . . . 0.0 109.95 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 26.0 tp -60.44 -41.71 94.62 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.194 -0.941 . . . . 0.0 109.864 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.424 HD21 ' CD2' ' A' ' 57' ' ' HIS . 60.5 tp -67.01 -49.42 65.38 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.068 -1.02 . . . . 0.0 108.961 179.321 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.445 ' CG2' ' CE1' ' A' ' 64' ' ' TYR . 40.7 mt -56.81 -36.36 49.32 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.47 0 O-C-N 121.124 -0.985 . . . . 0.0 108.918 178.609 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.77 -39.64 94.79 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.121 -0.987 . . . . 0.0 109.082 178.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.435 ' NZ ' ' OH ' ' A' ' 100' ' ' TYR . 4.3 mmtt -59.32 -46.58 88.19 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.087 -1.008 . . . . 0.0 109.276 179.274 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.0 m0 -60.17 -37.54 80.48 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.247 -0.908 . . . . 0.0 110.111 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.6 mtp85 -75.14 -31.92 61.21 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.064 -1.023 . . . . 0.0 110.615 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -53.97 -176.9 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.699 0 O-C-N 121.014 -1.054 . . . . 0.0 110.572 179.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 2.4 m -102.89 133.38 48.08 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.183 -0.948 . . . . 0.0 109.751 179.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.39 9.09 57.08 Favored Glycine 0 N--CA 1.493 2.486 0 C-N-CA 120.152 -1.023 . . . . 0.0 111.242 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.435 ' OH ' ' NZ ' ' A' ' 94' ' ' LYS . 51.4 m-85 -116.08 69.02 0.73 Allowed 'General case' 0 N--CA 1.495 1.801 0 CA-C-N 119.569 1.685 . . . . 0.0 109.971 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -97.29 -35.25 10.79 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.143 -0.973 . . . . 0.0 110.915 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.98 71.88 0.95 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.999 -1.063 . . . . 0.0 110.8 -179.611 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.3 pp -123.58 161.78 24.3 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.038 -1.039 . . . . 0.0 109.946 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.439 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.8 p -120.48 -33.0 3.95 Favored 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -178.83 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.549 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.8 m -140.92 -168.39 2.59 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.067 -1.646 . . . . 0.0 110.162 179.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 13.2 mt -95.47 -39.4 10.0 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.235 -0.916 . . . . 0.0 109.909 178.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 9.3 ttm180 -101.15 27.23 6.28 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.913 -1.117 . . . . 0.0 110.271 178.174 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.549 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.287 1.8 t -124.82 14.38 8.6 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.054 -1.029 . . . . 0.0 109.213 -179.779 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -158.67 35.64 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.339 0 O-C-N 120.714 -1.241 . . . . 0.0 111.116 -178.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -136.31 152.76 51.03 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 120.604 -1.31 . . . . 0.0 111.498 -178.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.435 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 0.0 OUTLIER -132.13 -176.09 3.95 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.213 -0.93 . . . . 0.0 110.065 179.581 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -124.29 175.92 6.77 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.247 -0.908 . . . . 0.0 110.24 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -116.13 154.21 30.39 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.147 -0.971 . . . . 0.0 110.124 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 65.32 -68.53 0.11 Allowed 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.13 -0.982 . . . . 0.0 110.888 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 13.6 t30 -149.21 -172.76 4.2 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.837 -1.164 . . . . 0.0 110.457 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 4.0 t30 53.05 50.94 16.76 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 120.945 -1.097 . . . . 0.0 110.794 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -83.19 134.61 12.99 Favored Glycine 0 N--CA 1.493 2.485 0 N-CA-C 109.469 -1.452 . . . . 0.0 109.469 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 13.8 m -147.06 95.16 2.52 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.174 -1.192 . . . . 0.0 110.48 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.435 ' OG1' ' HA ' ' A' ' 111' ' ' LYS . 2.8 m -132.96 169.84 16.22 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.22 -0.925 . . . . 0.0 110.069 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 46.7 t -101.49 155.55 18.01 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.259 -0.9 . . . . 0.0 109.785 179.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.448 ' CD1' ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -71.64 -37.47 63.33 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.347 0 O-C-N 121.087 -1.008 . . . . 0.0 110.682 -179.554 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.492 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 9.2 p -52.82 -32.98 47.13 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 120.953 -1.092 . . . . 0.0 111.262 -178.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -33.19 68.71 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 120.907 -1.121 . . . . 0.0 109.852 178.34 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 48.4 t -81.11 125.73 78.85 Favored Pre-proline 0 N--CA 1.503 2.216 0 O-C-N 121.1 -1.0 . . . . 0.0 109.746 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -65.91 172.02 9.04 Favored 'Trans proline' 0 N--CA 1.489 1.224 0 O-C-N 123.145 1.076 . . . . 0.0 110.815 179.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 5.1 tpt180 -75.07 -37.88 61.47 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.304 -0.873 . . . . 0.0 110.426 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.53 -40.28 78.45 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.071 -1.018 . . . . 0.0 110.107 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -69.41 -40.89 77.03 Favored 'General case' 0 N--CA 1.505 2.302 0 C-N-CA 119.344 -0.942 . . . . 0.0 109.333 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.3 mt -67.14 -38.93 86.39 Favored 'General case' 0 N--CA 1.507 2.377 0 C-N-CA 119.494 -0.882 . . . . 0.0 109.591 179.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -65.96 -40.07 90.96 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.133 -0.98 . . . . 0.0 109.573 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.71 -39.64 94.66 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.165 -0.959 . . . . 0.0 109.791 179.551 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -60.41 -41.78 94.64 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.287 -0.883 . . . . 0.0 110.031 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.41 -40.63 91.69 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.223 -0.923 . . . . 0.0 110.025 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -60.16 -39.59 86.94 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.239 -0.913 . . . . 0.0 109.95 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -61.76 -34.92 76.71 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.247 -0.908 . . . . 0.0 110.697 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.14 19.24 19.93 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 120.948 -1.095 . . . . 0.0 111.942 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 53.35 41.47 62.7 Favored Glycine 0 N--CA 1.5 2.903 0 O-C-N 120.612 -1.305 . . . . 0.0 110.593 179.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.7 t -131.54 -163.49 1.33 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.091 -1.241 . . . . 0.0 109.969 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -142.1 140.78 32.61 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.131 -0.981 . . . . 0.0 110.494 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.4 p -131.87 161.2 41.69 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.186 -0.946 . . . . 0.0 109.886 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 33.2 t -167.59 83.25 0.21 Allowed 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.175 -0.953 . . . . 0.0 111.48 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.492 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 36.5 t80 -93.56 162.1 14.09 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.187 -0.946 . . . . 0.0 109.943 179.501 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -139.07 -59.51 0.59 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.417 -0.802 . . . . 0.0 109.379 179.129 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.82 152.14 51.51 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.324 -0.86 . . . . 0.0 109.384 179.179 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 25.1 p -97.19 156.89 16.21 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.21 -0.931 . . . . 0.0 110.894 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 12.9 p -77.83 -22.18 13.84 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.509 0 O-C-N 121.337 -0.852 . . . . 0.0 111.872 -179.472 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -50.96 -57.88 7.44 Favored 'General case' 0 N--CA 1.516 2.839 0 O-C-N 120.834 -1.166 . . . . 0.0 109.9 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.436 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.8 p -128.78 -163.43 1.29 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.303 -0.873 . . . . 0.0 110.279 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.41 65.22 0.57 Allowed Glycine 0 N--CA 1.493 2.435 0 N-CA-C 108.036 -2.026 . . . . 0.0 108.036 178.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 37.3 t -104.59 147.36 27.71 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.31 -1.111 . . . . 0.0 110.297 -178.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 28.7 mtt85 -102.79 42.94 1.11 Allowed 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.327 -0.858 . . . . 0.0 109.482 179.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 77.06 96.72 0.19 Allowed Glycine 0 N--CA 1.487 2.08 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 22.7 p -111.53 128.42 56.02 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.23 -1.159 . . . . 0.0 110.554 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -154.83 145.86 22.68 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.162 -0.962 . . . . 0.0 110.474 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -119.21 -57.61 1.99 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.199 -0.938 . . . . 0.0 110.349 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -151.24 39.25 0.66 Allowed 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.195 -0.941 . . . . 0.0 110.588 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 . . . . . 0 N--CA 1.494 1.773 0 O-C-N 121.129 -0.982 . . . . 0.0 110.169 -179.958 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.361 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -117.34 75.02 0.28 Allowed Glycine 0 N--CA 1.493 2.494 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.3 p -136.45 94.59 13.51 Favored Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.114 -1.227 . . . . 0.0 110.198 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.32 123.4 9.14 Favored 'Trans proline' 0 C--N 1.317 -1.116 0 O-C-N 123.426 1.224 . . . . 0.0 110.467 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.2 ptt-85 -137.61 64.21 1.53 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.206 -0.934 . . . . 0.0 110.187 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 8.0 tt -132.88 149.32 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.077 -1.014 . . . . 0.0 110.279 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.2 tttt -137.3 151.96 49.23 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.206 -0.934 . . . . 0.0 110.28 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 26.5 m -128.69 135.08 48.76 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.18 -0.95 . . . . 0.0 110.246 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 19.5 mtt85 -120.49 118.3 29.9 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.191 -0.943 . . . . 0.0 110.184 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.06 -60.42 0.68 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.264 -0.898 . . . . 0.0 110.322 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.1 t -164.2 167.23 20.29 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.119 -0.988 . . . . 0.0 110.953 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.74 98.78 24.01 Favored Pre-proline 0 N--CA 1.494 1.774 0 O-C-N 121.182 -0.949 . . . . 0.0 110.077 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -71.55 158.13 54.51 Favored 'Trans proline' 0 C--N 1.316 -1.154 0 O-C-N 123.45 1.237 . . . . 0.0 110.847 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.453 ' HB3' ' CH2' ' A' ' 80' ' ' TRP . . . -65.89 145.78 99.01 Favored Pre-proline 0 N--CA 1.51 2.539 0 O-C-N 121.406 -0.809 . . . . 0.0 109.615 179.742 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -70.6 162.26 43.13 Favored 'Trans proline' 0 N--CA 1.487 1.13 0 O-C-N 123.335 1.177 . . . . 0.0 110.772 -179.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -48.53 -32.03 7.36 Favored 'General case' 0 N--CA 1.514 2.772 0 O-C-N 121.443 -0.786 . . . . 0.0 111.402 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.12 -34.0 38.74 Favored Glycine 0 N--CA 1.499 2.867 0 O-C-N 120.938 -1.101 . . . . 0.0 110.641 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.413 ' CE2' ' HG2' ' A' ' 20' ' ' LYS . 27.2 t80 -55.19 -32.4 62.17 Favored 'General case' 0 N--CA 1.511 2.585 0 O-C-N 120.882 -1.363 . . . . 0.0 110.795 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -53.15 -37.84 62.21 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 120.975 -1.078 . . . . 0.0 110.276 179.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.5 mmtt -59.56 -36.48 76.27 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.579 -0.848 . . . . 0.0 110.213 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.421 HG21 ' OH ' ' A' ' 62' ' ' TYR . 2.2 pt -120.79 35.6 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.175 -0.953 . . . . 0.0 110.602 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -85.22 -43.11 0.66 Allowed Pre-proline 0 N--CA 1.509 2.522 0 O-C-N 121.052 -1.03 . . . . 0.0 113.561 -178.892 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.1 Cg_endo -75.37 -35.86 2.66 Favored 'Trans proline' 0 N--CA 1.486 1.051 0 O-C-N 122.521 0.748 . . . . 0.0 112.007 -177.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 79.5 m -61.83 -46.38 89.75 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 120.982 -1.074 . . . . 0.0 109.945 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.418 HD22 ' CD2' ' A' ' 86' ' ' TYR . 5.0 mt -60.8 -37.2 81.13 Favored 'General case' 0 N--CA 1.507 2.397 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.812 179.512 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 72.6 m -57.22 -36.45 70.91 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 121.066 -1.021 . . . . 0.0 110.22 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -57.4 -38.82 74.93 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.06 -1.025 . . . . 0.0 110.081 179.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.449 ' CD2' ' CD ' ' A' ' 59' ' ' ARG . 15.0 m-85 -58.24 -40.03 80.67 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.094 -1.004 . . . . 0.0 110.131 179.697 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -59.18 -24.45 63.09 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.247 -0.908 . . . . 0.0 111.406 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 2.8 mp -77.96 -36.22 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.459 0 O-C-N 120.877 -1.14 . . . . 0.0 109.851 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 44.1 tt0 -80.73 -37.18 30.99 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.006 -1.058 . . . . 0.0 109.311 178.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.74 -31.84 63.55 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.134 -0.979 . . . . 0.0 110.164 179.023 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.0 ptm85 -71.3 -36.74 71.75 Favored 'General case' 0 N--CA 1.505 2.302 0 C-N-CA 118.738 -1.185 . . . . 0.0 109.724 179.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.42 -41.4 98.71 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.069 -1.052 . . . . 0.0 109.168 179.107 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.411 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -68.62 -43.13 77.04 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.221 -0.925 . . . . 0.0 109.05 179.053 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.84 -38.36 85.22 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.312 -0.868 . . . . 0.0 109.604 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -57.7 -34.49 69.5 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 121.125 -0.984 . . . . 0.0 110.467 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -55.8 -36.88 67.89 Favored 'General case' 0 N--CA 1.511 2.608 0 O-C-N 121.078 -1.014 . . . . 0.0 110.335 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -55.27 -39.29 69.64 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 121.059 -1.025 . . . . 0.0 110.369 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 60.1 p -115.24 39.74 2.85 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.209 -0.932 . . . . 0.0 110.2 179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.1 p -168.38 106.74 0.48 Allowed 'General case' 0 N--CA 1.502 2.125 0 O-C-N 121.246 -0.909 . . . . 0.0 110.664 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.6 tptp 53.66 94.55 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.022 -1.049 . . . . 0.0 110.305 -179.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -130.69 65.62 1.54 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.193 -0.942 . . . . 0.0 110.407 -179.697 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -112.22 -55.05 2.56 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.063 -1.023 . . . . 0.0 110.106 179.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -122.84 159.43 28.16 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.212 -0.93 . . . . 0.0 110.164 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.2 ttpp 52.87 59.65 4.32 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 121.0 -1.063 . . . . 0.0 110.777 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 68.4 m -113.5 -54.81 2.58 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.192 -0.942 . . . . 0.0 110.392 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -55.54 -37.88 68.54 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.202 -0.936 . . . . 0.0 110.092 179.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -60.32 -39.73 88.07 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.269 -0.894 . . . . 0.0 109.998 179.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.4 tp60 -61.73 -40.9 96.73 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.157 -0.964 . . . . 0.0 109.819 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 16.9 mt -61.12 -37.86 84.31 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.243 -0.911 . . . . 0.0 110.146 179.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 49.3 m0 -58.8 -37.75 77.05 Favored 'General case' 0 N--CA 1.511 2.596 0 O-C-N 121.146 -0.971 . . . . 0.0 110.086 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -61.81 -31.02 71.22 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.038 -1.039 . . . . 0.0 109.83 178.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.411 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 79.3 mt -71.81 -59.25 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.272 0 O-C-N 121.078 -1.014 . . . . 0.0 109.047 179.238 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -60.86 -29.45 69.54 Favored 'General case' 0 N--CA 1.509 2.523 0 C-N-CA 118.626 -1.23 . . . . 0.0 109.948 178.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -70.15 -37.82 75.33 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 120.808 -1.182 . . . . 0.0 109.136 178.277 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.422 HD22 ' CE2' ' A' ' 26' ' ' PHE . 11.7 mt -54.35 -33.02 58.16 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.146 -0.971 . . . . 0.0 110.296 179.109 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.454 ' NE2' ' N ' ' A' ' 88' ' ' ASP . 5.5 t60 -55.67 -37.33 68.14 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 120.993 -1.067 . . . . 0.0 110.205 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.442 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.0 m170 -61.48 -49.81 75.28 Favored 'General case' 0 N--CA 1.507 2.412 0 C-N-CA 119.254 -0.978 . . . . 0.0 109.332 179.231 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -60.33 -38.51 83.97 Favored 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 119.346 -0.942 . . . . 0.0 109.074 178.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.449 ' CD ' ' CD2' ' A' ' 26' ' ' PHE . 9.3 mtp180 -64.42 -51.49 62.89 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.256 -0.902 . . . . 0.0 109.315 178.753 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.0 p -60.75 -37.5 82.02 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.198 -0.939 . . . . 0.0 109.61 179.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.414 ' O ' ' OG1' ' A' ' 65' ' ' THR . 8.2 tpp180 -64.78 -39.76 94.14 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.058 -1.026 . . . . 0.0 109.442 179.17 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.421 ' OH ' HG21 ' A' ' 19' ' ' ILE . 26.6 t80 -61.58 -49.19 77.66 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.124 -0.985 . . . . 0.0 109.487 179.491 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.453 ' CG2' ' CD1' ' A' ' 78' ' ' TYR . 74.3 mt -73.34 -41.64 57.34 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.381 0 O-C-N 121.232 -0.918 . . . . 0.0 109.0 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.415 ' CE1' HG21 ' A' ' 92' ' ' ILE . 66.3 t80 -62.64 -40.44 97.0 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.309 -0.869 . . . . 0.0 109.386 179.303 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.414 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 86.7 m -66.53 -40.83 89.32 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.997 -1.064 . . . . 0.0 110.477 -179.689 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.404 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -83.2 -32.76 26.37 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 120.922 -1.111 . . . . 0.0 112.643 -178.76 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -86.28 -32.45 21.08 Favored 'General case' 0 N--CA 1.513 2.697 0 O-C-N 120.635 -1.291 . . . . 0.0 111.953 -178.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -97.98 -18.19 18.76 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.632 -1.293 . . . . 0.0 112.674 -178.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.1 mttm -118.64 -58.92 1.92 Allowed 'General case' 0 N--CA 1.503 2.187 0 O-C-N 120.574 -1.329 . . . . 0.0 110.676 179.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 -67.63 -29.25 68.51 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.204 -0.935 . . . . 0.0 110.984 -179.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.7 mttt 56.45 42.92 26.83 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 120.858 -1.151 . . . . 0.0 109.971 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.45 34.68 3.8 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.482 -0.761 . . . . 0.0 109.851 179.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.464 HD13 HG23 ' A' ' 73' ' ' ILE . 13.8 tt -152.52 162.6 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.197 -0.94 . . . . 0.0 109.753 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.0 m -108.36 144.81 35.41 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.106 -0.996 . . . . 0.0 110.434 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.4 tttp -45.9 -32.28 2.59 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.302 -0.874 . . . . 0.0 111.636 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.63 -49.67 75.65 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 120.861 -1.149 . . . . 0.0 109.312 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 37.0 tp -68.24 -44.54 75.45 Favored 'General case' 0 N--CA 1.506 2.348 0 C-N-CA 119.148 -1.021 . . . . 0.0 108.294 178.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.453 ' CD1' ' CG2' ' A' ' 63' ' ' ILE . 13.4 t80 -59.78 -37.51 79.28 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.369 -0.832 . . . . 0.0 109.471 179.091 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -71.33 -41.58 69.64 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 120.981 -1.074 . . . . 0.0 108.919 178.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.453 ' CH2' ' HB3' ' A' ' 12' ' ' ALA . 63.3 t90 -57.11 -39.59 75.38 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.172 -0.955 . . . . 0.0 109.512 179.095 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.419 ' HG ' ' CD2' ' A' ' 86' ' ' TYR . 3.7 mp -65.92 -50.85 62.96 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.222 -0.924 . . . . 0.0 109.183 179.127 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.9 mm -56.42 -34.62 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.658 0 O-C-N 121.121 -0.987 . . . . 0.0 110.02 179.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.7 mmtt -89.44 -5.8 57.06 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 120.947 -1.095 . . . . 0.0 112.526 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.429 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 45.9 mm-40 -114.99 24.16 11.95 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 120.447 -1.408 . . . . 0.0 112.05 -179.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.5 tttt 75.45 71.18 0.09 Allowed 'General case' 0 N--CA 1.512 2.657 0 O-C-N 121.159 -0.963 . . . . 0.0 111.724 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.419 ' CD2' ' HG ' ' A' ' 81' ' ' LEU . 27.2 m-85 -131.56 -62.48 0.87 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.468 -0.77 . . . . 0.0 109.255 179.29 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -136.49 175.92 9.17 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.49 -0.756 . . . . 0.0 109.528 179.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.454 ' N ' ' NE2' ' A' ' 56' ' ' HIS . 13.4 t0 -114.79 108.85 17.31 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.186 -0.946 . . . . 0.0 110.417 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 11.2 mtpp -59.02 -40.32 84.64 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.153 -0.967 . . . . 0.0 109.732 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 16.0 tp -60.08 -37.84 81.1 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.202 -0.936 . . . . 0.0 109.946 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.432 HD21 ' NE2' ' A' ' 57' ' ' HIS . 64.5 tp -68.82 -50.02 53.61 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.013 -1.054 . . . . 0.0 108.808 179.336 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.415 HG21 ' CE1' ' A' ' 64' ' ' TYR . 50.0 mt -57.85 -36.62 56.29 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.511 0 O-C-N 121.179 -0.951 . . . . 0.0 108.803 178.41 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.31 -39.7 89.47 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.178 -0.951 . . . . 0.0 109.244 178.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.43 ' HD2' ' CE2' ' A' ' 100' ' ' TYR . 7.0 mmtt -57.8 -46.1 85.13 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.088 -1.008 . . . . 0.0 109.395 179.313 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.1 m0 -58.24 -25.67 61.99 Favored 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 119.186 -1.006 . . . . 0.0 110.484 179.375 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.7 24.46 12.88 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 120.927 -1.108 . . . . 0.0 111.461 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.6 mmtt -92.52 -83.44 0.3 Allowed 'General case' 0 N--CA 1.505 2.284 0 O-C-N 120.694 -1.254 . . . . 0.0 109.897 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 5.9 t -177.52 128.88 0.15 Allowed 'General case' 0 N--CA 1.506 2.358 0 O-C-N 120.843 -1.161 . . . . 0.0 110.764 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.21 11.81 79.48 Favored Glycine 0 N--CA 1.492 2.376 0 C-N-CA 120.131 -1.033 . . . . 0.0 111.551 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.43 ' CE2' ' HD2' ' A' ' 94' ' ' LYS . 20.0 m-85 -100.5 46.88 0.94 Allowed 'General case' 0 N--CA 1.504 2.261 0 CA-C-N 119.746 1.773 . . . . 0.0 110.239 179.389 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -62.93 -39.96 96.19 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.163 -0.961 . . . . 0.0 109.539 179.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.422 ' HB2' ' OG ' ' A' ' 155' ' ' SER . 1.0 OUTLIER -111.94 100.45 8.9 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.215 -0.928 . . . . 0.0 109.684 179.358 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 9.6 tp -137.41 132.63 33.73 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.226 -0.921 . . . . 0.0 109.925 -179.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.442 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.0 p -109.5 -37.53 5.69 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.286 -0.883 . . . . 0.0 112.197 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.585 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.4 m -140.57 -168.03 2.48 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 120.355 -1.466 . . . . 0.0 110.001 179.018 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 12.5 mt -97.41 -38.38 9.64 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.007 -1.058 . . . . 0.0 110.489 179.277 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 26.8 ttt85 -102.21 31.64 3.88 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 120.995 -1.066 . . . . 0.0 109.614 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.585 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.305 1.7 t -126.94 15.47 7.4 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.193 -0.942 . . . . 0.0 109.003 -179.279 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.1 pt -158.59 36.87 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.361 0 O-C-N 120.799 -1.188 . . . . 0.0 110.844 -178.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -122.26 137.44 54.84 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 120.735 -1.228 . . . . 0.0 111.563 -178.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.442 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 15.7 ptpt -130.24 154.81 47.2 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.166 -0.959 . . . . 0.0 110.392 179.494 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -158.59 -56.54 0.07 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.209 -0.932 . . . . 0.0 110.801 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -131.23 -165.47 1.57 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.231 -0.918 . . . . 0.0 110.159 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.58 53.48 1.99 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.133 -0.979 . . . . 0.0 110.233 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -115.41 -54.92 2.5 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.116 -0.99 . . . . 0.0 110.458 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 15.5 p-10 -125.79 -169.93 2.09 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.104 -0.998 . . . . 0.0 110.339 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -58.69 108.86 1.7 Allowed Glycine 0 N--CA 1.495 2.622 0 N-CA-C 109.915 -1.274 . . . . 0.0 109.915 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 4.0 m -115.38 -55.74 2.42 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.279 -1.13 . . . . 0.0 110.536 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.442 ' OG1' ' HA ' ' A' ' 111' ' ' LYS . 0.7 OUTLIER -111.47 174.23 5.97 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.192 -0.942 . . . . 0.0 110.353 -179.92 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 44.4 t -105.02 155.26 19.13 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.409 -0.807 . . . . 0.0 109.575 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.444 HD12 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -70.47 -36.28 65.63 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 121.151 -0.968 . . . . 0.0 110.872 -179.374 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.475 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.9 p -54.83 -32.49 60.53 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 120.809 -1.182 . . . . 0.0 110.932 -179.153 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.26 -34.87 75.87 Favored 'General case' 0 N--CA 1.509 2.525 0 O-C-N 120.986 -1.071 . . . . 0.0 109.415 178.047 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 48.4 t -79.84 126.0 81.0 Favored Pre-proline 0 N--CA 1.504 2.267 0 O-C-N 121.109 -0.994 . . . . 0.0 109.707 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -65.65 172.3 8.3 Favored 'Trans proline' 0 N--CA 1.489 1.255 0 O-C-N 123.159 1.083 . . . . 0.0 110.795 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.1 -37.55 61.47 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.287 -0.883 . . . . 0.0 110.548 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.68 -41.0 80.71 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.071 -1.018 . . . . 0.0 110.044 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -69.48 -41.58 75.98 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.175 -0.953 . . . . 0.0 109.187 179.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.9 mt -65.86 -39.26 90.56 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.258 -0.901 . . . . 0.0 109.455 179.088 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -60.93 -39.69 90.42 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.199 -0.938 . . . . 0.0 109.829 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -59.62 -38.14 80.51 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.208 -0.933 . . . . 0.0 110.188 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -61.16 -44.61 97.04 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.209 -0.932 . . . . 0.0 109.929 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.27 -41.53 93.49 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.103 -0.998 . . . . 0.0 109.961 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.57 -35.37 72.26 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.187 -0.946 . . . . 0.0 110.322 179.652 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 21.3 mttm -71.74 -32.55 67.86 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.088 -1.007 . . . . 0.0 110.94 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 33.8 mttm -98.26 19.35 14.41 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.923 -1.111 . . . . 0.0 111.829 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 54.56 43.59 78.28 Favored Glycine 0 N--CA 1.498 2.825 0 O-C-N 120.591 -1.318 . . . . 0.0 110.502 179.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 7.3 t -142.88 -164.78 1.91 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.127 -1.219 . . . . 0.0 110.088 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.5 mp0 -138.25 149.57 45.87 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.193 -0.942 . . . . 0.0 110.407 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.5 p -131.86 161.49 41.19 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.165 -0.96 . . . . 0.0 109.949 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 29.1 t -165.79 88.88 0.41 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.164 -0.96 . . . . 0.0 111.167 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.475 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 47.1 t80 -97.58 159.9 14.65 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.317 -0.864 . . . . 0.0 110.239 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 53.4 m-70 -137.11 -61.6 0.65 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.482 -0.761 . . . . 0.0 109.001 179.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -133.63 151.96 51.79 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.41 -0.806 . . . . 0.0 108.912 178.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 31.2 p -92.92 153.19 18.93 Favored 'General case' 0 N--CA 1.504 2.243 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.179 -179.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 27.0 m -71.64 -25.94 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 O-C-N 121.396 -0.815 . . . . 0.0 111.387 -179.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -50.65 -55.42 16.49 Favored 'General case' 0 N--CA 1.515 2.779 0 O-C-N 120.764 -1.21 . . . . 0.0 110.079 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 25.5 p -130.96 -165.64 1.59 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.276 -0.89 . . . . 0.0 110.566 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.77 56.61 0.76 Allowed Glycine 0 N--CA 1.493 2.457 0 N-CA-C 107.961 -2.056 . . . . 0.0 107.961 178.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 17.7 t -99.99 142.25 31.72 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.374 -1.074 . . . . 0.0 109.85 -179.225 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 5.2 mtt-85 -95.46 53.69 1.51 Allowed 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.301 -0.874 . . . . 0.0 109.593 179.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 64.5 96.68 0.02 OUTLIER Glycine 0 N--CA 1.487 2.087 0 N-CA-C 109.915 -1.274 . . . . 0.0 109.915 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 26.2 p -106.3 124.8 50.15 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.311 -1.111 . . . . 0.0 110.048 179.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -134.59 135.31 42.12 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.131 -0.981 . . . . 0.0 110.1 -179.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' SER . . . . . 0.422 ' OG ' ' HB2' ' A' ' 102' ' ' LYS . 0.7 OUTLIER -104.31 41.43 1.31 Allowed 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.231 -0.918 . . . . 0.0 109.855 179.647 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -156.26 -56.73 0.09 Allowed 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.331 -0.855 . . . . 0.0 110.656 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 . . . . . 0 N--CA 1.494 1.732 0 CA-C-O 118.033 -0.984 . . . . 0.0 110.254 179.865 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.333 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 95.1 -131.57 10.75 Favored Glycine 0 N--CA 1.493 2.46 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 -179.996 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.23 90.27 50.96 Favored Pre-proline 0 N--CA 1.493 1.721 0 O-C-N 121.292 -1.122 . . . . 0.0 110.214 -179.981 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.98 123.31 8.8 Favored 'Trans proline' 0 C--N 1.317 -1.109 0 O-C-N 123.493 1.26 . . . . 0.0 110.432 -179.92 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 18.9 mtm180 -120.18 109.72 15.76 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.183 -0.948 . . . . 0.0 110.205 -179.985 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 82.0 mt -127.67 134.61 65.13 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 O-C-N 121.192 -0.942 . . . . 0.0 109.945 -179.901 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 30.7 tptt -143.6 50.2 1.38 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.284 -0.885 . . . . 0.0 110.27 179.983 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -129.09 111.43 12.95 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.221 -0.924 . . . . 0.0 110.232 -179.973 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -122.47 103.9 9.02 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.172 -0.955 . . . . 0.0 110.169 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 48.2 mtm180 -127.62 84.36 2.25 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.16 -0.963 . . . . 0.0 110.225 -179.967 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.8 t -143.2 46.04 1.54 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.191 -0.943 . . . . 0.0 110.325 179.888 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.7 mmtt -127.49 93.07 41.57 Favored Pre-proline 0 N--CA 1.494 1.742 0 O-C-N 121.201 -0.937 . . . . 0.0 110.218 -179.973 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -73.85 158.59 46.34 Favored 'Trans proline' 0 C--N 1.317 -1.09 0 O-C-N 123.399 1.21 . . . . 0.0 110.668 179.948 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.429 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -94.19 146.63 31.94 Favored Pre-proline 0 N--CA 1.502 2.147 0 O-C-N 121.404 -0.81 . . . . 0.0 109.738 179.542 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.31 162.01 43.84 Favored 'Trans proline' 0 C--N 1.317 -1.109 0 O-C-N 123.335 1.176 . . . . 0.0 110.833 -179.421 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -48.79 -31.92 7.82 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.476 -0.765 . . . . 0.0 111.358 -179.828 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.5 -34.95 43.5 Favored Glycine 0 N--CA 1.498 2.825 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 179.776 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -55.95 -33.45 64.76 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 121.057 -1.261 . . . . 0.0 110.656 179.814 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -53.9 -37.94 64.29 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.085 -1.01 . . . . 0.0 110.149 179.693 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 44.1 mmtt -59.55 -37.38 78.26 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.268 -0.895 . . . . 0.0 110.045 179.504 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.452 ' CG2' ' OH ' ' A' ' 62' ' ' TYR . 2.1 pt -116.37 35.29 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.182 -0.949 . . . . 0.0 110.552 179.814 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.423 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 4.5 tttt -84.38 -42.89 0.73 Allowed Pre-proline 0 N--CA 1.509 2.491 0 O-C-N 121.136 -0.977 . . . . 0.0 113.334 -179.163 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.0 Cg_endo -75.44 -35.17 2.99 Favored 'Trans proline' 0 N--CA 1.486 1.073 0 O-C-N 122.467 0.72 . . . . 0.0 111.805 -178.138 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 85.4 m -61.62 -46.79 88.32 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 120.932 -1.105 . . . . 0.0 109.896 -179.875 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.1 mt -62.58 -39.61 94.24 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 119.4 -0.92 . . . . 0.0 109.605 179.446 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.7 m -57.62 -35.69 70.81 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 121.123 -0.985 . . . . 0.0 110.256 179.524 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -57.6 -36.42 71.72 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 121.089 -1.007 . . . . 0.0 110.287 179.756 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.424 ' CD1' ' HD2' ' A' ' 59' ' ' ARG . 16.7 m-85 -57.42 -39.98 77.34 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.062 -1.024 . . . . 0.0 110.323 179.994 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -60.38 -23.28 64.19 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.224 -0.922 . . . . 0.0 111.514 -179.668 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 2.8 mp -81.18 -34.2 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.347 0 O-C-N 120.776 -1.202 . . . . 0.0 109.738 179.655 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.6 tp60 -80.96 -36.32 31.02 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.948 -1.095 . . . . 0.0 109.453 178.752 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.12 -31.83 61.23 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.131 -0.981 . . . . 0.0 109.96 178.913 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -70.17 -36.15 74.48 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 120.865 -1.147 . . . . 0.0 109.745 179.196 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.33 -41.85 93.54 Favored 'General case' 0 N--CA 1.507 2.387 0 C-N-CA 119.145 -1.022 . . . . 0.0 109.329 179.407 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.401 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -69.06 -42.16 76.63 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.301 -0.874 . . . . 0.0 109.53 179.323 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -68.67 -30.89 69.67 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.344 -0.847 . . . . 0.0 110.435 179.575 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.1 mtpt -92.07 -31.46 15.54 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 120.99 -1.068 . . . . 0.0 111.088 -179.971 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -55.53 -37.07 67.46 Favored 'General case' 0 N--CA 1.513 2.692 0 O-C-N 120.838 -1.164 . . . . 0.0 110.309 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.5 ttpt -65.34 -38.38 89.93 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.102 -0.999 . . . . 0.0 110.175 179.938 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.1 t -115.36 52.75 0.86 Allowed 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.075 -1.015 . . . . 0.0 110.418 -179.934 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.5 t -157.45 -56.77 0.08 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.147 -0.97 . . . . 0.0 110.739 179.973 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 31.5 mttp -96.15 -34.37 11.71 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.283 -0.886 . . . . 0.0 110.755 179.967 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 55.83 82.71 0.1 Allowed 'General case' 0 N--CA 1.502 2.131 0 O-C-N 120.82 -1.175 . . . . 0.0 110.419 -179.819 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -137.96 -162.63 1.33 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.274 -0.891 . . . . 0.0 109.94 -179.954 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -85.13 179.29 7.28 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.056 -1.028 . . . . 0.0 109.891 179.614 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 64.3 mttt 53.16 60.5 3.72 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.005 -1.059 . . . . 0.0 110.571 -179.767 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.85 -42.9 6.61 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.069 -1.019 . . . . 0.0 110.693 -179.907 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -58.0 -39.32 77.98 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 121.077 -1.014 . . . . 0.0 110.115 -179.935 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -59.68 -40.02 86.47 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.158 -0.964 . . . . 0.0 110.128 179.943 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 51.3 tp60 -59.5 -39.56 84.2 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.063 -1.023 . . . . 0.0 110.186 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -59.62 -39.66 85.01 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.137 -0.977 . . . . 0.0 110.181 -179.923 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.431 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.3 m0 -59.14 -37.19 76.68 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.186 -0.947 . . . . 0.0 110.164 179.827 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -59.94 -30.95 69.42 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.015 -1.053 . . . . 0.0 110.139 179.119 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.401 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 77.6 mt -71.28 -58.4 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.286 0 O-C-N 120.989 -1.069 . . . . 0.0 109.102 179.355 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.1 ptm -62.84 -29.94 71.12 Favored 'General case' 0 N--CA 1.507 2.408 0 C-N-CA 118.646 -1.221 . . . . 0.0 109.883 178.851 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.6 mm100 -69.43 -36.82 77.05 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.867 -1.146 . . . . 0.0 109.157 178.117 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.421 HD23 ' CE2' ' A' ' 26' ' ' PHE . 11.4 mt -53.24 -32.16 46.93 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.018 -1.052 . . . . 0.0 110.196 179.032 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.459 ' NE2' ' CB ' ' A' ' 88' ' ' ASP . 41.2 t60 -54.6 -39.76 68.18 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.09 -1.006 . . . . 0.0 110.07 179.859 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.428 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 4.9 m170 -62.41 -49.15 76.63 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.668 179.213 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -59.22 -36.23 75.05 Favored 'General case' 0 N--CA 1.508 2.438 0 C-N-CA 119.355 -0.938 . . . . 0.0 109.523 179.154 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.424 ' HD2' ' CD1' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -68.71 -52.09 34.58 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.085 -1.009 . . . . 0.0 108.761 178.769 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 91.7 p -61.21 -38.57 87.05 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.268 -0.895 . . . . 0.0 109.263 178.862 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 57.6 ttp85 -64.05 -38.49 91.26 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.094 -1.004 . . . . 0.0 109.456 179.028 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.452 ' OH ' ' CG2' ' A' ' 19' ' ' ILE . 48.1 t80 -60.31 -47.2 87.03 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.083 -1.011 . . . . 0.0 109.617 179.565 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.431 HG23 HD12 ' A' ' 63' ' ' ILE . 82.8 mt -77.77 -42.47 28.93 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.365 0 O-C-N 121.242 -0.911 . . . . 0.0 109.098 179.16 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.419 ' CE1' HG22 ' A' ' 92' ' ' ILE . 18.7 t80 -61.35 -23.37 65.7 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.354 -0.841 . . . . 0.0 110.659 179.01 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 97.2 m -91.02 -38.78 12.59 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.643 -1.286 . . . . 0.0 110.198 179.831 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.448 ' CD2' ' CE1' ' A' ' 62' ' ' TYR . 3.5 pp -83.04 -30.28 28.19 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.893 -1.13 . . . . 0.0 111.924 -179.429 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.436 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 39.9 t80 -86.25 -35.96 19.68 Favored 'General case' 0 N--CA 1.511 2.591 0 O-C-N 120.573 -1.329 . . . . 0.0 111.467 -179.81 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.403 ' CD2' ' CD1' ' A' ' 64' ' ' TYR . 15.1 m-85 -94.08 -29.88 14.96 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.828 -1.17 . . . . 0.0 112.422 -178.158 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.8 mtpp -105.52 -59.46 1.76 Allowed 'General case' 0 N--CA 1.504 2.268 0 O-C-N 120.684 -1.26 . . . . 0.0 110.42 -179.81 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 29.9 ttt85 -57.13 -33.27 67.21 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 121.109 -0.994 . . . . 0.0 110.366 -179.996 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.6 mttt 57.47 45.84 18.99 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.887 -1.133 . . . . 0.0 110.328 179.965 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -111.11 -57.17 2.28 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.372 -0.83 . . . . 0.0 109.38 179.289 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.481 HD13 HG22 ' A' ' 73' ' ' ILE . 15.1 tt -56.17 162.21 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.574 0 O-C-N 121.443 -0.786 . . . . 0.0 110.121 179.533 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.8 t -111.62 149.76 31.06 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.07 -1.019 . . . . 0.0 109.921 179.106 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.39 -32.71 1.42 Allowed 'General case' 0 N--CA 1.517 2.902 0 O-C-N 121.282 -0.886 . . . . 0.0 111.984 -179.709 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -61.68 -50.94 70.48 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 120.941 -1.099 . . . . 0.0 109.36 179.635 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 52.1 tp -67.96 -42.88 80.22 Favored 'General case' 0 N--CA 1.506 2.345 0 C-N-CA 119.139 -1.024 . . . . 0.0 108.466 178.727 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.436 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 21.8 t80 -60.1 -38.54 83.28 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.324 -0.86 . . . . 0.0 109.479 178.869 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -70.58 -42.67 70.74 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.067 -1.021 . . . . 0.0 108.73 178.745 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.429 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 72.0 t90 -59.03 -38.41 79.24 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.262 -0.899 . . . . 0.0 109.545 178.926 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.451 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 11.8 mt -64.86 -51.27 62.95 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.167 -0.958 . . . . 0.0 109.519 179.365 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.41 HG21 HD12 ' A' ' 82' ' ' ILE . 34.4 mm -57.75 -33.13 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.592 0 O-C-N 121.169 -0.957 . . . . 0.0 110.102 179.645 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -89.23 -9.03 52.27 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 120.898 -1.126 . . . . 0.0 112.437 -179.862 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.428 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 4.3 mm-40 -111.16 22.11 15.6 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 120.449 -1.407 . . . . 0.0 111.974 -179.984 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.4 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 0.0 OUTLIER 74.94 73.58 0.1 Allowed 'General case' 0 N--CA 1.51 2.562 0 O-C-N 121.031 -1.043 . . . . 0.0 111.66 179.451 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.451 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 32.6 m-85 -134.2 -62.8 0.74 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.557 -0.715 . . . . 0.0 109.215 179.456 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -131.16 163.04 28.59 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.478 -0.764 . . . . 0.0 109.248 179.313 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.459 ' CB ' ' NE2' ' A' ' 56' ' ' HIS . 30.7 t0 -111.27 118.27 35.43 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.084 -1.01 . . . . 0.0 110.314 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -57.67 -35.76 71.02 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 121.34 -0.85 . . . . 0.0 110.194 179.72 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.9 tp -60.68 -38.51 85.19 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.121 -0.987 . . . . 0.0 109.684 179.481 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.444 ' CD1' ' CZ3' ' A' ' 95' ' ' TRP . 0.3 OUTLIER -66.56 -56.71 9.5 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.085 -1.009 . . . . 0.0 108.829 179.078 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.419 HG22 ' CE1' ' A' ' 64' ' ' TYR . 38.8 mt -61.0 -33.74 57.03 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.416 0 C-N-CA 119.339 -0.944 . . . . 0.0 109.165 178.851 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.24 -41.1 86.2 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 120.985 -1.072 . . . . 0.0 109.239 178.854 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 10.0 mmtm -57.62 -44.25 85.38 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.177 -0.952 . . . . 0.0 109.49 179.387 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.444 ' CZ3' ' CD1' ' A' ' 91' ' ' LEU . 2.3 m0 -59.05 -26.37 64.54 Favored 'General case' 0 N--CA 1.508 2.44 0 C-N-CA 119.148 -1.021 . . . . 0.0 110.786 179.165 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.18 -35.51 25.43 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 120.736 -1.227 . . . . 0.0 110.671 179.587 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -51.1 175.79 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.803 0 O-C-N 121.025 -1.047 . . . . 0.0 110.831 179.89 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 60.8 m -103.79 138.83 39.85 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.168 -0.957 . . . . 0.0 109.487 179.219 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 103.47 -29.15 12.87 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.84 -1.304 . . . . 0.0 109.84 -178.881 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -94.43 58.16 2.37 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.867 -1.372 . . . . 0.0 109.898 179.658 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -73.0 -38.76 66.49 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.026 -1.046 . . . . 0.0 109.864 179.717 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.01 73.86 1.05 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.157 -0.964 . . . . 0.0 110.143 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.1 pp -110.1 148.77 31.1 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.068 -1.02 . . . . 0.0 110.149 179.941 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.428 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.7 p -110.21 -30.08 7.89 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.238 -0.914 . . . . 0.0 112.997 -179.727 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.544 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.3 m -143.56 -168.13 2.75 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 120.256 -1.527 . . . . 0.0 109.884 179.159 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.4 mt -96.73 -38.14 10.02 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.088 -1.007 . . . . 0.0 110.066 178.986 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 18.0 ttp180 -102.45 30.56 4.53 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 120.972 -1.08 . . . . 0.0 109.826 178.051 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.544 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.304 1.8 t -128.65 18.43 6.27 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.11 -0.994 . . . . 0.0 108.97 -179.575 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.7 pt -156.39 36.81 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.158 0 O-C-N 120.78 -1.2 . . . . 0.0 110.493 -178.631 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.413 ' O ' ' OG1' ' A' ' 119' ' ' THR . 9.5 tt0 -66.09 77.87 0.09 Allowed 'General case' 0 N--CA 1.51 2.554 0 O-C-N 120.995 -1.066 . . . . 0.0 110.788 -178.854 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -148.89 168.77 22.14 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.053 -1.029 . . . . 0.0 110.366 179.473 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -171.5 -61.03 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.181 -0.95 . . . . 0.0 110.804 179.922 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -168.1 44.33 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.223 -0.923 . . . . 0.0 110.968 -179.945 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 14.3 p -140.54 -175.15 4.17 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.27 -0.894 . . . . 0.0 110.227 -179.939 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 31.8 t-20 -128.73 92.36 3.4 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.195 -0.941 . . . . 0.0 110.25 179.997 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -137.79 -173.65 3.56 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.231 -0.918 . . . . 0.0 110.275 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -120.97 48.48 0.95 Allowed Glycine 0 N--CA 1.493 2.465 0 N-CA-C 109.633 -1.387 . . . . 0.0 109.633 -179.923 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 71.3 m -129.35 46.46 2.63 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.108 -1.231 . . . . 0.0 110.134 179.985 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.413 ' OG1' ' O ' ' A' ' 110' ' ' GLN . 7.1 m -139.88 165.52 27.09 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.233 -0.917 . . . . 0.0 109.996 -179.859 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 41.5 t -82.21 153.93 25.7 Favored 'General case' 0 N--CA 1.501 2.109 0 C-N-CA 119.321 -0.952 . . . . 0.0 108.802 178.766 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.443 HG21 ' CE1' ' A' ' 142' ' ' PHE . 14.1 tt -81.11 -29.33 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 O-C-N 121.047 -1.033 . . . . 0.0 112.448 -178.787 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.493 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 14.4 p -53.97 -35.14 61.47 Favored 'General case' 0 N--CA 1.512 2.647 0 O-C-N 120.707 -1.246 . . . . 0.0 110.658 -178.736 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -58.54 -26.85 63.98 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.118 -0.988 . . . . 0.0 109.836 177.707 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 48.9 t -73.89 118.24 67.74 Favored Pre-proline 0 N--CA 1.509 2.48 0 O-C-N 120.866 -1.146 . . . . 0.0 110.584 179.975 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . 0.419 ' HB3' ' CB ' ' A' ' 154' ' ' ALA . 37.4 Cg_endo -64.79 168.11 14.15 Favored 'Trans proline' 0 N--CA 1.489 1.224 0 O-C-N 123.026 1.013 . . . . 0.0 110.553 178.611 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.18 -38.81 60.67 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.203 -0.935 . . . . 0.0 110.189 179.971 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.28 -40.65 82.48 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.034 -1.041 . . . . 0.0 110.053 -179.811 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 -67.08 -41.1 86.96 Favored 'General case' 0 N--CA 1.507 2.42 0 C-N-CA 119.359 -0.936 . . . . 0.0 109.399 179.46 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 5.4 mt -64.27 -40.66 96.43 Favored 'General case' 0 N--CA 1.507 2.389 0 C-N-CA 119.446 -0.902 . . . . 0.0 109.552 179.318 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.68 -39.91 86.1 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.16 -0.962 . . . . 0.0 109.936 179.78 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -60.93 -40.02 91.67 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.148 -0.97 . . . . 0.0 109.964 179.781 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -62.19 -41.92 98.8 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.201 -0.937 . . . . 0.0 109.872 179.797 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.37 -41.6 97.34 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.215 -0.928 . . . . 0.0 109.886 179.955 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 6.9 mmt85 -59.65 -38.55 81.72 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.143 -0.973 . . . . 0.0 109.991 179.658 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 13.9 mttp -61.63 -35.68 78.61 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.18 -0.95 . . . . 0.0 110.567 -179.902 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -105.45 21.68 16.77 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.007 -1.058 . . . . 0.0 111.836 -179.913 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.39 46.06 58.14 Favored Glycine 0 N--CA 1.498 2.812 0 O-C-N 120.641 -1.287 . . . . 0.0 110.773 179.315 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.5 t -138.74 -165.31 1.8 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.113 -1.228 . . . . 0.0 110.189 179.747 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.4 mp0 -133.34 167.72 19.88 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.188 -0.945 . . . . 0.0 110.471 -179.896 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 8.6 p -159.82 161.14 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.041 0 O-C-N 121.336 -0.853 . . . . 0.0 110.646 -179.981 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 38.8 t -169.05 113.92 0.57 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.18 -0.95 . . . . 0.0 111.256 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.493 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 85.1 t80 -102.97 158.79 16.04 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.234 -0.916 . . . . 0.0 110.156 179.586 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 15.2 m80 -137.17 -61.54 0.65 Allowed 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.822 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -148.01 149.33 31.93 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.576 -0.702 . . . . 0.0 109.247 178.81 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 26.3 p -93.67 155.24 17.37 Favored 'General case' 0 N--CA 1.505 2.275 0 C-N-CA 119.038 -1.065 . . . . 0.0 110.813 -179.485 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.9 p -71.86 -25.15 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.493 0 O-C-N 121.287 -0.883 . . . . 0.0 111.77 -179.252 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -50.25 -59.78 3.62 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 120.832 -1.168 . . . . 0.0 110.171 -179.898 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.431 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.8 p -126.95 -165.11 1.42 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.213 -0.929 . . . . 0.0 110.491 179.424 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . 0.421 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.51 60.99 0.65 Allowed Glycine 0 N--CA 1.492 2.38 0 N-CA-C 107.945 -2.062 . . . . 0.0 107.945 178.3 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 16.9 t -99.15 138.69 35.9 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.353 -1.087 . . . . 0.0 109.64 -179.182 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.63 49.45 1.03 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.23 -0.919 . . . . 0.0 109.882 179.398 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 75.16 93.58 0.16 Allowed Glycine 0 N--CA 1.488 2.156 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 179.757 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.4 p -104.83 127.25 52.58 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.237 -1.154 . . . . 0.0 109.665 179.107 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . 0.419 ' CB ' ' HB3' ' A' ' 125' ' ' PRO . . . -153.98 149.51 27.31 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.052 -1.03 . . . . 0.0 110.554 -179.057 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -96.5 -39.12 9.71 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.269 -0.895 . . . . 0.0 110.422 179.949 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 6.8 m -56.8 -38.82 73.07 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.024 -1.047 . . . . 0.0 110.383 179.994 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 . . . . . 0 N--CA 1.493 1.69 0 CA-C-O 117.961 -1.018 . . . . 0.0 110.21 179.955 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.306 0 N-CA-C 109.564 -1.415 . . . . 0.0 109.564 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 70.83 42.04 61.68 Favored Glycine 0 N--CA 1.492 2.43 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 -179.972 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.7 t -142.27 70.89 22.35 Favored Pre-proline 0 N--CA 1.494 1.741 0 O-C-N 121.182 -1.187 . . . . 0.0 110.21 -179.97 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -73.05 132.5 18.27 Favored 'Trans proline' 0 C--N 1.317 -1.093 0 O-C-N 123.356 1.187 . . . . 0.0 110.466 -179.95 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -119.68 95.36 4.74 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.204 -0.935 . . . . 0.0 110.157 -179.982 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 38.9 pt -138.13 151.9 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.224 -0.922 . . . . 0.0 110.268 -179.934 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.6 mtmm -143.53 -174.03 4.12 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.273 -0.892 . . . . 0.0 110.268 179.993 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.1 p -116.95 170.81 8.34 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.253 -0.904 . . . . 0.0 110.187 -179.99 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 62.8 mtt-85 -142.87 85.74 1.9 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.203 -0.936 . . . . 0.0 110.292 -179.952 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.84 148.93 41.31 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.194 -0.941 . . . . 0.0 110.21 179.94 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.6 m 52.41 77.03 0.16 Allowed 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.077 -1.014 . . . . 0.0 110.816 -179.985 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.1 tptp -132.12 96.57 19.6 Favored Pre-proline 0 N--CA 1.494 1.748 0 O-C-N 121.198 -0.939 . . . . 0.0 110.224 -179.95 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.8 157.46 51.79 Favored 'Trans proline' 0 C--N 1.317 -1.115 0 O-C-N 123.408 1.215 . . . . 0.0 110.678 179.992 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.435 ' HB3' ' CE3' ' A' ' 80' ' ' TRP . . . 62.2 144.32 0.07 OUTLIER Pre-proline 0 N--CA 1.503 2.212 0 O-C-N 121.367 -0.833 . . . . 0.0 110.62 179.911 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -74.02 161.11 41.79 Favored 'Trans proline' 0 N--CA 1.485 1.0 0 O-C-N 123.192 1.101 . . . . 0.0 110.611 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -49.15 -31.81 8.97 Favored 'General case' 0 N--CA 1.515 2.815 0 O-C-N 121.431 -0.793 . . . . 0.0 111.318 -179.82 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.2 -33.37 45.42 Favored Glycine 0 N--CA 1.499 2.851 0 O-C-N 121.031 -1.043 . . . . 0.0 110.635 179.855 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -54.18 -32.01 54.32 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 120.962 -1.317 . . . . 0.0 110.766 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -54.93 -37.34 66.29 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 121.037 -1.04 . . . . 0.0 110.242 179.868 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.8 mtpp -57.68 -35.39 70.52 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.152 -0.968 . . . . 0.0 110.359 179.588 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 3.1 pt -116.26 36.73 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.15 -0.969 . . . . 0.0 110.428 179.592 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.441 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -82.53 -43.03 0.95 Allowed Pre-proline 0 N--CA 1.508 2.459 0 O-C-N 121.078 -1.014 . . . . 0.0 113.003 -179.436 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.441 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.2 Cg_endo -76.14 -34.73 2.74 Favored 'Trans proline' 0 N--CA 1.486 1.07 0 O-C-N 122.571 0.774 . . . . 0.0 111.875 -178.366 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.442 ' CG2' ' CE2' ' A' ' 62' ' ' TYR . 91.4 m -61.3 -47.99 83.41 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.885 -1.135 . . . . 0.0 109.833 -179.762 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.8 mt -62.07 -40.21 95.03 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.465 179.555 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.7 m -57.56 -35.41 70.31 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.155 -0.966 . . . . 0.0 110.187 179.229 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -56.72 -37.9 71.62 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.041 -1.037 . . . . 0.0 110.128 179.691 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.422 ' CD2' ' HD3' ' A' ' 59' ' ' ARG . 14.1 m-85 -58.69 -39.05 79.64 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.101 -1.0 . . . . 0.0 110.284 179.965 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -59.81 -40.14 87.38 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.17 -0.956 . . . . 0.0 110.362 -179.512 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.2 mp -65.65 -42.07 91.94 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.376 0 C-N-CA 119.12 -1.032 . . . . 0.0 108.668 179.48 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.7 tp60 -68.03 -50.99 51.99 Favored 'General case' 0 N--CA 1.506 2.337 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 178.494 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.6 tp -59.09 -36.28 74.84 Favored 'General case' 0 N--CA 1.509 2.516 0 C-N-CA 119.546 -0.861 . . . . 0.0 109.471 178.403 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.6 mtt85 -57.93 -37.79 74.73 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.124 -0.985 . . . . 0.0 110.333 179.675 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -62.74 -50.42 71.14 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.094 -1.003 . . . . 0.0 109.748 -179.636 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.405 ' HB1' ' CG1' ' A' ' 52' ' ' ILE . . . -71.46 -40.0 70.58 Favored 'General case' 0 N--CA 1.503 2.188 0 C-N-CA 118.829 -1.149 . . . . 0.0 108.827 178.796 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -62.1 -32.7 73.28 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.21 -0.931 . . . . 0.0 110.246 179.207 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.3 mtpt -96.42 -35.85 11.02 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 120.934 -1.104 . . . . 0.0 111.065 -179.818 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -56.43 -36.85 69.47 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 120.955 -1.09 . . . . 0.0 110.359 179.975 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.5 ttmt -55.75 -42.7 75.82 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 121.134 -0.979 . . . . 0.0 110.306 -179.928 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.2 m 52.15 54.22 11.15 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.033 -1.042 . . . . 0.0 110.768 -179.975 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.3 t 53.26 -164.55 0.09 Allowed 'General case' 0 N--CA 1.501 2.108 0 O-C-N 120.986 -1.071 . . . . 0.0 110.552 -179.971 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.5 mmtt -78.13 69.47 4.35 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.094 -1.004 . . . . 0.0 109.754 179.703 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.4 tp -146.04 42.12 1.2 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.297 -0.877 . . . . 0.0 110.366 -179.77 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -167.54 -179.55 4.43 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.124 -0.985 . . . . 0.0 111.062 -179.871 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -117.01 175.84 5.4 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.231 -0.918 . . . . 0.0 110.096 179.866 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 21.1 mttt 52.67 57.88 5.94 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.04 -1.037 . . . . 0.0 110.566 -179.951 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 5.6 m -95.31 -38.14 10.66 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.217 -0.927 . . . . 0.0 110.578 179.957 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.417 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 34.7 m120 -60.28 -45.03 94.75 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.126 -0.984 . . . . 0.0 109.828 179.937 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -60.16 -44.89 94.65 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.144 -0.973 . . . . 0.0 109.708 179.867 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.56 -43.78 92.85 Favored 'General case' 0 N--CA 1.506 2.375 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.272 179.29 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 20.6 mt -61.46 -35.65 78.21 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.332 -0.855 . . . . 0.0 110.185 179.818 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.446 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 49.4 m0 -58.7 -39.28 80.31 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 120.962 -1.086 . . . . 0.0 109.742 179.762 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -62.16 -31.25 71.72 Favored 'General case' 0 N--CA 1.504 2.257 0 C-N-CA 119.144 -1.022 . . . . 0.0 109.715 178.409 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.405 ' CG1' ' HB1' ' A' ' 33' ' ' ALA . 17.8 mt -71.81 -58.19 5.68 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.145 0 O-C-N 120.93 -1.106 . . . . 0.0 109.157 179.298 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.0 ptm -61.48 -29.58 70.06 Favored 'General case' 0 N--CA 1.508 2.458 0 C-N-CA 118.57 -1.252 . . . . 0.0 109.787 178.81 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -69.11 -38.17 78.78 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 120.793 -1.192 . . . . 0.0 109.009 178.078 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 11.1 mt -53.34 -32.05 47.33 Favored 'General case' 0 N--CA 1.513 2.681 0 O-C-N 120.951 -1.093 . . . . 0.0 110.163 178.963 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.467 ' NE2' ' CB ' ' A' ' 88' ' ' ASP . 67.6 t60 -56.19 -38.9 71.6 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.061 -1.025 . . . . 0.0 110.24 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.405 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 7.4 m170 -60.13 -47.99 83.61 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.103 -0.998 . . . . 0.0 109.449 179.361 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -60.38 -35.88 76.77 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.262 -0.899 . . . . 0.0 109.651 178.974 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.422 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -64.97 -49.11 71.61 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.045 -1.034 . . . . 0.0 109.615 179.385 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.7 p -62.77 -38.56 91.09 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.139 -0.976 . . . . 0.0 109.409 179.329 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.421 ' O ' ' OG1' ' A' ' 65' ' ' THR . 19.5 ttt85 -63.13 -40.31 97.22 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.064 -1.022 . . . . 0.0 109.342 179.281 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.442 ' CE2' ' CG2' ' A' ' 22' ' ' THR . 43.0 t80 -62.35 -50.87 69.86 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.181 -0.949 . . . . 0.0 109.379 179.506 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 86.9 mt -69.5 -39.53 78.67 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.345 0 C-N-CA 119.271 -0.972 . . . . 0.0 109.126 179.351 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 9.5 t80 -64.48 -42.39 95.92 Favored 'General case' 0 N--CA 1.503 2.216 0 C-N-CA 119.409 -0.917 . . . . 0.0 109.055 179.022 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.421 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 87.4 m -60.89 -42.01 97.14 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.055 -1.028 . . . . 0.0 110.5 -179.575 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.406 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -83.29 -33.16 26.03 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 118.923 -1.111 . . . . 0.0 112.759 -178.766 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.422 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 51.0 t80 -86.32 -32.43 21.04 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 120.599 -1.313 . . . . 0.0 111.734 -179.363 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -98.38 -16.75 19.17 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 120.827 -1.171 . . . . 0.0 112.713 -178.872 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.8 mttt -124.15 -59.31 1.5 Allowed 'General case' 0 N--CA 1.501 2.114 0 O-C-N 120.46 -1.4 . . . . 0.0 111.008 179.79 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 4.8 tpt180 -61.87 -30.21 70.71 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.147 -0.971 . . . . 0.0 110.825 -179.649 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.2 tttp 57.87 42.05 23.75 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 120.754 -1.216 . . . . 0.0 110.093 -179.592 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.38 35.72 3.88 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.369 -0.832 . . . . 0.0 109.952 179.303 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.471 HG21 HD11 ' A' ' 73' ' ' ILE . 14.0 tt -154.64 162.37 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 O-C-N 121.214 -0.929 . . . . 0.0 109.905 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.8 m -110.02 147.82 32.83 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.172 -0.955 . . . . 0.0 110.18 179.791 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.9 ttmt -45.42 -32.27 2.06 Favored 'General case' 0 N--CA 1.516 2.835 0 O-C-N 121.401 -0.812 . . . . 0.0 111.656 -179.971 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -62.25 -50.99 69.54 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 120.938 -1.101 . . . . 0.0 109.3 179.559 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 50.1 tp -65.63 -46.03 80.82 Favored 'General case' 0 N--CA 1.505 2.306 0 C-N-CA 119.106 -1.038 . . . . 0.0 108.481 178.959 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.422 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 18.8 t80 -59.8 -38.98 83.47 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.276 -0.89 . . . . 0.0 109.545 179.224 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -72.73 -42.14 64.41 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.112 -0.993 . . . . 0.0 108.971 178.933 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.435 ' CE3' ' HB3' ' A' ' 12' ' ' ALA . 83.0 t90 -57.48 -37.27 72.64 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.218 -0.927 . . . . 0.0 109.717 179.091 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.477 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 62.9 mt -68.5 -48.12 65.22 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.19 -0.944 . . . . 0.0 108.981 179.149 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.4 mm -56.01 -33.36 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.56 0 O-C-N 121.206 -0.934 . . . . 0.0 109.941 179.374 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -89.29 -16.23 31.65 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.004 -1.06 . . . . 0.0 112.082 179.929 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.423 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 8.4 mm-40 -102.88 21.61 15.29 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.547 -1.345 . . . . 0.0 112.05 -179.829 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 17.1 tttp 75.54 72.04 0.09 Allowed 'General case' 0 N--CA 1.511 2.599 0 O-C-N 121.201 -0.937 . . . . 0.0 111.735 179.443 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.477 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 33.9 m-85 -134.2 -62.89 0.74 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.519 -0.738 . . . . 0.0 109.119 179.267 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -129.09 160.15 33.72 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.507 -0.745 . . . . 0.0 109.4 179.243 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.467 ' CB ' ' NE2' ' A' ' 56' ' ' HIS . 8.2 t70 -107.61 115.25 29.82 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.035 -1.041 . . . . 0.0 110.346 -179.866 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -58.64 -37.22 75.47 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.255 -0.903 . . . . 0.0 110.03 179.668 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.1 tp -60.79 -38.79 86.5 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.124 -0.985 . . . . 0.0 109.601 179.504 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.455 ' CD1' ' CZ3' ' A' ' 95' ' ' TRP . 0.3 OUTLIER -65.13 -55.54 18.1 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.094 -1.004 . . . . 0.0 108.856 179.155 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.405 HD13 HG21 ' A' ' 92' ' ' ILE . 57.7 mt -61.67 -36.97 76.75 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.41 0 C-N-CA 119.401 -0.919 . . . . 0.0 109.038 178.974 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.74 -39.3 90.99 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.164 -0.96 . . . . 0.0 109.428 178.891 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.419 ' HD2' ' CE1' ' A' ' 100' ' ' TYR . 12.8 mmtm -59.36 -43.94 92.78 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.115 -0.99 . . . . 0.0 109.635 179.543 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.455 ' CZ3' ' CD1' ' A' ' 91' ' ' LEU . 2.9 m0 -63.86 -33.86 76.65 Favored 'General case' 0 N--CA 1.51 2.526 0 C-N-CA 119.311 -0.956 . . . . 0.0 110.343 179.461 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.54 -30.49 29.69 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.043 -1.036 . . . . 0.0 110.993 179.722 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -54.15 -176.57 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.68 0 O-C-N 120.912 -1.118 . . . . 0.0 110.601 179.87 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -104.16 136.54 43.59 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.16 -0.962 . . . . 0.0 109.874 179.296 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 94.09 13.17 55.28 Favored Glycine 0 N--CA 1.494 2.501 0 C-N-CA 120.295 -0.955 . . . . 0.0 110.938 -179.418 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.419 ' CE1' ' HD2' ' A' ' 94' ' ' LYS . 49.6 m-85 -120.14 71.34 0.9 Allowed 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 119.322 1.561 . . . . 0.0 110.003 179.748 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -92.84 -36.66 12.71 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.08 -1.012 . . . . 0.0 110.474 179.89 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.28 76.94 1.52 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.051 -1.031 . . . . 0.0 110.698 -179.854 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.2 pp -122.58 147.34 46.52 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.06 -1.025 . . . . 0.0 109.957 179.536 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.405 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.6 p -111.58 -32.06 6.8 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 119.491 -0.884 . . . . 0.0 112.988 -179.447 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.536 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.1 m -142.22 -168.15 2.65 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 120.26 -1.525 . . . . 0.0 110.156 179.246 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.2 mt -95.97 -38.26 10.31 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.153 -0.967 . . . . 0.0 110.021 179.018 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 18.0 ttt85 -102.46 30.83 4.37 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.958 -1.089 . . . . 0.0 109.721 178.109 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.536 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.311 1.8 t -130.51 20.07 5.19 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.168 -0.958 . . . . 0.0 108.746 -179.429 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 2.1 pt -156.63 38.17 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 O-C-N 120.938 -1.101 . . . . 0.0 110.107 -178.574 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.419 ' O ' ' OG1' ' A' ' 119' ' ' THR . 31.0 mt-30 -88.19 97.23 10.89 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 120.953 -1.092 . . . . 0.0 110.869 -178.639 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.42 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 7.6 tttm -104.57 -49.57 3.51 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.3 -0.875 . . . . 0.0 110.278 179.586 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -115.79 -173.17 2.3 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.183 -0.948 . . . . 0.0 110.251 179.814 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 52.71 50.45 18.09 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.111 -0.993 . . . . 0.0 110.8 179.951 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -145.8 154.74 42.35 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.086 -1.009 . . . . 0.0 110.373 -179.994 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -116.05 -57.06 2.26 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.215 -0.928 . . . . 0.0 110.07 179.886 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 52.8 m-20 -116.4 110.13 18.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.268 -0.895 . . . . 0.0 110.05 179.814 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 143.15 -168.37 26.12 Favored Glycine 0 N--CA 1.493 2.497 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 -179.87 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 12.3 m -145.86 -164.54 1.98 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.194 -1.18 . . . . 0.0 110.358 -179.777 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.42 ' OG1' ' HA ' ' A' ' 111' ' ' LYS . 1.6 m -107.51 158.24 17.37 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.179 -0.951 . . . . 0.0 109.934 179.814 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 43.0 t -70.27 153.23 43.3 Favored 'General case' 0 N--CA 1.501 2.087 0 C-N-CA 118.895 -1.122 . . . . 0.0 108.244 178.527 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.454 ' CD1' ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -70.41 -31.74 47.78 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.391 0 O-C-N 121.072 -1.017 . . . . 0.0 111.523 -178.667 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.512 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.4 p -60.95 -35.98 78.18 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 120.701 -1.249 . . . . 0.0 110.28 -179.8 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 23.5 tpt85 -57.31 -36.93 71.71 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 120.905 -1.122 . . . . 0.0 109.603 178.539 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 49.1 t -75.13 119.5 77.23 Favored Pre-proline 0 N--CA 1.505 2.302 0 O-C-N 121.204 -0.935 . . . . 0.0 109.85 179.718 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -64.43 178.9 1.43 Allowed 'Trans proline' 0 N--CA 1.488 1.188 0 O-C-N 123.133 1.07 . . . . 0.0 110.768 179.584 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.7 mmm-85 -74.99 -37.53 61.85 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.193 -0.942 . . . . 0.0 110.596 -179.784 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.46 -40.61 83.14 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.071 -1.018 . . . . 0.0 109.968 -179.867 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -69.92 -41.49 74.56 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 119.382 -0.927 . . . . 0.0 109.266 179.246 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 11.1 mt -65.34 -38.69 90.87 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.272 -0.893 . . . . 0.0 109.576 179.188 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -60.98 -38.75 87.07 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.179 -0.951 . . . . 0.0 109.924 179.653 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.26 -36.21 72.91 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.148 -0.97 . . . . 0.0 110.416 179.845 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -63.77 -49.42 73.02 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.182 -0.949 . . . . 0.0 109.807 179.973 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.25 -38.25 86.01 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.122 -0.986 . . . . 0.0 109.84 179.733 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 15.6 mtp85 -61.69 -36.24 80.32 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.114 -0.991 . . . . 0.0 110.12 179.562 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 6.7 mttm -87.13 -34.96 18.9 Favored 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.029 -1.044 . . . . 0.0 110.747 179.798 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -82.48 -35.99 26.92 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 120.987 -1.07 . . . . 0.0 110.667 179.776 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.87 34.78 8.09 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.804 -1.319 . . . . 0.0 109.804 -179.861 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.9 t -131.17 23.14 4.85 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.992 -1.299 . . . . 0.0 111.531 179.702 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 48.62 -179.06 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.862 -1.149 . . . . 0.0 111.928 179.462 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.7 p -174.07 159.28 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.307 0 O-C-N 121.051 -1.031 . . . . 0.0 110.698 -179.841 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 41.5 t -171.98 92.5 0.13 Allowed 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.219 -0.926 . . . . 0.0 110.939 179.787 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.512 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 80.8 t80 -99.79 158.9 15.46 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.24 -0.912 . . . . 0.0 110.724 -179.881 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -139.46 -61.33 0.55 Allowed 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 178.615 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 1.6 pm0 -137.67 150.81 47.65 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.49 -0.756 . . . . 0.0 108.972 178.621 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . 0.406 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.4 p -91.99 153.88 19.16 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.973 -1.08 . . . . 0.0 111.034 -179.735 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.3 p -72.4 -23.4 21.21 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.416 0 C-N-CA 119.733 -0.787 . . . . 0.0 111.51 -179.76 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -51.55 -60.6 2.96 Favored 'General case' 0 N--CA 1.514 2.746 0 O-C-N 120.711 -1.243 . . . . 0.0 110.044 179.921 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.446 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 21.6 p -125.8 -164.11 1.28 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.265 -0.897 . . . . 0.0 110.395 179.327 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -101.64 61.53 0.55 Allowed Glycine 0 N--CA 1.492 2.384 0 N-CA-C 107.958 -2.057 . . . . 0.0 107.958 178.202 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 18.9 t -100.32 146.38 27.02 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.293 -1.122 . . . . 0.0 109.866 -179.13 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 6.7 ttm-85 -100.42 45.65 0.97 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.254 -0.904 . . . . 0.0 109.566 179.349 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 74.08 97.03 0.1 OUTLIER Glycine 0 N--CA 1.486 2.015 0 N-CA-C 109.806 -1.318 . . . . 0.0 109.806 179.993 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 26.3 p -109.47 125.74 52.77 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.275 -1.132 . . . . 0.0 110.133 179.606 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -144.79 144.93 31.41 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.088 -1.008 . . . . 0.0 110.181 -179.414 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.73 -35.28 10.6 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.235 -0.916 . . . . 0.0 111.025 -179.824 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 41.7 p -77.63 -40.33 42.28 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 120.888 -1.132 . . . . 0.0 110.217 179.978 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 . . . . . 0 N--CA 1.496 1.837 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.45 179.881 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.3 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 66.78 90.14 0.05 OUTLIER Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.633 -1.387 . . . . 0.0 109.633 -179.972 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 60.2 p -121.11 84.84 40.39 Favored Pre-proline 0 N--CA 1.494 1.769 0 O-C-N 121.242 -1.152 . . . . 0.0 110.212 -179.99 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.89 117.75 5.26 Favored 'Trans proline' 0 C--N 1.316 -1.132 0 O-C-N 123.413 1.217 . . . . 0.0 110.38 -179.973 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.9 ttm-85 -120.51 58.51 0.93 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.198 -0.939 . . . . 0.0 110.157 179.964 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.6 mm -116.62 141.3 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.144 -0.973 . . . . 0.0 110.016 -179.994 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.6 mttp -120.08 158.86 25.98 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.174 -0.954 . . . . 0.0 110.219 -179.984 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 12.8 p -118.84 54.58 0.95 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.235 -0.915 . . . . 0.0 110.155 -179.994 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.92 84.56 2.17 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.134 -0.979 . . . . 0.0 110.178 -179.981 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.8 ttm-85 -117.55 -57.56 2.12 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.247 -0.908 . . . . 0.0 110.093 179.892 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.4 t -128.79 98.51 5.0 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.177 -0.952 . . . . 0.0 110.13 179.977 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.3 tptt -127.9 95.77 33.68 Favored Pre-proline 0 N--CA 1.494 1.753 0 O-C-N 121.251 -0.906 . . . . 0.0 110.227 -179.908 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.52 158.59 50.76 Favored 'Trans proline' 0 C--N 1.316 -1.161 0 O-C-N 123.414 1.218 . . . . 0.0 110.508 179.858 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.442 ' HB1' ' CH2' ' A' ' 80' ' ' TRP . . . -55.26 148.61 30.53 Favored Pre-proline 0 N--CA 1.514 2.728 0 O-C-N 121.312 -0.868 . . . . 0.0 110.079 -179.982 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -70.97 160.43 49.38 Favored 'Trans proline' 0 C--N 1.316 -1.152 0 O-C-N 123.314 1.165 . . . . 0.0 110.831 -179.538 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -48.72 -32.06 7.87 Favored 'General case' 0 N--CA 1.515 2.816 0 O-C-N 121.384 -0.822 . . . . 0.0 111.403 -179.718 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.63 -33.27 41.12 Favored Glycine 0 N--CA 1.498 2.773 0 O-C-N 121.011 -1.055 . . . . 0.0 110.653 179.751 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.427 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 16.6 t80 -55.3 -34.23 63.96 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 120.939 -1.33 . . . . 0.0 110.701 179.888 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -55.17 -37.22 66.74 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 121.05 -1.031 . . . . 0.0 110.239 179.727 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.3 mtpt -57.65 -35.51 70.62 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.237 -0.915 . . . . 0.0 110.319 179.604 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.426 HG23 ' OH ' ' A' ' 62' ' ' TYR . 3.2 pt -115.25 36.33 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 O-C-N 121.186 -0.947 . . . . 0.0 110.328 179.548 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -84.98 -42.93 0.67 Allowed Pre-proline 0 N--CA 1.511 2.59 0 O-C-N 121.149 -0.969 . . . . 0.0 113.509 -179.143 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.8 Cg_endo -75.06 -37.23 2.09 Favored 'Trans proline' 0 N--CA 1.488 1.188 0 O-C-N 122.63 0.805 . . . . 0.0 111.921 -177.828 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 70.6 m -61.32 -43.38 98.96 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.019 -1.051 . . . . 0.0 110.139 -179.569 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 34.1 mt -65.07 -40.18 94.32 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.219 -0.926 . . . . 0.0 109.58 179.746 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -34.17 69.2 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.107 -0.995 . . . . 0.0 110.276 179.337 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -56.72 -36.36 69.62 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.004 -1.06 . . . . 0.0 110.288 179.628 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.429 ' CE1' ' HG2' ' A' ' 59' ' ' ARG . 26.2 m-85 -57.2 -39.89 76.33 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.098 -1.001 . . . . 0.0 110.325 179.866 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -60.06 -23.63 63.92 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.316 -0.865 . . . . 0.0 111.483 -179.461 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 2.7 mp -81.19 -34.72 13.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.426 0 O-C-N 120.767 -1.208 . . . . 0.0 109.727 179.623 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 25.3 tt0 -82.53 -36.21 26.56 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 120.951 -1.093 . . . . 0.0 109.179 178.543 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.18 -31.65 62.75 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.134 -0.979 . . . . 0.0 110.054 178.864 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -69.56 -36.71 76.57 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 120.808 -1.183 . . . . 0.0 109.911 179.419 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -64.19 -42.09 96.82 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.104 -1.038 . . . . 0.0 109.168 179.277 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.413 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -68.43 -41.95 79.59 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.272 -0.893 . . . . 0.0 109.096 178.964 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -59.41 -35.13 73.4 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.226 -0.922 . . . . 0.0 110.218 179.579 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -82.79 -39.73 21.39 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.009 -1.057 . . . . 0.0 110.147 179.818 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -59.98 -39.76 86.82 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.214 -0.929 . . . . 0.0 109.959 179.681 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.67 -38.05 74.47 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.148 -0.97 . . . . 0.0 110.374 179.937 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 6.4 t -109.82 59.71 0.6 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.047 -1.033 . . . . 0.0 110.077 179.847 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.3 t -146.95 -58.59 0.28 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.206 -0.934 . . . . 0.0 110.506 -179.962 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 42.2 mttt -103.63 -48.09 4.06 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.215 -0.928 . . . . 0.0 110.311 179.907 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 54.07 53.84 10.53 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 120.932 -1.105 . . . . 0.0 110.615 -179.88 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -142.94 -59.64 0.43 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.167 -0.958 . . . . 0.0 110.28 179.87 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -136.16 157.61 46.4 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.27 -0.894 . . . . 0.0 110.178 179.868 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.2 tttm 52.92 49.28 20.56 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.04 -1.038 . . . . 0.0 110.759 179.986 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.0 m -112.7 -54.15 2.65 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.123 -0.985 . . . . 0.0 110.501 179.983 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -56.25 -38.36 71.02 Favored 'General case' 0 N--CA 1.511 2.599 0 O-C-N 121.138 -0.976 . . . . 0.0 110.06 179.884 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -62.01 -40.84 97.05 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.211 -0.931 . . . . 0.0 109.804 179.773 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 48.9 tp60 -62.21 -40.49 96.26 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.183 -0.948 . . . . 0.0 109.782 179.805 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.6 mt -59.32 -39.28 82.61 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.142 -0.974 . . . . 0.0 110.092 179.87 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.425 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.8 m0 -61.17 -36.22 79.24 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.114 -0.991 . . . . 0.0 110.149 179.86 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.96 -31.21 68.52 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.988 -1.07 . . . . 0.0 110.107 178.871 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.413 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 79.6 mt -72.08 -60.29 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.286 0 O-C-N 120.921 -1.112 . . . . 0.0 108.816 179.148 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 5.6 ptm -61.67 -29.32 70.0 Favored 'General case' 0 N--CA 1.508 2.443 0 C-N-CA 118.771 -1.171 . . . . 0.0 109.685 178.568 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -70.39 -38.32 74.65 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.832 -1.168 . . . . 0.0 109.001 178.307 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.426 HD23 ' CD1' ' A' ' 26' ' ' PHE . 11.7 mt -53.72 -33.39 55.42 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.057 -1.027 . . . . 0.0 110.067 178.959 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.447 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 38.4 t60 -54.63 -38.79 67.28 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 120.961 -1.087 . . . . 0.0 109.943 179.816 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.427 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 5.2 m170 -59.15 -46.14 89.14 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.152 -0.967 . . . . 0.0 109.321 179.354 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 -61.64 -37.36 83.71 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.406 -0.917 . . . . 0.0 109.272 178.93 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.429 ' HG2' ' CE1' ' A' ' 26' ' ' PHE . 3.5 mmm-85 -64.51 -50.46 67.29 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.125 -0.984 . . . . 0.0 109.216 178.999 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 89.4 p -62.82 -40.11 96.39 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.197 -0.939 . . . . 0.0 109.193 179.455 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.405 ' O ' ' OG1' ' A' ' 65' ' ' THR . 12.5 ttm-85 -64.72 -38.25 90.34 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.127 -0.983 . . . . 0.0 109.399 178.995 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.426 ' OH ' HG23 ' A' ' 19' ' ' ILE . 37.7 t80 -60.61 -48.69 80.66 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.094 -1.004 . . . . 0.0 109.583 179.542 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.435 HG23 HD11 ' A' ' 63' ' ' ILE . 84.7 mt -76.51 -42.25 35.32 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.338 0 O-C-N 121.222 -0.924 . . . . 0.0 108.875 179.119 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.429 ' OH ' ' HD2' ' A' ' 96' ' ' ARG . 44.4 t80 -61.44 -22.74 65.31 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.402 -0.811 . . . . 0.0 110.507 178.824 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.405 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 86.9 m -90.73 -36.0 14.56 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.609 -1.307 . . . . 0.0 110.503 179.955 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.6 pp -82.9 -32.3 27.37 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.898 -1.126 . . . . 0.0 112.343 -179.179 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.427 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 34.3 t80 -86.21 -37.87 18.21 Favored 'General case' 0 N--CA 1.512 2.648 0 O-C-N 120.738 -1.226 . . . . 0.0 111.299 -179.375 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -89.68 -21.63 22.64 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.977 -1.077 . . . . 0.0 112.548 -178.647 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.6 mttm -119.87 -60.71 1.68 Allowed 'General case' 0 N--CA 1.501 2.104 0 O-C-N 120.489 -1.382 . . . . 0.0 111.153 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.8 ttt85 -60.38 -30.33 69.51 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.079 -1.013 . . . . 0.0 110.92 -179.464 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.1 tttt 57.5 42.04 25.03 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.859 -1.15 . . . . 0.0 110.025 -179.462 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -111.93 35.31 3.76 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.342 -0.849 . . . . 0.0 109.87 179.219 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.421 HD13 HG21 ' A' ' 73' ' ' ILE . 13.6 tt -156.14 162.1 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.214 -0.929 . . . . 0.0 109.913 -179.956 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 40.5 m -108.78 149.56 28.88 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.117 -0.989 . . . . 0.0 110.211 179.967 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.0 tttt -46.83 -32.08 3.48 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.307 -0.871 . . . . 0.0 111.462 -179.972 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.19 -50.6 71.14 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 120.893 -1.129 . . . . 0.0 109.39 179.521 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 38.0 tp -66.9 -44.3 81.17 Favored 'General case' 0 N--CA 1.505 2.301 0 C-N-CA 119.108 -1.037 . . . . 0.0 108.488 178.856 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.427 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 17.5 t80 -60.24 -38.64 84.05 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.305 -0.872 . . . . 0.0 109.425 178.933 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -72.75 -42.7 63.78 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.04 -1.037 . . . . 0.0 108.656 178.495 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.442 ' CH2' ' HB1' ' A' ' 12' ' ' ALA . 75.0 t90 -57.68 -37.13 72.91 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.271 -0.893 . . . . 0.0 109.576 178.825 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.455 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 12.7 mt -67.6 -51.44 50.27 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.18 -0.95 . . . . 0.0 109.113 179.178 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.401 HG21 HD12 ' A' ' 82' ' ' ILE . 36.3 mm -57.34 -31.64 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.507 0 O-C-N 121.246 -0.909 . . . . 0.0 110.228 179.559 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -89.26 -13.13 38.81 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 120.907 -1.12 . . . . 0.0 112.222 -179.804 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.424 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 76.4 mm-40 -108.84 23.12 15.0 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 120.535 -1.353 . . . . 0.0 111.977 -179.879 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.65 74.18 0.11 Allowed 'General case' 0 N--CA 1.512 2.671 0 O-C-N 121.188 -0.945 . . . . 0.0 111.71 179.227 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.455 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 32.0 m-85 -134.05 -62.94 0.75 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.512 -0.743 . . . . 0.0 109.22 179.433 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -131.2 163.06 28.56 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.472 -0.768 . . . . 0.0 109.418 179.315 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.447 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 8.3 t0 -107.93 108.65 19.89 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.091 -1.006 . . . . 0.0 110.417 -179.911 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -58.7 -37.54 76.32 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.249 -0.907 . . . . 0.0 110.19 179.742 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 18.4 tp -59.03 -39.01 80.63 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.102 -0.999 . . . . 0.0 110.19 -179.973 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.411 HD23 ' CD2' ' A' ' 57' ' ' HIS . 58.4 tp -71.02 -45.5 63.8 Favored 'General case' 0 N--CA 1.505 2.29 0 C-N-CA 119.123 -1.031 . . . . 0.0 108.884 179.318 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.421 HG22 ' CE1' ' A' ' 64' ' ' TYR . 20.6 mt -60.91 -39.09 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.384 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 178.358 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.77 -39.88 95.57 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.116 -0.99 . . . . 0.0 109.355 178.741 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 13.5 mmtm -59.54 -47.73 84.4 Favored 'General case' 0 N--CA 1.51 2.575 0 O-C-N 121.137 -0.977 . . . . 0.0 109.287 179.455 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.6 m0 -59.68 -35.18 73.96 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.364 -0.835 . . . . 0.0 110.244 179.549 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.429 ' HD2' ' OH ' ' A' ' 64' ' ' TYR . 8.9 mtp85 -81.94 -33.02 30.53 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.112 -0.992 . . . . 0.0 110.757 179.76 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 7.9 mmtt -51.82 178.01 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.782 0 O-C-N 121.007 -1.058 . . . . 0.0 110.851 -179.855 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 28.5 m -105.38 140.43 38.5 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.252 -0.905 . . . . 0.0 109.395 179.188 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.88 -22.85 37.84 Favored Glycine 0 N--CA 1.494 2.534 0 C-N-CA 119.709 -1.234 . . . . 0.0 110.465 -179.26 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -91.22 58.43 3.68 Favored 'General case' 0 N--CA 1.505 2.277 0 CA-C-N 119.181 1.49 . . . . 0.0 110.056 179.831 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -66.6 -36.08 81.75 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.076 -1.015 . . . . 0.0 110.272 179.891 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.1 mmmt -127.95 97.36 4.77 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.054 -1.029 . . . . 0.0 110.819 -179.708 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.2 pp -134.64 136.62 42.98 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.111 -0.993 . . . . 0.0 109.983 179.24 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.427 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.9 p -103.9 -28.42 11.6 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.193 -0.942 . . . . 0.0 112.337 -179.787 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.62 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 14.3 m -145.46 -166.63 2.48 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.301 -1.499 . . . . 0.0 109.547 178.955 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 25.6 mt -99.0 -45.84 5.81 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.111 -0.993 . . . . 0.0 109.63 178.613 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 61.8 ttt-85 -93.42 -1.67 55.5 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 120.977 -1.077 . . . . 0.0 111.498 178.911 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.62 ' HB2' ' HB2' ' A' ' 105' ' ' CYS . 1.6 t -83.04 -48.13 10.94 Favored 'General case' 0 N--CA 1.512 2.635 0 N-CA-C 105.331 -2.1 . . . . 0.0 105.331 178.61 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 14.4 pt -76.13 -25.21 16.69 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.553 0 O-C-N 121.208 -0.933 . . . . 0.0 110.83 177.568 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -120.61 -174.68 2.86 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.004 -1.06 . . . . 0.0 110.127 -179.767 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.81 -167.74 1.74 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.202 -0.936 . . . . 0.0 110.412 179.9 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -146.01 -58.32 0.31 Allowed 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.212 -0.93 . . . . 0.0 110.73 -179.748 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -125.49 50.51 1.8 Allowed 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.174 -0.954 . . . . 0.0 110.49 -179.97 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.52 -163.63 1.19 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.282 -0.886 . . . . 0.0 109.735 179.768 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 12.8 t30 -106.45 179.78 4.17 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.068 -1.02 . . . . 0.0 110.151 179.954 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 50.9 m-20 -60.44 141.65 56.11 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.146 -0.971 . . . . 0.0 110.037 -179.827 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 68.78 46.96 58.54 Favored Glycine 0 N--CA 1.491 2.367 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.992 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 64.4 m -139.17 61.02 1.57 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.199 -1.177 . . . . 0.0 110.219 179.975 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -115.56 179.35 3.99 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.112 -0.993 . . . . 0.0 109.952 179.72 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 34.3 t -58.72 153.91 15.76 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.172 -0.955 . . . . 0.0 109.87 179.802 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.452 HG22 HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -72.87 -34.53 46.78 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.394 0 O-C-N 121.126 -0.984 . . . . 0.0 111.217 -179.207 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.511 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 12.3 p -55.64 -33.82 64.39 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 120.817 -1.177 . . . . 0.0 111.165 -178.788 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 6.6 ttp85 -59.56 -35.15 73.7 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 120.882 -1.136 . . . . 0.0 109.55 178.382 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 58.7 t -79.95 125.19 82.43 Favored Pre-proline 0 N--CA 1.503 2.18 0 O-C-N 121.121 -0.987 . . . . 0.0 109.653 179.468 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.12 177.12 2.66 Favored 'Trans proline' 0 N--CA 1.488 1.155 0 O-C-N 123.104 1.055 . . . . 0.0 110.814 179.734 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 3.8 tpp85 -75.01 -38.12 61.64 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.257 -0.902 . . . . 0.0 110.529 -179.818 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.18 -40.67 82.08 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.066 -1.021 . . . . 0.0 110.031 -179.946 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 14.8 tm0? -69.94 -42.28 73.46 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.21 -0.931 . . . . 0.0 109.17 179.25 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 8.2 mt -65.5 -38.44 89.72 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 119.526 -0.869 . . . . 0.0 109.464 179.08 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -59.81 -38.53 82.22 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.113 -0.992 . . . . 0.0 110.013 179.563 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -58.44 -37.29 75.11 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.133 -0.98 . . . . 0.0 110.379 179.895 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -60.19 -43.38 95.96 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.091 -1.006 . . . . 0.0 110.041 -179.969 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.91 -45.79 92.16 Favored 'General case' 0 N--CA 1.509 2.487 0 C-N-CA 119.305 -0.958 . . . . 0.0 109.726 179.875 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 3.3 mmt85 -58.19 -34.28 70.18 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.207 -0.933 . . . . 0.0 110.373 179.618 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -76.73 -31.42 57.13 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.116 -0.99 . . . . 0.0 110.914 179.919 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 42.0 mttt -98.73 23.93 8.16 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 120.812 -1.18 . . . . 0.0 111.642 -179.9 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.71 47.02 53.68 Favored Glycine 0 N--CA 1.5 2.905 0 O-C-N 120.696 -1.252 . . . . 0.0 110.717 179.212 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.7 t -153.47 -171.06 3.78 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.087 -1.243 . . . . 0.0 110.726 179.822 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -123.65 176.77 6.03 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.232 -0.917 . . . . 0.0 110.241 -179.831 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.2 p -158.89 161.17 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.193 -0.942 . . . . 0.0 110.765 -179.953 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 31.6 t -166.3 97.62 0.6 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.325 -0.859 . . . . 0.0 110.971 -179.999 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.511 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 59.4 t80 -101.08 158.65 15.85 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.295 -0.878 . . . . 0.0 110.483 -179.87 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 21.0 m170 -137.59 -60.51 0.65 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.437 -0.789 . . . . 0.0 109.102 179.04 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -138.0 149.13 45.82 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.374 -0.829 . . . . 0.0 109.139 178.793 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . 0.415 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.3 p -88.88 154.98 19.81 Favored 'General case' 0 N--CA 1.507 2.397 0 C-N-CA 119.112 -1.035 . . . . 0.0 111.033 -179.553 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.1 p -74.89 -23.78 17.71 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.327 0 O-C-N 121.318 -0.864 . . . . 0.0 111.678 -179.382 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -52.01 -61.5 2.22 Favored 'General case' 0 N--CA 1.515 2.791 0 O-C-N 120.659 -1.276 . . . . 0.0 110.115 -179.933 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.425 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.9 p -125.61 -167.12 1.65 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.224 -0.923 . . . . 0.0 110.404 179.711 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -97.79 66.93 0.8 Allowed Glycine 0 N--CA 1.493 2.47 0 N-CA-C 108.076 -2.009 . . . . 0.0 108.076 178.54 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 36.7 t -102.97 144.18 31.58 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.305 -1.115 . . . . 0.0 110.111 -179.165 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 32.5 mtp85 -99.29 48.39 0.95 Allowed 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.156 -0.965 . . . . 0.0 109.38 178.993 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.17 96.39 0.05 OUTLIER Glycine 0 N--CA 1.486 1.994 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 -179.814 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 22.8 p -109.17 127.88 54.57 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.151 -1.205 . . . . 0.0 110.339 179.72 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -141.96 141.99 32.96 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.115 -0.991 . . . . 0.0 109.863 -179.734 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -106.75 -49.74 3.25 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.252 -0.905 . . . . 0.0 110.563 -179.801 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 27.9 p -54.09 -38.28 65.18 Favored 'General case' 0 N--CA 1.513 2.683 0 O-C-N 121.012 -1.055 . . . . 0.0 110.614 -179.79 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 117.987 -1.006 . . . . 0.0 110.326 179.923 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.337 0 N-CA-C 109.584 -1.407 . . . . 0.0 109.584 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -93.66 -169.17 38.5 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.981 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.416 ' OG ' ' HD2' ' A' ' 2' ' ' PRO . 0.3 OUTLIER -120.51 162.98 31.52 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.194 -1.18 . . . . 0.0 110.164 -179.978 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.416 ' HD2' ' OG ' ' A' ' 1' ' ' SER . 46.4 Cg_endo -72.75 132.43 18.62 Favored 'Trans proline' 0 C--N 1.317 -1.111 0 O-C-N 123.419 1.221 . . . . 0.0 110.367 -179.993 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.97 74.62 0.92 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.188 -0.945 . . . . 0.0 110.201 -179.969 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.7 pp -148.36 127.37 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.129 -0.982 . . . . 0.0 110.455 179.75 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.7 tttp -134.98 103.14 5.46 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.301 -0.875 . . . . 0.0 110.157 -179.943 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 74.8 p -117.37 172.0 7.61 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.273 -0.892 . . . . 0.0 110.246 -179.972 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.3 mmm-85 -136.01 177.5 7.79 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.197 -0.939 . . . . 0.0 110.245 179.982 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 75.9 mtt180 -125.34 47.59 2.16 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.148 -0.97 . . . . 0.0 110.246 179.991 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.4 t -139.33 41.21 2.07 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.225 -0.922 . . . . 0.0 110.234 -179.966 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 39.1 mttp -130.31 72.28 81.96 Favored Pre-proline 0 N--CA 1.493 1.696 0 O-C-N 121.126 -0.984 . . . . 0.0 110.082 179.996 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -74.23 158.5 45.01 Favored 'Trans proline' 0 C--N 1.317 -1.121 0 O-C-N 123.345 1.182 . . . . 0.0 110.758 -179.963 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.432 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -103.74 143.47 26.7 Favored Pre-proline 0 N--CA 1.5 2.071 0 O-C-N 121.482 -0.761 . . . . 0.0 109.654 179.566 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -68.36 164.24 33.35 Favored 'Trans proline' 0 C--N 1.317 -1.131 0 O-C-N 123.282 1.148 . . . . 0.0 110.94 -179.772 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -48.11 -31.65 5.85 Favored 'General case' 0 N--CA 1.516 2.825 0 O-C-N 121.484 -0.76 . . . . 0.0 111.544 -179.739 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.76 -36.15 40.3 Favored Glycine 0 N--CA 1.498 2.8 0 O-C-N 120.898 -1.126 . . . . 0.0 110.548 179.887 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 23.0 t80 -57.48 -34.18 68.76 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.983 -1.304 . . . . 0.0 110.504 179.76 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -52.58 -36.64 56.47 Favored 'General case' 0 N--CA 1.513 2.697 0 O-C-N 120.912 -1.117 . . . . 0.0 110.212 179.743 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.9 mtmt -58.56 -36.09 73.37 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.216 -0.927 . . . . 0.0 110.259 179.534 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 1.7 pt -120.7 35.01 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 O-C-N 121.109 -0.995 . . . . 0.0 110.77 179.881 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.436 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.7 OUTLIER -83.7 -43.33 0.8 Allowed Pre-proline 0 N--CA 1.51 2.557 0 O-C-N 121.031 -1.043 . . . . 0.0 113.313 -179.085 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.436 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.5 Cg_endo -75.37 -35.24 3.0 Favored 'Trans proline' 0 N--CA 1.486 1.044 0 O-C-N 122.6 0.789 . . . . 0.0 111.903 -178.094 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 88.6 m -60.16 -43.26 95.94 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 120.95 -1.094 . . . . 0.0 110.1 -179.738 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.9 mt -65.95 -41.16 91.61 Favored 'General case' 0 N--CA 1.507 2.418 0 C-N-CA 119.472 -0.891 . . . . 0.0 109.355 179.512 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.17 -34.63 72.34 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.259 -0.9 . . . . 0.0 110.077 179.277 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -58.49 -36.72 74.19 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.145 -0.972 . . . . 0.0 110.349 179.869 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.424 ' CD2' ' HD3' ' A' ' 59' ' ' ARG . 11.6 m-85 -55.78 -41.47 74.11 Favored 'General case' 0 N--CA 1.512 2.634 0 O-C-N 120.905 -1.122 . . . . 0.0 109.869 179.56 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -58.24 -25.98 62.35 Favored 'General case' 0 N--CA 1.506 2.352 0 C-N-CA 119.302 -0.959 . . . . 0.0 110.501 179.05 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 15.2 mm -68.41 -52.23 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.342 0 O-C-N 120.923 -1.111 . . . . 0.0 109.162 179.488 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -66.89 -42.47 85.45 Favored 'General case' 0 N--CA 1.508 2.451 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.018 179.31 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.69 -35.53 81.35 Favored 'General case' 0 N--CA 1.506 2.358 0 C-N-CA 119.44 -0.904 . . . . 0.0 109.106 178.744 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.71 -40.38 83.54 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.082 -1.011 . . . . 0.0 109.997 179.582 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -62.55 -47.74 82.57 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.202 -0.937 . . . . 0.0 109.717 -179.957 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.405 ' HB2' ' CG1' ' A' ' 52' ' ' ILE . . . -69.05 -40.24 78.65 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.164 -0.96 . . . . 0.0 109.278 179.213 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 41.4 mm-40 -67.57 -31.69 71.93 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.248 -0.907 . . . . 0.0 110.398 179.465 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.2 mmmt -92.89 -34.66 13.72 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 120.861 -1.149 . . . . 0.0 110.736 179.965 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -57.54 -36.07 71.14 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.017 -1.052 . . . . 0.0 110.153 179.836 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 9.2 mtmt -54.39 -37.2 64.75 Favored 'General case' 0 N--CA 1.512 2.627 0 O-C-N 121.064 -1.022 . . . . 0.0 110.461 179.879 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.3 p -106.2 39.19 1.85 Allowed 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.092 -1.005 . . . . 0.0 110.194 179.657 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.1 m -154.94 89.54 1.23 Allowed 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.151 -0.968 . . . . 0.0 110.496 -179.995 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt 53.48 86.98 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.06 -1.025 . . . . 0.0 110.664 -179.852 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 tp -154.36 87.58 1.19 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.194 -0.941 . . . . 0.0 110.648 -179.986 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.21 -39.08 10.27 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.214 -0.929 . . . . 0.0 110.275 179.801 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -115.56 170.11 8.67 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.027 -1.045 . . . . 0.0 110.226 179.94 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 17.1 mttt 53.24 77.27 0.18 Allowed 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.017 -1.052 . . . . 0.0 110.752 179.952 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.9 t -115.31 -55.16 2.48 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.178 -0.951 . . . . 0.0 110.508 179.958 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.7 m-20 -55.12 -38.29 68.0 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.094 -1.004 . . . . 0.0 110.036 179.763 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -59.8 -38.31 81.58 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.274 -0.891 . . . . 0.0 110.144 179.708 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -64.47 -40.71 96.22 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.113 -0.992 . . . . 0.0 109.925 179.947 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 24.8 mt -67.85 -35.78 79.17 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.223 -0.923 . . . . 0.0 110.344 179.899 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 47.1 m0 -58.79 -37.82 77.16 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.003 -1.06 . . . . 0.0 110.019 179.879 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -62.96 -32.17 73.44 Favored 'General case' 0 N--CA 1.504 2.235 0 C-N-CA 119.074 -1.05 . . . . 0.0 109.494 178.425 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.405 ' CG1' ' HB2' ' A' ' 33' ' ' ALA . 68.6 mt -71.83 -59.04 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.232 0 O-C-N 120.91 -1.119 . . . . 0.0 108.999 179.216 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -60.69 -29.11 69.12 Favored 'General case' 0 N--CA 1.511 2.605 0 C-N-CA 118.483 -1.287 . . . . 0.0 109.918 178.9 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.4 mm-40 -68.75 -37.9 79.72 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 120.846 -1.159 . . . . 0.0 109.138 178.215 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.408 HD23 ' CE2' ' A' ' 26' ' ' PHE . 10.9 mt -53.74 -32.18 51.22 Favored 'General case' 0 N--CA 1.511 2.6 0 O-C-N 120.92 -1.112 . . . . 0.0 110.375 179.026 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.444 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 17.6 t60 -56.62 -37.0 70.09 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.004 -1.06 . . . . 0.0 110.302 179.91 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.443 ' NE2' HD21 ' A' ' 91' ' ' LEU . 5.5 m170 -61.41 -51.13 70.04 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.141 -0.974 . . . . 0.0 109.458 179.407 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -57.98 -35.92 71.88 Favored 'General case' 0 N--CA 1.509 2.478 0 C-N-CA 119.377 -0.929 . . . . 0.0 109.715 179.206 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.424 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -65.48 -50.27 65.95 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.102 -0.999 . . . . 0.0 109.353 179.272 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 60.7 p -62.24 -39.12 91.77 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.097 -1.002 . . . . 0.0 109.209 179.24 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.402 ' O ' ' OG1' ' A' ' 65' ' ' THR . 4.9 ttt180 -63.78 -37.39 87.2 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.292 -0.963 . . . . 0.0 109.416 179.001 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -61.0 -50.6 72.71 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.154 -0.966 . . . . 0.0 109.344 179.504 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.428 HG21 HD12 ' A' ' 63' ' ' ILE . 92.0 mt -74.5 -41.91 49.23 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 C-N-CA 119.329 -0.949 . . . . 0.0 108.872 179.193 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.435 ' OH ' ' NH1' ' A' ' 96' ' ' ARG . 58.6 t80 -59.77 -36.21 76.21 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.3 -0.875 . . . . 0.0 109.821 179.032 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.402 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 76.2 m -75.04 -38.77 61.34 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.943 -1.098 . . . . 0.0 110.356 180.0 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.419 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.5 pp -83.23 -31.47 26.99 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.85 -1.156 . . . . 0.0 112.142 -179.275 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.424 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 40.8 t80 -86.4 -41.47 14.44 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 120.658 -1.277 . . . . 0.0 111.874 -179.575 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -90.39 -26.36 19.94 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 120.89 -1.131 . . . . 0.0 112.818 -177.723 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.42 ' HE2' ' CD2' ' A' ' 64' ' ' TYR . 0.7 OUTLIER -109.11 -58.2 2.06 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.673 -1.267 . . . . 0.0 110.668 -179.988 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.1 tpt180 -58.32 -33.58 69.66 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.015 -1.053 . . . . 0.0 110.364 179.721 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.7 tttp 59.26 47.21 11.8 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 120.896 -1.128 . . . . 0.0 110.37 179.903 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.8 -58.1 2.2 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.378 -0.826 . . . . 0.0 109.507 179.339 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.439 HG23 HD12 ' A' ' 73' ' ' ILE . 14.8 tt -54.91 162.39 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.601 0 O-C-N 121.366 -0.834 . . . . 0.0 110.224 179.55 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.0 t -110.53 147.36 34.32 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.188 -0.945 . . . . 0.0 109.805 178.975 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -43.15 -33.83 0.98 Allowed 'General case' 0 N--CA 1.52 3.04 0 O-C-N 121.376 -0.828 . . . . 0.0 111.986 -179.594 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.6 -48.04 83.52 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 120.956 -1.09 . . . . 0.0 109.474 179.556 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 23.9 tp -70.52 -41.79 72.12 Favored 'General case' 0 N--CA 1.504 2.233 0 C-N-CA 119.236 -0.986 . . . . 0.0 108.705 178.611 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.424 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 26.2 t80 -61.71 -36.56 81.29 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.27 -0.894 . . . . 0.0 109.478 178.821 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -71.96 -43.77 64.63 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.024 -1.048 . . . . 0.0 108.905 179.047 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.432 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 72.8 t90 -59.42 -37.97 79.42 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.227 -0.921 . . . . 0.0 109.428 178.979 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.447 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 18.8 mt -65.74 -49.77 67.21 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.247 -0.908 . . . . 0.0 109.55 179.531 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.455 HD11 HG21 ' A' ' 82' ' ' ILE . 39.7 mm -59.6 -33.16 50.92 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.515 0 O-C-N 121.258 -0.901 . . . . 0.0 110.164 179.68 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.13 -6.3 57.11 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 120.909 -1.119 . . . . 0.0 112.379 -179.802 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.422 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 7.6 mm-40 -114.46 21.81 14.24 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.537 -1.352 . . . . 0.0 111.899 -179.941 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.01 77.74 0.12 Allowed 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.014 -1.054 . . . . 0.0 111.433 179.371 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.447 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 33.0 m-85 -136.7 -63.46 0.62 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.499 -0.75 . . . . 0.0 109.418 179.653 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -125.6 -174.26 3.03 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.431 -0.793 . . . . 0.0 109.293 179.342 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.444 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 5.4 t0 -121.67 102.76 8.43 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.098 -1.001 . . . . 0.0 110.343 -179.956 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.5 mtpt -60.37 -40.38 90.6 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.143 -0.973 . . . . 0.0 109.874 179.618 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 30.9 tp -59.97 -42.78 94.88 Favored 'General case' 0 N--CA 1.508 2.425 0 C-N-CA 119.408 -0.917 . . . . 0.0 109.67 179.711 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.443 HD21 ' NE2' ' A' ' 57' ' ' HIS . 37.0 tp -64.97 -50.44 66.34 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.168 -0.957 . . . . 0.0 108.927 179.529 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.411 HG23 ' CE1' ' A' ' 64' ' ' TYR . 55.9 mt -59.25 -36.04 61.19 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.413 0 O-C-N 121.188 -0.945 . . . . 0.0 108.797 178.593 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -64.53 -44.93 89.29 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.135 -0.978 . . . . 0.0 109.341 178.726 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.416 ' CD ' ' CD2' ' A' ' 106' ' ' LEU . 8.7 mttp -59.66 -44.68 93.46 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.087 -1.008 . . . . 0.0 109.862 179.163 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.408 ' CH2' HD21 ' A' ' 91' ' ' LEU . 5.5 m0 -59.04 -35.49 73.4 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.158 -0.964 . . . . 0.0 110.105 179.262 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.435 ' NH1' ' OH ' ' A' ' 64' ' ' TYR . 13.2 mtp85 -85.04 -30.4 24.16 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.07 -1.019 . . . . 0.0 110.513 179.269 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.43 -176.93 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.719 0 O-C-N 120.987 -1.07 . . . . 0.0 110.697 179.865 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 12.0 m -102.23 135.11 44.4 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.208 -0.933 . . . . 0.0 109.594 179.012 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 97.04 10.42 54.92 Favored Glycine 0 N--CA 1.494 2.522 0 O-C-N 121.132 -0.98 . . . . 0.0 111.081 -179.345 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -118.35 71.87 0.85 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 119.339 1.57 . . . . 0.0 109.641 179.576 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -94.62 -33.75 12.88 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.158 -0.964 . . . . 0.0 110.871 -179.804 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.68 77.08 1.77 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.99 -1.069 . . . . 0.0 110.997 -179.49 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.3 pp -125.44 159.36 32.1 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.031 -1.043 . . . . 0.0 109.83 179.042 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.441 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.6 p -120.3 -33.06 3.98 Favored 'General case' 0 N--CA 1.501 2.101 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -178.709 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.558 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.3 m -140.27 -168.04 2.45 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 120.056 -1.653 . . . . 0.0 110.254 179.573 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.416 ' CD2' ' CD ' ' A' ' 94' ' ' LYS . 46.1 mt -95.65 -39.45 9.9 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.166 -0.959 . . . . 0.0 110.069 179.134 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.86 28.26 5.36 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 120.934 -1.104 . . . . 0.0 110.042 178.006 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.558 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.8 t -126.32 15.55 7.75 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.093 -1.004 . . . . 0.0 108.855 -179.669 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.2 pt -157.81 36.86 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.292 0 O-C-N 120.803 -1.185 . . . . 0.0 110.55 -178.776 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -117.58 134.05 55.3 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 120.73 -1.231 . . . . 0.0 111.824 -178.071 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.45 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 9.5 ptpp? -130.86 -170.05 2.28 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.249 -0.907 . . . . 0.0 110.097 179.406 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 60.31 -74.64 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.514 -0.741 . . . . 0.0 111.38 -179.899 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.405 ' N ' ' O ' ' A' ' 111' ' ' LYS . 13.7 mm-40 -112.6 123.83 51.17 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.868 -1.145 . . . . 0.0 110.237 -179.955 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 17.3 p -137.02 -179.82 5.94 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.177 -0.952 . . . . 0.0 110.185 -179.971 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -118.82 -57.05 2.07 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.243 -0.911 . . . . 0.0 110.285 179.995 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -123.42 103.42 8.46 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.128 -0.982 . . . . 0.0 110.205 -179.955 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 98.18 -143.71 16.83 Favored Glycine 0 N--CA 1.493 2.469 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.981 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 14.9 m -145.81 -167.84 2.82 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.234 -1.156 . . . . 0.0 110.359 179.999 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.45 ' OG1' ' HA ' ' A' ' 111' ' ' LYS . 1.5 m -60.6 169.06 1.92 Allowed 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.228 -0.92 . . . . 0.0 109.978 179.908 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 49.3 t -95.2 154.13 17.33 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 119.555 -0.858 . . . . 0.0 109.186 178.913 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.445 HD13 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -71.56 -37.18 62.85 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.441 0 O-C-N 121.115 -0.99 . . . . 0.0 110.987 -179.053 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.478 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 10.8 p -53.97 -34.35 59.49 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 120.932 -1.105 . . . . 0.0 111.127 -178.703 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 10.9 ttp85 -59.53 -34.88 73.18 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 120.966 -1.084 . . . . 0.0 109.542 178.38 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 49.5 t -79.9 124.75 83.07 Favored Pre-proline 0 N--CA 1.505 2.29 0 O-C-N 121.14 -0.975 . . . . 0.0 109.925 179.614 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -65.13 178.7 1.81 Allowed 'Trans proline' 0 N--CA 1.488 1.205 0 O-C-N 123.113 1.06 . . . . 0.0 110.804 179.517 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.2 mmt85 -75.05 -37.73 61.61 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.233 -0.917 . . . . 0.0 110.489 -179.803 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.64 -42.81 89.18 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.043 -1.035 . . . . 0.0 109.971 -179.752 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -68.79 -41.65 78.44 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.281 -0.968 . . . . 0.0 109.128 179.256 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 5.6 mt -64.17 -38.57 91.54 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.172 -0.955 . . . . 0.0 109.701 179.166 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -60.61 -40.15 90.81 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.095 -1.003 . . . . 0.0 109.853 179.765 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -59.62 -37.07 77.64 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.12 -0.987 . . . . 0.0 110.16 179.739 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -60.67 -45.15 95.23 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.114 -0.991 . . . . 0.0 109.843 179.859 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.13 -46.41 89.12 Favored 'General case' 0 N--CA 1.507 2.389 0 C-N-CA 119.337 -0.945 . . . . 0.0 109.687 179.759 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.79 -35.2 74.16 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.192 -0.943 . . . . 0.0 110.11 179.559 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -73.89 -32.64 63.69 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.101 -1.0 . . . . 0.0 110.773 179.887 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 1.4 ttmt -98.87 23.32 9.0 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.944 -1.098 . . . . 0.0 111.685 179.996 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.92 46.73 55.06 Favored Glycine 0 N--CA 1.499 2.873 0 O-C-N 120.69 -1.256 . . . . 0.0 110.702 179.288 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.8 t -148.79 -165.15 2.2 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.154 -1.204 . . . . 0.0 110.468 179.848 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -131.62 153.52 49.84 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.214 -0.929 . . . . 0.0 110.186 -179.874 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 8.1 p -131.55 160.66 42.2 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 O-C-N 121.193 -0.942 . . . . 0.0 110.349 179.964 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 47.7 t -168.57 86.68 0.19 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.232 -0.917 . . . . 0.0 110.744 179.99 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.478 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 57.8 t80 -102.47 161.72 13.49 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.181 -0.949 . . . . 0.0 110.821 -179.483 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 3.3 m170 -139.5 -60.96 0.55 Allowed 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 178.995 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -134.86 150.17 50.42 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.339 -0.85 . . . . 0.0 108.774 178.47 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 28.3 p -92.65 154.09 18.58 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.096 -1.042 . . . . 0.0 111.117 -179.42 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.9 p -73.31 -25.19 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 O-C-N 121.39 -0.819 . . . . 0.0 111.475 -179.603 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -49.73 -55.79 12.61 Favored 'General case' 0 N--CA 1.516 2.835 0 O-C-N 120.828 -1.17 . . . . 0.0 110.231 -179.875 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 23.1 p -131.55 -163.41 1.32 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.218 -0.926 . . . . 0.0 110.226 179.651 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -102.23 63.47 0.48 Allowed Glycine 0 N--CA 1.492 2.394 0 N-CA-C 108.015 -2.034 . . . . 0.0 108.015 178.4 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 31.6 t -104.01 141.48 36.11 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.362 -1.081 . . . . 0.0 110.162 -178.993 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 6.0 ttt-85 -96.33 53.26 1.31 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.303 -0.873 . . . . 0.0 109.423 178.995 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.23 96.87 0.03 OUTLIER Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.714 -1.355 . . . . 0.0 109.714 -179.857 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.2 p -107.24 127.21 53.33 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.165 -1.197 . . . . 0.0 110.34 179.608 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -152.99 148.82 27.53 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.167 -0.958 . . . . 0.0 110.355 -179.546 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -104.14 -45.89 4.59 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.191 -0.943 . . . . 0.0 110.759 -179.727 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 3.0 m -52.89 -38.57 61.87 Favored 'General case' 0 N--CA 1.513 2.682 0 O-C-N 120.935 -1.103 . . . . 0.0 110.722 -179.742 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 . . . . . 0 N--CA 1.495 1.802 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.223 179.893 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.291 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -74.36 168.82 54.34 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 179.986 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 60.1 p -131.57 93.88 27.44 Favored Pre-proline 0 N--CA 1.495 1.793 0 O-C-N 121.207 -1.173 . . . . 0.0 110.228 179.999 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.59 173.47 13.25 Favored 'Trans proline' 0 C--N 1.317 -1.124 0 O-C-N 123.402 1.211 . . . . 0.0 110.437 179.958 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.7 tpp85 -116.99 130.0 56.4 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.198 -0.939 . . . . 0.0 110.159 -179.991 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 85.1 mt -119.73 92.64 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 O-C-N 121.257 -0.902 . . . . 0.0 110.021 -179.999 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.4 tttt -119.03 98.72 6.32 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.195 -0.941 . . . . 0.0 110.159 179.965 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.6 m -134.46 61.19 1.68 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.183 -0.948 . . . . 0.0 110.19 -179.974 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 80.2 mtt-85 -119.91 40.17 3.48 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.15 -0.969 . . . . 0.0 110.238 179.998 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.2 179.42 4.7 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.181 -0.95 . . . . 0.0 110.057 -179.948 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.0 p -124.59 -167.89 1.73 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.234 -0.916 . . . . 0.0 110.168 -180.0 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 24.7 mmtt -137.7 160.32 65.42 Favored Pre-proline 0 N--CA 1.494 1.739 0 O-C-N 121.25 -0.906 . . . . 0.0 110.35 -179.945 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -73.22 158.28 49.06 Favored 'Trans proline' 0 C--N 1.318 -1.059 0 O-C-N 123.362 1.19 . . . . 0.0 110.543 -179.935 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.427 ' HB3' ' CZ2' ' A' ' 80' ' ' TRP . . . -60.41 144.2 88.56 Favored Pre-proline 0 N--CA 1.51 2.566 0 C-N-CA 119.566 -0.854 . . . . 0.0 109.65 179.995 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -72.45 160.41 46.85 Favored 'Trans proline' 0 C--N 1.317 -1.116 0 O-C-N 123.346 1.182 . . . . 0.0 110.722 -179.823 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -49.37 -31.55 9.67 Favored 'General case' 0 N--CA 1.515 2.789 0 O-C-N 121.394 -0.816 . . . . 0.0 111.361 -179.869 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.55 -33.4 40.76 Favored Glycine 0 N--CA 1.498 2.798 0 O-C-N 120.941 -1.099 . . . . 0.0 110.686 179.888 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -55.21 -33.08 62.75 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 120.938 -1.331 . . . . 0.0 110.665 179.939 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -54.16 -37.71 64.73 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 120.981 -1.074 . . . . 0.0 110.325 179.776 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.3 mtpp -59.74 -36.94 77.64 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.227 -0.921 . . . . 0.0 110.201 179.545 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 1.6 pt -114.96 33.85 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 O-C-N 121.129 -0.982 . . . . 0.0 110.702 179.759 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.427 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 1.1 ttpt -83.81 -43.21 0.79 Allowed Pre-proline 0 N--CA 1.508 2.469 0 O-C-N 121.005 -1.059 . . . . 0.0 113.102 -179.356 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.3 Cg_endo -75.7 -35.14 2.82 Favored 'Trans proline' 0 N--CA 1.487 1.103 0 O-C-N 122.592 0.785 . . . . 0.0 111.563 -178.448 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 90.5 m -58.48 -41.86 86.21 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 120.948 -1.095 . . . . 0.0 110.05 -179.926 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.0 mt -68.18 -41.3 81.64 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.514 -0.874 . . . . 0.0 109.297 179.398 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.3 m -60.42 -33.95 73.26 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.168 -0.958 . . . . 0.0 109.845 178.926 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -55.57 -34.96 65.24 Favored 'General case' 0 N--CA 1.511 2.579 0 O-C-N 121.01 -1.056 . . . . 0.0 110.198 179.465 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.431 ' CD1' ' HD3' ' A' ' 59' ' ' ARG . 15.7 m-85 -55.32 -35.79 65.52 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.103 -0.998 . . . . 0.0 110.516 179.704 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -57.16 -38.19 73.2 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.095 -1.003 . . . . 0.0 110.647 -179.628 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.2 mp -66.36 -40.81 87.66 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 C-N-CA 119.316 -0.954 . . . . 0.0 109.158 179.725 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -70.32 -46.87 63.35 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.125 -0.985 . . . . 0.0 108.784 178.97 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.407 ' CD1' ' CG2' ' A' ' 52' ' ' ILE . 2.2 tp -62.07 -35.54 78.94 Favored 'General case' 0 N--CA 1.507 2.419 0 C-N-CA 119.377 -0.929 . . . . 0.0 109.305 178.555 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.92 -36.08 69.78 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.106 -0.996 . . . . 0.0 110.391 179.699 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -62.88 -52.4 63.23 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.054 -1.029 . . . . 0.0 109.458 -179.883 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.42 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -68.91 -41.96 77.48 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 119.042 -1.063 . . . . 0.0 108.589 178.809 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -60.45 -32.42 71.36 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.22 -0.925 . . . . 0.0 110.187 179.309 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 41.8 mtpt -93.6 -30.16 15.1 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 120.939 -1.1 . . . . 0.0 111.037 179.952 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -54.54 -35.78 63.59 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 120.861 -1.15 . . . . 0.0 110.407 -179.947 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.2 ttpt -55.79 -48.55 75.16 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.007 -1.058 . . . . 0.0 110.316 -179.965 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 53.04 -179.95 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.073 -1.017 . . . . 0.0 110.912 179.959 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.0 t -117.61 161.26 19.93 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.105 -0.997 . . . . 0.0 110.092 179.994 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 31.2 mtpt 52.11 38.52 24.43 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.091 -1.006 . . . . 0.0 110.803 -179.826 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.4 tp -128.15 -57.0 1.24 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.234 -0.916 . . . . 0.0 110.475 -179.753 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 53.96 95.62 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.043 -1.036 . . . . 0.0 110.865 -179.735 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -173.48 103.92 0.12 Allowed 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.289 -0.882 . . . . 0.0 110.604 179.85 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 30.2 mtmt 51.81 60.98 3.46 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.037 -1.039 . . . . 0.0 110.496 -179.719 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.5 m -96.14 -39.32 9.76 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.235 -0.915 . . . . 0.0 110.616 -179.819 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -61.34 -40.88 95.89 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.112 -0.992 . . . . 0.0 109.66 179.99 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -61.03 -39.45 89.81 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.217 -0.927 . . . . 0.0 109.788 179.455 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.411 ' HG2' ' CB ' ' A' ' 33' ' ' ALA . 0.3 OUTLIER -59.44 -44.59 92.9 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.187 -0.946 . . . . 0.0 109.53 179.694 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 20.8 mt -59.41 -35.97 74.97 Favored 'General case' 0 N--CA 1.508 2.449 0 C-N-CA 119.318 -0.953 . . . . 0.0 110.296 -179.736 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.463 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.1 m0 -54.0 -38.62 65.28 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 120.885 -1.135 . . . . 0.0 109.52 179.195 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -67.83 -37.27 81.71 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.328 -0.857 . . . . 0.0 109.553 178.817 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.42 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 16.6 mt -66.97 -42.84 89.27 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.329 0 O-C-N 121.038 -1.039 . . . . 0.0 109.42 179.604 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.43 ' CE ' ' HB3' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -68.68 -29.44 67.9 Favored 'General case' 0 N--CA 1.502 2.166 0 C-N-CA 118.66 -1.216 . . . . 0.0 109.864 179.285 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.408 ' N ' ' HG3' ' A' ' 53' ' ' MET . 23.4 mt-30 -66.24 -37.69 86.12 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.997 -1.065 . . . . 0.0 109.282 178.896 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.41 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.6 mt -52.77 -32.83 45.68 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.013 -1.054 . . . . 0.0 109.959 179.187 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.435 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 8.4 t60 -56.93 -37.27 71.25 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.058 -1.026 . . . . 0.0 109.966 179.247 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.44 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 5.5 m170 -59.42 -49.35 78.15 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.097 -1.002 . . . . 0.0 109.103 179.215 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -58.78 -35.99 73.69 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.305 -0.872 . . . . 0.0 109.43 178.856 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.431 ' HD3' ' CD1' ' A' ' 26' ' ' PHE . 32.6 mmm-85 -62.81 -51.98 64.97 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.159 -0.963 . . . . 0.0 109.078 178.978 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 92.9 p -63.7 -39.23 93.79 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.237 -0.914 . . . . 0.0 109.127 179.262 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.407 ' O ' ' OG1' ' A' ' 65' ' ' THR . 58.7 ttt-85 -64.48 -37.88 89.06 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 121.094 -1.004 . . . . 0.0 109.634 179.195 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -62.3 -49.54 75.22 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.075 -1.016 . . . . 0.0 109.485 179.528 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.428 HG22 HD11 ' A' ' 63' ' ' ILE . 86.9 mt -75.43 -40.62 42.25 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.328 0 O-C-N 121.168 -0.957 . . . . 0.0 109.313 179.382 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.422 ' CE1' HG21 ' A' ' 92' ' ' ILE . 38.6 t80 -63.03 -22.06 66.59 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.202 -0.937 . . . . 0.0 110.551 178.758 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.407 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 87.4 m -90.78 -35.51 14.81 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 120.665 -1.272 . . . . 0.0 110.39 179.751 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.7 pp -82.87 -31.95 27.67 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.917 -1.114 . . . . 0.0 112.207 -179.246 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.429 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 40.3 t80 -86.13 -38.01 18.18 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 120.657 -1.277 . . . . 0.0 111.271 -179.477 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.403 ' CD2' ' CD1' ' A' ' 64' ' ' TYR . 17.2 m-85 -89.65 -21.93 22.53 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.896 -1.128 . . . . 0.0 112.614 -178.663 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.7 mttm -119.58 -61.07 1.66 Allowed 'General case' 0 N--CA 1.501 2.093 0 O-C-N 120.466 -1.396 . . . . 0.0 111.211 -179.671 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.81 -30.65 67.78 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.113 -0.992 . . . . 0.0 110.808 -179.502 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.0 ttmm 57.28 41.59 26.48 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 120.852 -1.155 . . . . 0.0 110.023 -179.498 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.14 35.64 3.87 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.425 -0.797 . . . . 0.0 109.871 179.288 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 14.1 tt -155.29 162.14 1.89 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.197 -0.939 . . . . 0.0 109.918 -179.975 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.1 148.92 30.09 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.105 -0.997 . . . . 0.0 110.245 179.966 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -46.38 -32.29 3.12 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 121.35 -0.843 . . . . 0.0 111.553 179.97 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -62.02 -50.55 71.57 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 120.843 -1.16 . . . . 0.0 109.349 179.427 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 54.4 tp -66.37 -45.4 80.25 Favored 'General case' 0 N--CA 1.506 2.336 0 C-N-CA 119.141 -1.024 . . . . 0.0 108.465 178.818 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.429 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 18.4 t80 -59.78 -38.26 81.36 Favored 'General case' 0 N--CA 1.506 2.331 0 C-N-CA 119.694 -0.802 . . . . 0.0 109.551 179.112 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -73.75 -42.43 61.11 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.102 -0.999 . . . . 0.0 108.764 178.726 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.429 ' CE2' ' HG3' ' A' ' 84' ' ' GLU . 72.1 t90 -57.88 -36.12 71.93 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.228 -0.92 . . . . 0.0 109.772 178.943 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.455 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 11.9 mt -69.56 -50.28 46.29 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.119 -0.988 . . . . 0.0 108.84 179.213 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.455 HG23 HD11 ' A' ' 82' ' ' ILE . 35.5 mm -57.16 -30.88 35.88 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.639 0 O-C-N 121.205 -0.934 . . . . 0.0 110.117 179.362 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -89.18 -20.87 23.68 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 120.886 -1.134 . . . . 0.0 112.159 -179.549 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.429 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 77.9 mm-40 -101.63 22.19 13.17 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 120.659 -1.276 . . . . 0.0 112.08 -179.767 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 73.46 77.75 0.13 Allowed 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.05 -1.031 . . . . 0.0 111.659 179.079 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.455 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 29.0 m-85 -134.64 -64.71 0.66 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.553 -0.717 . . . . 0.0 109.468 179.721 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -120.63 -174.06 2.72 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.378 -0.826 . . . . 0.0 109.513 179.336 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.435 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 5.9 t0 -124.7 102.86 7.8 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.165 -0.96 . . . . 0.0 110.348 -179.878 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -60.22 -40.28 89.6 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.226 -0.921 . . . . 0.0 109.806 179.646 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.2 tp -60.33 -37.85 81.89 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 121.204 -0.935 . . . . 0.0 110.045 179.829 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.429 ' CD2' ' CZ3' ' A' ' 95' ' ' TRP . 45.2 tp -70.63 -49.3 49.01 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.078 -1.014 . . . . 0.0 108.813 179.179 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.422 HG21 ' CE1' ' A' ' 64' ' ' TYR . 34.5 mt -59.0 -34.03 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 121.255 -0.903 . . . . 0.0 109.098 178.556 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.12 -46.64 76.84 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.089 -1.007 . . . . 0.0 109.356 178.933 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.41 ' CD ' ' CD2' ' A' ' 106' ' ' LEU . 10.9 mttp -60.5 -44.36 96.06 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.129 -0.982 . . . . 0.0 109.804 179.32 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.429 ' CZ3' ' CD2' ' A' ' 91' ' ' LEU . 3.3 m0 -58.66 -28.66 65.92 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.086 -1.009 . . . . 0.0 109.966 178.926 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.405 ' CD ' ' OH ' ' A' ' 64' ' ' TYR . 0.0 OUTLIER -99.69 22.53 10.81 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 120.939 -1.101 . . . . 0.0 110.886 178.676 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -109.41 -174.28 2.47 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.732 -1.23 . . . . 0.0 109.851 179.366 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 29.2 m -104.6 137.8 41.9 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.214 -0.929 . . . . 0.0 109.441 179.149 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 102.2 -25.77 26.6 Favored Glycine 0 N--CA 1.493 2.496 0 C-N-CA 119.815 -1.184 . . . . 0.0 110.2 -179.004 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 -92.37 58.63 3.25 Favored 'General case' 0 N--CA 1.504 2.258 0 CA-C-N 119.009 1.404 . . . . 0.0 109.994 179.771 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -72.88 -37.64 67.26 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.006 -1.059 . . . . 0.0 110.2 179.909 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.87 82.67 2.1 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.039 -1.038 . . . . 0.0 110.47 179.949 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -119.71 148.36 43.48 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.168 -0.958 . . . . 0.0 110.349 179.759 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.44 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.1 p -113.03 -26.66 8.37 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.163 -0.96 . . . . 0.0 113.374 -179.516 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.59 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 11.4 m -143.48 -167.31 2.54 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 120.068 -1.645 . . . . 0.0 109.642 179.065 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.41 ' CD2' ' CD ' ' A' ' 94' ' ' LYS . 14.4 mt -97.15 -38.28 9.78 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.103 -0.998 . . . . 0.0 110.306 179.224 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 22.7 ttt85 -102.98 31.83 4.02 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 120.893 -1.129 . . . . 0.0 109.678 178.153 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.59 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.308 1.7 t -127.71 16.53 6.93 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.154 -0.966 . . . . 0.0 108.953 -179.257 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.1 pt -159.25 38.06 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 120.947 -1.095 . . . . 0.0 110.628 -178.545 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.402 ' O ' ' OG1' ' A' ' 119' ' ' THR . 1.5 mm-40 -113.52 129.11 56.62 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 120.749 -1.22 . . . . 0.0 111.321 -178.49 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.435 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 4.5 ptpt -126.62 161.77 27.28 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.2 -0.937 . . . . 0.0 110.215 179.36 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -149.92 -57.4 0.19 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.161 -0.962 . . . . 0.0 110.713 179.945 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -133.84 -166.82 1.84 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.086 -1.009 . . . . 0.0 110.113 -179.943 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 80.9 p -94.93 -37.29 11.24 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.143 -0.973 . . . . 0.0 110.532 179.825 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -105.69 144.06 32.97 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.012 -1.055 . . . . 0.0 109.975 179.747 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 53.5 49.14 20.18 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 120.996 -1.065 . . . . 0.0 110.613 -179.78 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -92.4 -167.64 39.72 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 -180.0 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 66.1 m -148.2 60.16 1.1 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.202 -1.175 . . . . 0.0 110.506 -179.881 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.435 ' OG1' ' HA ' ' A' ' 111' ' ' LYS . 0.9 OUTLIER -119.65 172.85 7.38 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.078 -1.014 . . . . 0.0 110.26 179.755 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 48.9 t -106.7 155.02 20.11 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.405 -0.81 . . . . 0.0 109.531 179.231 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.448 HD13 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -72.74 -35.72 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.395 0 O-C-N 121.081 -1.012 . . . . 0.0 111.255 -179.172 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.503 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 11.0 p -54.21 -31.86 54.2 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.805 -1.185 . . . . 0.0 111.298 -178.861 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 6.7 ttp85 -58.22 -32.86 68.71 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 120.929 -1.107 . . . . 0.0 109.798 178.375 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 60.8 t -81.87 125.24 78.21 Favored Pre-proline 0 N--CA 1.506 2.328 0 O-C-N 121.124 -0.985 . . . . 0.0 109.923 179.68 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -66.65 178.99 2.35 Favored 'Trans proline' 0 N--CA 1.488 1.152 0 O-C-N 123.097 1.051 . . . . 0.0 110.551 179.407 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -75.17 -37.77 61.15 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.184 -0.948 . . . . 0.0 110.513 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.06 -41.12 82.64 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.001 -1.062 . . . . 0.0 110.097 -179.732 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -66.91 -41.78 86.5 Favored 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.319 179.494 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.4 mt -63.27 -39.97 96.09 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.226 -0.922 . . . . 0.0 109.693 179.561 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -60.1 -38.31 82.58 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.19 -0.943 . . . . 0.0 109.993 179.782 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -57.79 -36.12 71.75 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.072 -1.018 . . . . 0.0 110.381 179.802 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.36 -49.56 73.39 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.072 -1.017 . . . . 0.0 109.754 179.902 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.11 -38.95 90.85 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.148 -0.97 . . . . 0.0 109.797 179.754 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 43.4 ttp85 -66.78 -35.53 80.31 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.155 -0.966 . . . . 0.0 110.452 179.771 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 25.4 mttm -86.84 -35.04 19.28 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.048 -1.032 . . . . 0.0 110.479 179.86 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 16.8 mttm -80.96 -22.55 39.46 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.086 -1.009 . . . . 0.0 111.472 179.692 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.83 32.91 9.48 Favored Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.673 -1.371 . . . . 0.0 109.673 -179.537 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.1 t -135.9 -161.22 1.13 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.054 -1.262 . . . . 0.0 109.792 179.946 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -130.85 143.08 50.47 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.07 -1.018 . . . . 0.0 109.959 179.944 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 8.1 p -129.85 160.2 41.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.216 -0.927 . . . . 0.0 110.373 -179.981 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 43.6 t -169.94 87.83 0.15 Allowed 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.261 -0.9 . . . . 0.0 111.031 179.96 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.503 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 62.3 t80 -99.68 159.81 14.77 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.187 -0.945 . . . . 0.0 110.491 -179.882 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -138.26 -59.76 0.63 Allowed 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 179.015 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -139.47 151.07 45.9 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.341 -0.849 . . . . 0.0 109.05 178.778 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 29.7 p -91.73 154.49 18.93 Favored 'General case' 0 N--CA 1.505 2.282 0 C-N-CA 119.05 -1.06 . . . . 0.0 111.093 -179.502 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.9 p -72.58 -26.26 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 O-C-N 121.379 -0.826 . . . . 0.0 111.57 -179.455 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -51.05 -51.74 50.23 Favored 'General case' 0 N--CA 1.516 2.839 0 O-C-N 120.764 -1.21 . . . . 0.0 110.195 -179.955 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.463 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 31.8 p -135.0 -169.03 2.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.237 -0.914 . . . . 0.0 111.121 179.764 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -98.39 60.97 0.9 Allowed Glycine 0 N--CA 1.491 2.329 0 N-CA-C 107.756 -2.138 . . . . 0.0 107.756 178.366 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 20.8 t -100.98 143.24 31.36 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.39 -1.065 . . . . 0.0 109.971 -179.021 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 50.5 mtm-85 -97.16 51.94 1.12 Allowed 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.237 -0.914 . . . . 0.0 109.308 179.046 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.41 96.72 0.03 OUTLIER Glycine 0 N--CA 1.487 2.095 0 N-CA-C 109.746 -1.342 . . . . 0.0 109.746 -179.726 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.0 p -106.65 125.24 50.76 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.19 -1.182 . . . . 0.0 110.258 179.67 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -149.28 151.3 33.97 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.199 -0.938 . . . . 0.0 110.162 -179.622 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 4.9 m -97.09 -40.68 8.71 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.326 -0.859 . . . . 0.0 110.48 -179.892 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 3.3 m -58.31 -39.43 79.33 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 121.081 -1.012 . . . . 0.0 110.408 -179.961 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 . . . . . 0 N--CA 1.494 1.769 0 CA-C-O 117.962 -1.018 . . . . 0.0 110.147 179.976 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.256 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -110.28 -158.65 16.76 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.944 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.64 154.96 50.98 Favored Pre-proline 0 N--CA 1.493 1.702 0 O-C-N 121.151 -1.205 . . . . 0.0 110.32 179.901 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.71 134.03 21.31 Favored 'Trans proline' 0 C--N 1.318 -1.075 0 O-C-N 123.396 1.208 . . . . 0.0 110.467 179.991 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.4 ttm-85 -120.82 84.47 2.23 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.196 -0.94 . . . . 0.0 110.23 179.995 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 83.8 mt -131.17 139.85 49.95 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.15 -0.969 . . . . 0.0 110.0 -179.925 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.2 tptt -129.46 120.44 25.45 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.287 -0.883 . . . . 0.0 110.216 -179.998 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.7 p -130.43 132.72 45.86 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.227 -0.921 . . . . 0.0 110.265 179.977 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.42 94.28 4.49 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.287 -0.883 . . . . 0.0 110.241 -179.99 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 mmt85 -117.46 140.13 50.0 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.185 -0.947 . . . . 0.0 110.209 179.895 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.6 m -135.85 -175.14 3.86 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.149 -0.969 . . . . 0.0 110.191 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.4 pttt -152.58 61.0 3.66 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.201 -0.937 . . . . 0.0 110.713 -179.941 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -72.14 158.93 51.14 Favored 'Trans proline' 0 C--N 1.317 -1.113 0 O-C-N 123.226 1.119 . . . . 0.0 110.482 179.82 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.431 ' HB2' ' CE3' ' A' ' 80' ' ' TRP . . . -85.53 143.31 38.44 Favored Pre-proline 0 N--CA 1.504 2.273 0 O-C-N 121.284 -0.885 . . . . 0.0 109.781 179.738 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.49 162.52 42.0 Favored 'Trans proline' 0 C--N 1.317 -1.081 0 O-C-N 123.273 1.144 . . . . 0.0 110.801 -179.611 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -48.96 -31.76 7.95 Favored 'General case' 0 N--CA 1.515 2.803 0 O-C-N 121.433 -0.792 . . . . 0.0 111.318 -179.874 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.0 -35.11 39.96 Favored Glycine 0 N--CA 1.499 2.873 0 O-C-N 120.951 -1.093 . . . . 0.0 110.388 179.801 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -54.88 -32.44 60.86 Favored 'General case' 0 N--CA 1.512 2.664 0 O-C-N 121.013 -1.286 . . . . 0.0 110.617 179.626 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -54.11 -37.86 64.76 Favored 'General case' 0 N--CA 1.512 2.662 0 O-C-N 121.01 -1.056 . . . . 0.0 110.244 179.823 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.6 mmtp -58.86 -37.93 77.61 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.28 -0.887 . . . . 0.0 110.107 179.59 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.422 HG21 ' OH ' ' A' ' 62' ' ' TYR . 2.0 pt -114.4 33.51 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 O-C-N 121.237 -0.914 . . . . 0.0 110.544 179.458 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.423 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 5.7 tmtt? -83.6 -43.57 0.81 Allowed Pre-proline 0 N--CA 1.508 2.466 0 O-C-N 121.005 -1.059 . . . . 0.0 113.019 -179.171 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.4 Cg_endo -76.63 -35.6 1.98 Allowed 'Trans proline' 0 N--CA 1.486 1.069 0 O-C-N 122.545 0.76 . . . . 0.0 111.434 -178.485 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 91.5 m -59.22 -42.32 90.71 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 120.98 -1.075 . . . . 0.0 110.042 -179.752 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.3 mt -65.73 -40.51 92.23 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.225 -0.922 . . . . 0.0 109.574 179.516 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -59.58 -35.87 75.13 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.145 -0.972 . . . . 0.0 110.048 179.287 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -56.49 -36.4 69.1 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 121.019 -1.05 . . . . 0.0 110.315 179.707 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.504 ' CE1' HD12 ' A' ' 55' ' ' LEU . 12.1 m-85 -57.39 -35.76 70.42 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.162 -0.961 . . . . 0.0 110.877 -179.964 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -61.62 -38.56 88.1 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.092 -1.005 . . . . 0.0 111.006 -179.145 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 2.9 mp -62.82 -39.36 84.63 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.499 0 C-N-CA 119.038 -1.065 . . . . 0.0 109.35 -179.989 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.5 tp60 -68.82 -54.63 14.69 Favored 'General case' 0 N--CA 1.506 2.366 0 C-N-CA 119.106 -1.037 . . . . 0.0 108.661 178.9 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.407 ' CD2' ' CG2' ' A' ' 52' ' ' ILE . 0.1 OUTLIER -58.72 -33.96 70.8 Favored 'General case' 0 N--CA 1.511 2.616 0 O-C-N 121.193 -0.942 . . . . 0.0 109.342 178.407 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -57.8 -41.94 83.17 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.004 -1.06 . . . . 0.0 109.98 179.655 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 -63.18 -49.91 72.41 Favored 'General case' 0 N--CA 1.508 2.453 0 C-N-CA 119.135 -1.026 . . . . 0.0 109.411 -179.982 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.436 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -64.78 -40.22 94.91 Favored 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 119.306 -0.958 . . . . 0.0 109.179 179.051 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.412 ' O ' ' OG ' ' A' ' 38' ' ' SER . 60.8 mt-30 -58.38 -34.16 70.41 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.238 -0.914 . . . . 0.0 110.348 179.707 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 17.5 mmtm -93.59 -38.68 11.24 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.048 -1.032 . . . . 0.0 110.45 179.879 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -58.23 -34.64 70.64 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.139 -0.976 . . . . 0.0 110.531 179.992 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.8 ttpp -83.01 -37.13 24.38 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 120.959 -1.088 . . . . 0.0 110.457 179.992 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.412 ' OG ' ' O ' ' A' ' 34' ' ' GLN . 1.8 p -74.53 -37.93 62.91 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.092 -1.005 . . . . 0.0 110.23 179.819 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 43.8 m -71.42 -38.87 71.37 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.104 -0.997 . . . . 0.0 110.042 179.743 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -113.75 128.28 56.36 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.145 -0.972 . . . . 0.0 110.157 179.814 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.6 tp -129.81 58.26 1.65 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.206 -0.934 . . . . 0.0 110.231 -179.9 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -138.8 -65.27 0.5 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.122 -0.987 . . . . 0.0 110.232 179.954 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -126.48 169.73 12.72 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.246 -0.909 . . . . 0.0 110.238 179.996 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.1 ttpt 52.71 55.58 8.82 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.082 -1.012 . . . . 0.0 110.758 179.97 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 43.1 m -111.31 -53.94 2.65 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.244 -0.91 . . . . 0.0 110.364 179.958 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.402 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 85.8 m-20 -56.82 -39.79 74.82 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.169 -0.957 . . . . 0.0 109.951 179.739 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -60.15 -39.29 85.83 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.243 -0.911 . . . . 0.0 109.98 179.633 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 35.5 tp60 -63.76 -46.56 84.74 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.146 -0.971 . . . . 0.0 109.788 179.858 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 51.0 mt -60.88 -35.08 75.69 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.188 -0.945 . . . . 0.0 110.339 179.94 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.421 ' CE3' ' HA2' ' A' ' 149' ' ' GLY . 41.2 m0 -58.31 -39.64 79.93 Favored 'General case' 0 N--CA 1.511 2.579 0 O-C-N 120.973 -1.079 . . . . 0.0 109.675 179.623 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -63.62 -33.15 74.98 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 119.165 -1.014 . . . . 0.0 109.334 178.186 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.436 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 66.9 mt -70.6 -58.52 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.247 0 O-C-N 121.054 -1.029 . . . . 0.0 109.301 179.303 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.01 -25.18 63.44 Favored 'General case' 0 N--CA 1.511 2.616 0 C-N-CA 118.309 -1.356 . . . . 0.0 110.15 178.77 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.4 mm-40 -65.6 -38.84 90.62 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.795 -1.191 . . . . 0.0 109.396 178.495 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.504 HD12 ' CE1' ' A' ' 26' ' ' PHE . 0.2 OUTLIER -54.86 -32.56 60.86 Favored 'General case' 0 N--CA 1.512 2.675 0 O-C-N 120.952 -1.093 . . . . 0.0 110.084 179.308 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.443 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 13.7 t60 -57.5 -40.83 79.54 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.013 -1.054 . . . . 0.0 110.052 -179.666 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.436 ' NE2' HD21 ' A' ' 91' ' ' LEU . 4.8 m170 -64.23 -53.17 53.3 Favored 'General case' 0 N--CA 1.508 2.444 0 C-N-CA 119.338 -0.945 . . . . 0.0 109.342 179.33 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 5.2 tp60 -57.24 -35.08 69.26 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.265 -0.897 . . . . 0.0 109.878 179.547 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.437 ' HG2' ' CE1' ' A' ' 26' ' ' PHE . 1.1 mmt85 -66.44 -49.25 67.32 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.179 -0.951 . . . . 0.0 109.28 179.157 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 84.0 p -64.26 -40.3 95.72 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.187 -0.945 . . . . 0.0 109.152 179.216 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.429 ' O ' ' OG1' ' A' ' 65' ' ' THR . 11.8 ttt85 -62.4 -39.65 93.94 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.155 -0.966 . . . . 0.0 109.413 179.076 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.422 ' OH ' HG21 ' A' ' 19' ' ' ILE . 34.2 t80 -62.14 -51.2 68.81 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.094 -1.003 . . . . 0.0 109.431 179.403 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.427 HG22 HD13 ' A' ' 63' ' ' ILE . 79.5 mt -70.3 -36.98 69.56 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.341 0 O-C-N 121.18 -0.95 . . . . 0.0 109.449 179.342 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.418 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 10.2 t80 -67.09 -42.26 84.91 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.03 -1.044 . . . . 0.0 108.933 178.97 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.429 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 89.4 m -60.72 -41.08 94.56 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.177 -0.952 . . . . 0.0 110.181 179.91 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.402 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.8 pp -83.1 -36.72 24.61 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.997 -1.064 . . . . 0.0 112.407 -179.081 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.429 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 51.6 t80 -86.7 -35.06 19.5 Favored 'General case' 0 N--CA 1.512 2.641 0 O-C-N 120.519 -1.363 . . . . 0.0 111.817 -179.508 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.418 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 6.9 m-85 -98.3 -3.51 37.07 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 120.851 -1.155 . . . . 0.0 113.2 -178.474 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.91 -58.98 0.61 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.326 -1.484 . . . . 0.0 110.762 179.502 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 9.5 ttt85 -62.89 -29.54 70.84 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.048 -1.032 . . . . 0.0 110.722 179.987 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.7 mttt 60.16 43.71 13.77 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.801 -1.187 . . . . 0.0 109.966 -179.569 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.16 37.47 3.67 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.322 -0.861 . . . . 0.0 109.806 179.322 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.429 HD13 HG23 ' A' ' 73' ' ' ILE . 14.4 tt -156.95 162.64 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.165 -0.959 . . . . 0.0 110.221 -179.821 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -110.82 147.97 33.38 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.19 -0.944 . . . . 0.0 110.09 179.554 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -45.17 -32.68 1.95 Allowed 'General case' 0 N--CA 1.517 2.878 0 O-C-N 121.361 -0.837 . . . . 0.0 111.7 -179.779 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -62.14 -49.82 74.34 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 120.978 -1.076 . . . . 0.0 109.494 179.685 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 31.3 tp -66.54 -46.44 76.1 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.14 -1.024 . . . . 0.0 108.688 179.052 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.429 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 18.9 t80 -60.65 -37.26 80.94 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.3 -0.875 . . . . 0.0 109.535 179.143 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -72.78 -42.76 63.62 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.06 -1.025 . . . . 0.0 108.936 178.986 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.431 ' CE3' ' HB2' ' A' ' 12' ' ' ALA . 79.8 t90 -58.48 -36.43 73.72 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.312 -0.867 . . . . 0.0 109.757 179.094 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.476 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 30.7 mt -69.28 -47.45 64.56 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.079 -1.013 . . . . 0.0 109.037 179.45 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.428 HG21 HD13 ' A' ' 82' ' ' ILE . 34.2 mm -57.68 -32.91 43.67 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.588 0 O-C-N 121.18 -0.95 . . . . 0.0 110.151 179.231 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.33 -22.33 28.54 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 120.951 -1.093 . . . . 0.0 111.747 -179.886 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.419 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 10.5 mm-40 -100.35 20.29 15.08 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 120.752 -1.217 . . . . 0.0 112.046 179.956 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 71.3 tttt 72.7 83.06 0.13 Allowed 'General case' 0 N--CA 1.51 2.536 0 O-C-N 120.974 -1.079 . . . . 0.0 111.29 179.393 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.476 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 28.0 m-85 -139.32 -63.69 0.51 Allowed 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.509 -0.745 . . . . 0.0 110.117 -179.385 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -114.68 -171.77 1.99 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.395 -0.815 . . . . 0.0 110.147 179.877 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.443 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 21.2 t0 -123.17 102.88 8.21 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.158 -0.964 . . . . 0.0 110.263 -179.839 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.11 -40.41 74.92 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.159 -0.963 . . . . 0.0 109.892 179.753 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 20.7 tp -62.52 -46.6 87.67 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.156 -0.965 . . . . 0.0 109.611 179.71 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.436 HD21 ' NE2' ' A' ' 57' ' ' HIS . 65.9 tp -65.81 -44.88 84.33 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.261 -0.975 . . . . 0.0 108.947 179.216 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.431 HD13 HG21 ' A' ' 92' ' ' ILE . 54.1 mt -58.28 -36.5 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.508 0 O-C-N 121.149 -0.969 . . . . 0.0 108.74 178.654 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.65 -40.21 96.29 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.086 -1.009 . . . . 0.0 109.269 178.733 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.427 ' HD2' ' CZ ' ' A' ' 100' ' ' TYR . 5.2 mmtm -59.15 -47.97 83.34 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.085 -1.009 . . . . 0.0 109.393 179.295 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.411 ' CH2' HD21 ' A' ' 91' ' ' LEU . 5.9 m0 -59.13 -33.19 70.59 Favored 'General case' 0 N--CA 1.508 2.466 0 C-N-CA 119.542 -0.863 . . . . 0.0 110.301 179.591 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.36 -30.68 30.17 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.053 -1.03 . . . . 0.0 110.851 179.547 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.1 mmtt -53.69 -176.95 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.738 0 O-C-N 120.959 -1.088 . . . . 0.0 110.674 -179.972 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -103.36 134.71 46.28 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.126 -0.984 . . . . 0.0 109.699 179.207 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 95.77 11.19 55.64 Favored Glycine 0 N--CA 1.493 2.475 0 C-N-CA 120.172 -1.013 . . . . 0.0 111.094 -179.465 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.427 ' CZ ' ' HD2' ' A' ' 94' ' ' LYS . 47.8 m-85 -117.82 71.22 0.81 Allowed 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 119.405 1.602 . . . . 0.0 109.876 179.738 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -95.21 -36.16 11.56 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.129 -0.982 . . . . 0.0 110.666 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.65 72.88 1.09 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.025 -1.047 . . . . 0.0 110.736 -179.577 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -122.24 154.73 37.13 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.032 -1.043 . . . . 0.0 109.945 179.449 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.435 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.7 p -116.11 -31.45 5.68 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -179.15 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.538 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.6 m -141.71 -167.87 2.53 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 120.119 -1.613 . . . . 0.0 109.961 179.257 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 20.1 mt -95.92 -38.99 10.02 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.12 -0.987 . . . . 0.0 109.929 179.139 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -101.86 28.48 5.66 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 120.969 -1.082 . . . . 0.0 109.999 178.055 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.538 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.297 1.8 t -126.96 15.02 7.4 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.086 -1.009 . . . . 0.0 109.351 -179.631 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.405 ' CG2' ' O ' ' A' ' 108' ' ' CYS . 1.0 OUTLIER -159.48 37.54 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.375 0 O-C-N 120.832 -1.167 . . . . 0.0 111.018 -178.71 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -130.05 142.42 50.62 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.643 -1.285 . . . . 0.0 111.652 -178.987 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.436 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 18.0 ptpt -137.54 -172.26 3.18 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.198 -0.939 . . . . 0.0 110.081 179.811 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -147.97 -58.88 0.25 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.172 -0.955 . . . . 0.0 110.442 179.975 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -141.61 -162.84 1.45 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.203 -0.936 . . . . 0.0 109.918 -179.83 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 12.9 p -84.11 -38.05 21.23 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.044 -1.035 . . . . 0.0 110.14 179.79 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -111.37 155.72 22.68 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.181 -0.95 . . . . 0.0 110.037 179.789 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 53.22 49.65 19.43 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.17 -0.956 . . . . 0.0 110.684 -179.89 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -107.97 177.56 21.1 Favored Glycine 0 N--CA 1.493 2.479 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 -179.964 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 19.3 m -145.58 80.48 1.59 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.193 -1.181 . . . . 0.0 110.475 -179.961 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.436 ' OG1' ' HA ' ' A' ' 111' ' ' LYS . 2.4 m -130.11 170.03 14.55 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.187 -0.946 . . . . 0.0 110.042 179.912 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 49.5 t -100.67 155.09 18.08 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.2 -0.937 . . . . 0.0 109.526 179.262 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.446 HG22 HD11 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -71.4 -37.07 63.47 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.37 0 O-C-N 121.102 -0.999 . . . . 0.0 110.877 -179.444 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.489 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 11.2 p -53.57 -33.36 54.52 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 120.89 -1.131 . . . . 0.0 111.22 -178.824 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.61 -34.4 74.19 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.051 -1.031 . . . . 0.0 109.539 178.35 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 47.2 t -80.64 125.34 80.78 Favored Pre-proline 0 N--CA 1.504 2.271 0 O-C-N 121.131 -0.98 . . . . 0.0 109.824 179.629 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -65.41 175.13 4.42 Favored 'Trans proline' 0 N--CA 1.489 1.229 0 O-C-N 123.181 1.095 . . . . 0.0 110.803 179.516 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.12 -36.39 61.64 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.275 -0.891 . . . . 0.0 110.791 -179.721 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.56 -40.69 79.5 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 120.992 -1.067 . . . . 0.0 110.16 -179.657 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -70.07 -41.35 74.24 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.222 179.233 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.9 mt -65.7 -38.78 90.16 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.579 179.148 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -61.23 -39.35 89.95 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.175 -0.953 . . . . 0.0 109.838 179.645 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -59.75 -38.57 82.11 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.131 -0.981 . . . . 0.0 110.143 179.825 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -60.8 -44.31 97.03 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.127 -0.983 . . . . 0.0 109.917 179.996 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.47 -44.42 97.13 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.168 -0.957 . . . . 0.0 109.833 179.854 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.93 -34.27 71.54 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.258 -0.901 . . . . 0.0 110.288 179.663 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 24.4 mttt -75.9 -31.96 59.42 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.045 -1.035 . . . . 0.0 110.934 179.997 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.14 23.77 8.7 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 120.926 -1.108 . . . . 0.0 111.681 -179.934 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.59 46.62 53.36 Favored Glycine 0 N--CA 1.5 2.945 0 O-C-N 120.663 -1.273 . . . . 0.0 110.722 179.257 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.9 t -147.61 -164.92 2.12 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.092 -1.24 . . . . 0.0 110.371 179.842 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.6 mp0 -136.27 150.83 49.11 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.227 -0.921 . . . . 0.0 110.285 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 8.0 p -130.72 160.93 41.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 121.203 -0.935 . . . . 0.0 110.034 179.79 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 31.9 t -167.98 81.18 0.18 Allowed 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.126 -0.984 . . . . 0.0 111.233 -179.964 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.489 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 42.7 t80 -93.86 161.39 14.33 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.197 -0.94 . . . . 0.0 110.099 179.761 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 4.5 m80 -139.47 -60.55 0.56 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.605 -0.684 . . . . 0.0 109.175 179.065 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -132.77 152.21 51.82 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.44 -0.787 . . . . 0.0 109.198 178.967 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 25.7 p -97.08 156.56 16.32 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.13 -0.981 . . . . 0.0 110.803 -179.84 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 21.3 m -76.48 -24.4 15.88 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 O-C-N 121.315 -0.866 . . . . 0.0 111.859 -179.384 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -49.83 -53.69 23.9 Favored 'General case' 0 N--CA 1.515 2.822 0 O-C-N 120.728 -1.232 . . . . 0.0 110.42 -179.733 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 25.2 p -133.88 -163.05 1.31 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.308 -0.87 . . . . 0.0 110.387 179.851 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . 0.421 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.19 63.46 0.63 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 108.209 -1.956 . . . . 0.0 108.209 178.549 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 38.4 t -104.49 144.77 31.22 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.301 -1.117 . . . . 0.0 110.068 -179.175 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 19.0 mtt85 -101.59 44.63 1.0 Allowed 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.398 -0.813 . . . . 0.0 109.509 179.275 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 76.61 95.93 0.18 Allowed Glycine 0 N--CA 1.488 2.123 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 -179.823 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.3 p -109.02 126.26 52.94 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.093 -1.239 . . . . 0.0 110.435 179.842 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -148.68 150.37 33.09 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.16 -0.962 . . . . 0.0 110.27 -179.543 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -110.97 -52.01 2.82 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.27 -0.894 . . . . 0.0 110.665 -179.747 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 15.5 m -52.74 -39.6 62.3 Favored 'General case' 0 N--CA 1.513 2.694 0 O-C-N 120.972 -1.08 . . . . 0.0 110.722 -179.655 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 N--CA 1.496 1.866 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.492 179.845 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -110.05 156.31 15.65 Favored Glycine 0 N--CA 1.493 2.456 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 179.956 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -126.43 149.31 67.18 Favored Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.123 -1.221 . . . . 0.0 110.221 -179.969 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.64 141.38 34.23 Favored 'Trans proline' 0 C--N 1.316 -1.141 0 O-C-N 123.48 1.253 . . . . 0.0 110.387 179.999 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -116.89 101.67 8.73 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.241 -0.912 . . . . 0.0 110.196 -179.956 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.2 tp -143.11 64.36 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.175 -0.953 . . . . 0.0 110.14 179.952 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -143.7 65.48 1.31 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.183 -0.948 . . . . 0.0 110.262 -179.915 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 15.6 m -127.87 106.97 9.47 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.142 -0.974 . . . . 0.0 110.207 179.95 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 39.3 mtm-85 -130.67 53.05 1.99 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.138 -0.976 . . . . 0.0 110.231 179.995 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -116.52 73.31 0.85 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.136 -0.978 . . . . 0.0 110.21 179.89 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.91 -58.09 1.84 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.103 -0.998 . . . . 0.0 110.19 179.996 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.414 ' O ' ' CD1' ' A' ' 80' ' ' TRP . 0.2 OUTLIER -121.19 91.77 48.23 Favored Pre-proline 0 N--CA 1.492 1.671 0 O-C-N 121.183 -0.948 . . . . 0.0 110.233 -179.989 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -75.43 160.25 38.95 Favored 'Trans proline' 0 C--N 1.317 -1.094 0 O-C-N 123.379 1.199 . . . . 0.0 110.65 179.982 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.431 ' HB1' ' CZ2' ' A' ' 80' ' ' TRP . . . -79.86 138.4 53.79 Favored Pre-proline 0 N--CA 1.507 2.424 0 C-N-CA 119.655 -0.818 . . . . 0.0 109.414 179.395 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -71.8 166.84 28.29 Favored 'Trans proline' 0 C--N 1.317 -1.083 0 O-C-N 123.174 1.091 . . . . 0.0 110.696 -179.617 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -47.53 -32.61 5.48 Favored 'General case' 0 N--CA 1.516 2.838 0 O-C-N 121.549 -0.719 . . . . 0.0 111.404 -179.814 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.07 -32.31 42.35 Favored Glycine 0 N--CA 1.498 2.822 0 O-C-N 121.047 -1.033 . . . . 0.0 110.571 179.636 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -52.01 -33.2 37.3 Favored 'General case' 0 N--CA 1.514 2.741 0 O-C-N 120.935 -1.332 . . . . 0.0 110.44 179.758 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -53.55 -34.99 60.26 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.108 -0.995 . . . . 0.0 110.208 179.457 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.13 -39.77 83.36 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.264 -0.897 . . . . 0.0 110.034 179.574 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.1 pt -113.51 34.61 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.21 -0.931 . . . . 0.0 110.497 179.658 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.426 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 7.4 tmtt? -85.02 -43.31 0.67 Allowed Pre-proline 0 N--CA 1.51 2.539 0 O-C-N 121.07 -1.019 . . . . 0.0 113.441 -178.993 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.426 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.4 Cg_endo -75.73 -36.74 1.99 Allowed 'Trans proline' 0 N--CA 1.486 1.074 0 O-C-N 122.591 0.785 . . . . 0.0 111.699 -178.134 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 89.4 m -60.61 -42.83 97.59 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 120.942 -1.099 . . . . 0.0 109.934 -179.737 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 84.8 mt -65.35 -39.66 92.63 Favored 'General case' 0 N--CA 1.507 2.401 0 C-N-CA 119.477 -0.889 . . . . 0.0 109.554 179.51 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -58.39 -35.85 72.65 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.138 -0.976 . . . . 0.0 110.127 179.355 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -56.63 -36.0 68.97 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.058 -1.026 . . . . 0.0 110.368 179.647 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.43 ' CE2' HD22 ' A' ' 55' ' ' LEU . 22.2 m-85 -57.72 -38.78 75.89 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.04 -1.037 . . . . 0.0 110.479 -179.965 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -63.07 -23.35 67.4 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.214 -0.929 . . . . 0.0 111.82 -179.483 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 2.6 mp -81.21 -33.59 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.412 0 O-C-N 120.759 -1.213 . . . . 0.0 109.827 179.659 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -82.37 -36.31 26.92 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 120.997 -1.064 . . . . 0.0 109.28 178.557 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.29 -31.88 62.67 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.118 -0.989 . . . . 0.0 110.102 178.843 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -68.75 -35.73 77.47 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 120.842 -1.161 . . . . 0.0 110.01 179.479 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -65.87 -41.8 91.14 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.012 -1.055 . . . . 0.0 109.428 179.583 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.418 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -67.37 -41.94 84.22 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.215 -0.928 . . . . 0.0 109.223 179.142 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.0 mm100 -58.72 -34.39 71.29 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.352 -0.843 . . . . 0.0 110.365 179.812 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.2 mtmm -92.91 -38.88 11.47 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.029 -1.045 . . . . 0.0 110.372 179.887 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.6 -39.43 84.17 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.204 -0.935 . . . . 0.0 110.011 179.847 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.5 ttpt -57.88 -38.59 76.06 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.201 -0.937 . . . . 0.0 110.284 -179.997 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.7 m -111.53 47.83 1.0 Allowed 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.153 -0.967 . . . . 0.0 110.128 -179.978 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.1 p -96.7 95.64 8.06 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.224 -0.923 . . . . 0.0 109.15 179.147 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.6 ttpt 53.33 29.31 8.46 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.018 -1.051 . . . . 0.0 110.826 -179.002 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 34.5 tp 50.28 87.05 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.868 -1.145 . . . . 0.0 110.985 179.879 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -114.24 -163.71 0.88 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.309 -0.869 . . . . 0.0 109.983 179.956 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -102.6 177.6 4.81 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.054 -1.029 . . . . 0.0 110.0 179.822 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.1 mttp 52.94 50.87 17.03 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 120.977 -1.077 . . . . 0.0 110.607 -179.75 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -98.38 -40.01 8.51 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.221 -0.924 . . . . 0.0 110.747 -179.857 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -58.71 -39.36 80.6 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.181 -0.949 . . . . 0.0 110.132 -179.889 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -60.39 -39.67 88.12 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.15 -0.969 . . . . 0.0 110.086 179.898 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 39.3 tp60 -60.85 -42.23 97.41 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.098 -1.001 . . . . 0.0 110.02 -179.948 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.4 mt -60.08 -38.1 81.9 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.162 -0.961 . . . . 0.0 110.436 179.988 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.443 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 52.6 m0 -57.05 -40.47 76.88 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.094 -1.003 . . . . 0.0 109.574 179.794 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -60.88 -35.47 76.7 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.321 -0.862 . . . . 0.0 109.799 179.007 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.418 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 73.8 mt -65.23 -51.45 65.08 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 121.109 -0.994 . . . . 0.0 109.394 179.585 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.422 ' HG3' ' N ' ' A' ' 54' ' ' GLN . 0.0 OUTLIER -64.8 -30.78 71.79 Favored 'General case' 0 N--CA 1.501 2.123 0 C-N-CA 118.65 -1.22 . . . . 0.0 109.692 179.307 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.422 ' N ' ' HG3' ' A' ' 53' ' ' MET . 5.0 mm100 -64.95 -36.79 85.52 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.089 -1.007 . . . . 0.0 109.358 178.733 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.43 HD22 ' CE2' ' A' ' 26' ' ' PHE . 13.9 mt -52.78 -33.71 50.0 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.081 -1.012 . . . . 0.0 109.928 179.217 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.434 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 19.6 t60 -56.71 -38.02 71.73 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.086 -1.009 . . . . 0.0 109.771 179.235 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.439 ' NE2' HD21 ' A' ' 91' ' ' LEU . 5.9 m170 -60.0 -49.64 76.88 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.027 -1.046 . . . . 0.0 109.048 178.999 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 26.2 tp60 -59.69 -38.17 80.82 Favored 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 119.634 -0.826 . . . . 0.0 109.427 179.134 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.415 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.86 -48.83 75.16 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.233 -0.987 . . . . 0.0 108.879 179.03 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 92.1 p -64.58 -42.14 95.81 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.148 -0.97 . . . . 0.0 108.763 178.834 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 46.8 ttt85 -62.54 -39.83 94.86 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.185 -0.947 . . . . 0.0 109.303 178.803 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 44.2 t80 -61.96 -49.55 75.66 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.261 -0.9 . . . . 0.0 109.386 179.494 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.438 HD13 HG23 ' A' ' 63' ' ' ILE . 90.2 mt -71.76 -39.16 68.14 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.36 0 O-C-N 121.26 -0.9 . . . . 0.0 109.022 179.153 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.431 ' CE1' HG22 ' A' ' 92' ' ' ILE . 40.3 t80 -62.77 -41.17 99.11 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.136 -0.977 . . . . 0.0 109.005 178.901 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 51.8 m -67.1 -38.19 85.25 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.202 -0.936 . . . . 0.0 110.793 -179.825 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.4 ' HA ' ' CB ' ' A' ' 70' ' ' ARG . 3.7 pp -83.17 -36.35 24.78 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 120.949 -1.094 . . . . 0.0 112.489 -178.875 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.437 ' CD1' ' HB2' ' A' ' 78' ' ' TYR . 66.1 t80 -86.55 -35.4 19.53 Favored 'General case' 0 N--CA 1.512 2.652 0 O-C-N 120.54 -1.35 . . . . 0.0 111.907 -179.299 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -98.35 -3.39 37.16 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 120.873 -1.142 . . . . 0.0 113.077 -178.649 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -139.25 -60.27 0.57 Allowed 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.383 -1.448 . . . . 0.0 111.04 179.698 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.4 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 6.9 tpt85 -59.66 -29.59 68.16 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.081 -1.012 . . . . 0.0 110.754 -179.749 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.8 tttt 59.68 43.44 15.58 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.866 -1.146 . . . . 0.0 109.947 -179.609 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -117.99 37.34 4.0 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.425 -0.797 . . . . 0.0 109.925 179.401 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.476 HG23 HD12 ' A' ' 73' ' ' ILE . 14.2 tt -157.19 162.27 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.19 -0.944 . . . . 0.0 110.345 -179.88 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.5 t -110.7 149.46 30.45 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.184 -0.948 . . . . 0.0 109.788 179.356 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.0 ttmt -45.31 -33.11 2.28 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.273 -0.892 . . . . 0.0 111.587 -179.78 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -62.36 -49.31 76.06 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 120.928 -1.108 . . . . 0.0 109.479 179.379 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.18 -47.62 76.32 Favored 'General case' 0 N--CA 1.507 2.395 0 C-N-CA 119.149 -1.02 . . . . 0.0 108.6 178.917 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.437 ' HB2' ' CD1' ' A' ' 67' ' ' TYR . 18.1 t80 -60.21 -38.72 84.18 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 119.661 -0.815 . . . . 0.0 109.692 179.436 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -69.59 -42.05 74.97 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.065 -1.022 . . . . 0.0 108.825 178.766 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.431 ' CZ2' ' HB1' ' A' ' 12' ' ' ALA . 67.9 t90 -58.27 -38.88 77.83 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.243 -0.911 . . . . 0.0 109.595 179.116 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.45 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 9.5 mt -65.65 -52.11 54.28 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.234 -0.916 . . . . 0.0 109.282 179.425 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.438 HG21 HD13 ' A' ' 82' ' ' ILE . 35.6 mm -59.12 -32.73 48.58 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.521 0 O-C-N 121.23 -0.919 . . . . 0.0 110.098 179.466 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 20.0 tttp -85.84 -14.3 45.43 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 120.938 -1.101 . . . . 0.0 112.032 -179.913 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.42 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 22.3 mm-40 -108.53 21.39 17.35 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 120.554 -1.341 . . . . 0.0 112.076 -179.97 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 73.25 78.4 0.14 Allowed 'General case' 0 N--CA 1.511 2.576 0 O-C-N 120.981 -1.074 . . . . 0.0 111.418 179.278 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.45 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 25.9 m-85 -134.04 -65.0 0.68 Allowed 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.493 -0.755 . . . . 0.0 109.808 -179.869 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -121.16 -175.61 3.1 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.304 -0.873 . . . . 0.0 109.937 179.68 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.434 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 7.9 t0 -117.3 122.08 42.92 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.145 -0.972 . . . . 0.0 110.134 179.906 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 12.3 mtmt -74.71 -40.57 61.25 Favored 'General case' 0 N--CA 1.506 2.37 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.725 179.742 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.16 -42.96 99.76 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.157 -0.964 . . . . 0.0 109.341 179.514 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.439 HD21 ' NE2' ' A' ' 57' ' ' HIS . 22.1 tp -63.73 -48.4 77.2 Favored 'General case' 0 N--CA 1.507 2.381 0 C-N-CA 119.289 -0.964 . . . . 0.0 109.14 179.737 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.461 HG21 HD12 ' A' ' 92' ' ' ILE . 49.0 mt -60.95 -37.14 76.37 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.447 0 O-C-N 121.081 -1.012 . . . . 0.0 108.336 178.198 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.79 -39.55 76.53 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.125 -0.984 . . . . 0.0 108.694 177.907 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.437 ' CD ' ' CZ ' ' A' ' 100' ' ' TYR . 5.7 mmtm -58.72 -45.32 89.86 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.175 -0.953 . . . . 0.0 109.295 178.933 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.0 m0 -64.12 -35.37 80.55 Favored 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 119.485 -0.886 . . . . 0.0 110.079 179.356 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.23 -29.66 34.41 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.064 -1.023 . . . . 0.0 110.71 179.369 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.8 mmtt -53.72 -176.85 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.681 0 O-C-N 121.0 -1.062 . . . . 0.0 110.607 179.802 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 36.8 m -103.66 131.83 50.46 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.137 -0.977 . . . . 0.0 109.687 179.175 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.27 9.55 50.82 Favored Glycine 0 N--CA 1.493 2.47 0 C-N-CA 120.242 -0.98 . . . . 0.0 111.053 -179.458 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.437 ' CZ ' ' CD ' ' A' ' 94' ' ' LYS . 51.4 m-85 -118.22 71.13 0.82 Allowed 'General case' 0 N--CA 1.493 1.724 0 CA-C-N 119.459 1.629 . . . . 0.0 109.921 179.697 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -95.17 -32.41 13.07 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.087 -1.008 . . . . 0.0 110.872 179.979 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -126.55 68.42 1.23 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.923 -1.11 . . . . 0.0 110.883 -179.516 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.53 155.12 29.22 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.907 -1.121 . . . . 0.0 109.85 179.225 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.432 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.8 p -115.96 -34.8 4.63 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.156 -0.965 . . . . 0.0 113.473 -178.852 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.562 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.0 m -139.59 -167.6 2.3 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 120.18 -1.575 . . . . 0.0 110.088 179.501 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 14.8 mt -96.65 -39.51 9.46 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.204 -0.935 . . . . 0.0 110.048 179.338 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -100.86 28.03 5.53 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 120.967 -1.083 . . . . 0.0 109.98 177.903 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.562 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.301 1.8 t -125.68 14.81 8.12 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.107 -0.995 . . . . 0.0 109.017 -179.707 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.1 pt -158.11 36.06 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.263 0 O-C-N 120.832 -1.168 . . . . 0.0 110.955 -178.492 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 60.7 tp60 -130.81 151.47 51.21 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 120.707 -1.246 . . . . 0.0 111.45 -178.671 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.441 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 0.0 OUTLIER -133.93 156.61 47.81 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.235 -0.915 . . . . 0.0 110.377 179.634 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -131.09 162.31 30.14 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.265 -0.897 . . . . 0.0 110.328 -179.849 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -122.08 39.69 3.83 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.284 -0.885 . . . . 0.0 110.122 179.711 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -149.55 41.24 0.86 Allowed 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.208 -0.932 . . . . 0.0 110.403 -179.912 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 10.6 m120 53.8 178.02 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.151 -0.968 . . . . 0.0 110.725 -179.956 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 57.3 m-80 52.55 75.67 0.22 Allowed 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.016 -1.052 . . . . 0.0 110.821 -179.962 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 133.91 137.22 3.79 Favored Glycine 0 N--CA 1.493 2.451 0 N-CA-C 109.584 -1.407 . . . . 0.0 109.584 179.968 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 44.1 m -143.57 -173.85 4.07 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.244 -1.15 . . . . 0.0 110.316 179.958 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.441 ' OG1' ' HA ' ' A' ' 111' ' ' LYS . 6.6 m -115.93 166.12 12.33 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.22 -0.925 . . . . 0.0 110.114 -179.982 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 37.5 t -86.19 154.7 21.13 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.273 -0.892 . . . . 0.0 109.73 179.482 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.465 ' CG2' ' CE1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -76.68 -29.85 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.383 0 O-C-N 121.139 -0.976 . . . . 0.0 111.593 -179.201 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.458 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.7 p -58.01 -35.38 71.17 Favored 'General case' 0 N--CA 1.511 2.607 0 O-C-N 120.655 -1.278 . . . . 0.0 110.659 -179.163 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 1.2 ttt-85 -55.84 -32.92 64.04 Favored 'General case' 0 N--CA 1.513 2.686 0 O-C-N 121.023 -1.048 . . . . 0.0 110.071 178.904 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 60.8 t -79.44 124.6 83.93 Favored Pre-proline 0 N--CA 1.504 2.243 0 O-C-N 121.119 -0.988 . . . . 0.0 109.936 179.729 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.21 178.76 2.3 Favored 'Trans proline' 0 N--CA 1.488 1.203 0 O-C-N 123.11 1.058 . . . . 0.0 110.81 179.71 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -75.21 -36.93 61.33 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.255 -0.903 . . . . 0.0 110.574 179.979 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.17 -40.54 77.52 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 120.981 -1.074 . . . . 0.0 110.066 -179.761 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -69.48 -42.32 74.98 Favored 'General case' 0 N--CA 1.505 2.301 0 C-N-CA 119.402 -0.919 . . . . 0.0 109.075 179.247 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.9 mt -64.41 -38.79 92.25 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.52 -0.872 . . . . 0.0 109.476 179.184 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -60.13 -39.39 86.12 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.16 -0.962 . . . . 0.0 109.929 179.728 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -58.89 -38.55 79.11 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.187 -0.946 . . . . 0.0 110.263 179.903 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -63.48 -39.76 95.3 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.144 -0.973 . . . . 0.0 109.993 179.783 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.84 -41.95 97.71 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 121.211 -0.931 . . . . 0.0 109.82 179.891 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -60.21 -38.1 82.33 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.158 -0.964 . . . . 0.0 109.823 179.515 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -58.0 -35.37 71.13 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.132 -0.98 . . . . 0.0 110.555 179.859 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -105.08 16.63 25.51 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 120.963 -1.085 . . . . 0.0 112.061 -179.993 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 58.01 44.44 94.59 Favored Glycine 0 N--CA 1.497 2.731 0 O-C-N 120.635 -1.291 . . . . 0.0 110.174 179.448 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 7.4 t -137.83 -162.7 1.33 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.136 -1.214 . . . . 0.0 110.028 179.957 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -136.97 147.11 46.12 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.104 -0.997 . . . . 0.0 110.29 179.963 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.5 p -133.67 161.62 40.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.165 -0.959 . . . . 0.0 110.288 -179.858 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 45.6 t -164.06 111.16 1.1 Allowed 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.302 -0.874 . . . . 0.0 110.926 179.948 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.465 ' CE1' ' CG2' ' A' ' 121' ' ' ILE . 81.7 t80 -104.83 137.24 42.92 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.226 -0.921 . . . . 0.0 110.869 -179.783 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 11.3 m-70 -111.93 -56.76 2.35 Favored 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 178.122 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -151.71 156.03 39.5 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.5 -0.75 . . . . 0.0 109.574 179.115 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . 0.424 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 27.3 p -95.0 155.24 16.81 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.07 -1.019 . . . . 0.0 111.036 -179.553 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.9 p -72.38 -24.09 21.8 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.461 0 O-C-N 121.391 -0.818 . . . . 0.0 111.696 -179.528 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -51.79 -53.08 43.9 Favored 'General case' 0 N--CA 1.513 2.714 0 O-C-N 120.749 -1.219 . . . . 0.0 110.182 -179.918 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.443 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 28.3 p -135.41 -164.94 1.61 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.208 -0.932 . . . . 0.0 111.026 -179.997 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.39 59.42 0.71 Allowed Glycine 0 N--CA 1.491 2.315 0 N-CA-C 107.9 -2.08 . . . . 0.0 107.9 178.539 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 21.0 t -100.59 138.34 37.78 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.401 -1.058 . . . . 0.0 109.809 -179.228 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -96.44 51.58 1.19 Allowed 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.233 -0.917 . . . . 0.0 109.623 179.108 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 72.0 99.37 0.06 OUTLIER Glycine 0 N--CA 1.487 2.071 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 179.761 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 p -110.73 127.16 55.23 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.261 -1.14 . . . . 0.0 110.099 179.38 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -152.03 148.9 28.25 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.061 -1.024 . . . . 0.0 110.479 -179.391 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -112.77 -57.84 2.23 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.135 -0.978 . . . . 0.0 110.261 -179.891 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 7.8 t -165.87 43.21 0.07 Allowed 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.181 -0.949 . . . . 0.0 110.927 -179.876 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 . . . . . 0 N--CA 1.494 1.734 0 CA-C-O 118.001 -1.0 . . . . 0.0 110.21 179.983 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.234 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 75.97 78.19 0.69 Allowed Glycine 0 N--CA 1.493 2.453 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.931 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 70.9 p -135.56 55.59 13.2 Favored Pre-proline 0 N--CA 1.494 1.746 0 O-C-N 121.15 -1.206 . . . . 0.0 110.176 179.987 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.37 143.98 40.13 Favored 'Trans proline' 0 C--N 1.317 -1.115 0 O-C-N 123.323 1.17 . . . . 0.0 110.377 179.973 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.8 ptt85 -144.38 50.15 1.31 Allowed 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.237 -0.914 . . . . 0.0 110.259 -179.952 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.407 HD11 HG23 ' A' ' 4' ' ' ILE . 82.4 mt -117.58 -58.1 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.277 -0.89 . . . . 0.0 109.945 179.968 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -119.57 154.55 33.73 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.285 -0.884 . . . . 0.0 110.25 179.998 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.3 m -129.45 67.35 1.44 Allowed 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.229 -0.919 . . . . 0.0 110.193 -179.951 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.2 ttt-85 -135.89 128.45 30.62 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.181 -0.949 . . . . 0.0 110.17 179.968 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -121.66 173.98 7.1 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.178 -0.951 . . . . 0.0 110.255 -179.98 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.5 p -142.64 -164.71 1.89 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.17 -0.956 . . . . 0.0 110.263 -179.964 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.6 tmtt? 53.42 68.6 2.79 Favored Pre-proline 0 N--CA 1.501 2.108 0 O-C-N 120.972 -1.08 . . . . 0.0 110.707 -179.952 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.48 157.88 52.11 Favored 'Trans proline' 0 C--N 1.316 -1.154 0 O-C-N 123.389 1.205 . . . . 0.0 110.622 179.998 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.444 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -63.59 148.98 93.26 Favored Pre-proline 0 N--CA 1.509 2.5 0 C-N-CA 119.622 -0.831 . . . . 0.0 109.595 179.776 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -70.91 161.79 44.89 Favored 'Trans proline' 0 C--N 1.316 -1.175 0 O-C-N 123.374 1.197 . . . . 0.0 110.63 -179.928 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -48.51 -31.93 7.16 Favored 'General case' 0 N--CA 1.515 2.799 0 O-C-N 121.366 -0.833 . . . . 0.0 111.441 -179.761 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.21 -34.13 46.92 Favored Glycine 0 N--CA 1.499 2.845 0 O-C-N 120.95 -1.094 . . . . 0.0 110.588 179.939 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -54.57 -31.03 55.96 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 120.913 -1.346 . . . . 0.0 110.879 179.818 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -54.09 -37.61 64.45 Favored 'General case' 0 N--CA 1.512 2.664 0 O-C-N 120.984 -1.073 . . . . 0.0 110.169 179.756 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.2 mptt -59.11 -36.4 75.12 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.154 -0.966 . . . . 0.0 110.224 179.492 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.427 HG22 ' OH ' ' A' ' 62' ' ' TYR . 2.7 pt -116.9 36.04 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.973 0 O-C-N 121.089 -1.007 . . . . 0.0 110.527 179.705 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.434 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.6 OUTLIER -83.97 -42.71 0.77 Allowed Pre-proline 0 N--CA 1.509 2.499 0 O-C-N 121.095 -1.003 . . . . 0.0 113.264 -179.092 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.434 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.7 Cg_endo -75.95 -38.57 1.17 Allowed 'Trans proline' 0 N--CA 1.487 1.126 0 O-C-N 122.596 0.787 . . . . 0.0 111.631 -178.292 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 68.2 m -60.27 -43.86 95.81 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 120.991 -1.068 . . . . 0.0 109.99 -179.768 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.421 HD22 ' CE2' ' A' ' 86' ' ' TYR . 2.2 mt -62.88 -37.92 88.8 Favored 'General case' 0 N--CA 1.507 2.387 0 C-N-CA 119.331 -0.947 . . . . 0.0 109.689 179.435 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 4.1 m -57.5 -37.51 73.1 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.101 -0.999 . . . . 0.0 110.24 179.627 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -58.01 -38.64 76.55 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.075 -1.015 . . . . 0.0 109.997 179.699 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.434 ' CD2' ' HD2' ' A' ' 59' ' ' ARG . 13.9 m-85 -57.76 -39.32 77.14 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.178 -0.951 . . . . 0.0 110.26 179.821 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.64 -22.53 65.35 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.199 -0.938 . . . . 0.0 111.668 -179.554 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 2.7 mp -80.22 -34.12 14.69 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.469 0 O-C-N 120.842 -1.161 . . . . 0.0 109.978 179.931 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 40.4 tt0 -81.29 -34.11 32.19 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.908 -1.12 . . . . 0.0 109.514 178.786 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.64 -32.7 58.17 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.062 -1.024 . . . . 0.0 109.841 178.769 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -68.76 -34.94 76.44 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 120.969 -1.082 . . . . 0.0 109.878 179.307 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.74 -41.07 79.47 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.047 -1.033 . . . . 0.0 109.647 179.564 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.419 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -65.57 -40.98 93.37 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.181 -0.95 . . . . 0.0 109.499 179.342 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 -58.33 -34.64 70.84 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.212 -0.93 . . . . 0.0 110.507 -179.996 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.37 -39.17 10.16 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 120.939 -1.101 . . . . 0.0 110.678 -179.904 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -59.44 -40.1 85.7 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 121.128 -0.982 . . . . 0.0 110.139 -179.963 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -58.86 -40.59 84.75 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.068 -1.02 . . . . 0.0 110.085 -179.929 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 51.42 -171.48 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.046 -1.034 . . . . 0.0 110.943 179.774 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.3 m -118.09 -57.66 2.07 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.237 -0.914 . . . . 0.0 110.269 -179.898 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.3 mttt -120.02 78.73 1.37 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.182 -0.948 . . . . 0.0 110.224 -179.956 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.5 tt -116.2 -57.85 2.16 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.047 -1.033 . . . . 0.0 110.213 179.848 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -169.2 -66.75 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.114 -0.991 . . . . 0.0 111.044 179.902 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -168.6 -165.45 0.58 Allowed 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.105 -0.997 . . . . 0.0 110.99 -179.905 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.2 tttt 53.49 67.47 1.0 Allowed 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.041 -1.037 . . . . 0.0 110.805 179.909 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 67.1 m -111.97 -53.95 2.66 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.171 -0.955 . . . . 0.0 110.393 179.808 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -55.1 -36.87 66.15 Favored 'General case' 0 N--CA 1.512 2.652 0 O-C-N 121.19 -0.944 . . . . 0.0 110.069 179.628 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -58.98 -39.99 83.46 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.124 -0.985 . . . . 0.0 109.985 179.651 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.2 tp60 -61.49 -40.27 93.97 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.121 -0.987 . . . . 0.0 109.82 179.695 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 94.3 mt -66.51 -34.63 78.35 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.213 -0.929 . . . . 0.0 110.371 179.783 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.43 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 37.3 m0 -58.52 -36.83 74.45 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.037 -1.039 . . . . 0.0 109.449 179.703 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -66.66 -33.7 76.23 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.757 -1.214 . . . . 0.0 109.227 177.96 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.419 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 75.5 mt -70.33 -54.61 17.77 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 O-C-N 120.986 -1.071 . . . . 0.0 109.323 179.285 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.477 ' CE ' ' HB2' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -60.71 -32.64 71.87 Favored 'General case' 0 N--CA 1.508 2.465 0 C-N-CA 118.61 -1.236 . . . . 0.0 109.54 178.868 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.38 -39.59 87.82 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 120.875 -1.14 . . . . 0.0 109.398 179.022 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.429 HD21 ' CE2' ' A' ' 26' ' ' PHE . 21.2 mt -54.59 -34.31 61.77 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.097 -1.002 . . . . 0.0 110.012 179.242 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.432 ' CE1' ' HB2' ' A' ' 88' ' ' ASP . 82.2 t60 -56.46 -40.23 74.49 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 120.991 -1.068 . . . . 0.0 109.626 179.184 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.423 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 7.5 m170 -61.23 -49.1 78.49 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.206 -0.934 . . . . 0.0 108.991 178.966 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -62.72 -41.01 98.95 Favored 'General case' 0 N--CA 1.504 2.249 0 C-N-CA 119.417 -0.913 . . . . 0.0 108.87 178.747 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.434 ' HD2' ' CD2' ' A' ' 26' ' ' PHE . 2.5 mtp85 -61.18 -45.9 92.7 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.247 -0.908 . . . . 0.0 109.302 179.087 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 93.2 p -65.9 -40.02 91.13 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.231 -0.918 . . . . 0.0 109.194 179.226 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.4 ' O ' ' OG1' ' A' ' 65' ' ' THR . 24.0 ttt85 -65.17 -38.73 91.48 Favored 'General case' 0 N--CA 1.508 2.452 0 C-N-CA 119.212 -0.995 . . . . 0.0 109.453 179.082 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.427 ' OH ' HG22 ' A' ' 19' ' ' ILE . 43.0 t80 -61.21 -48.3 82.14 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.124 -0.985 . . . . 0.0 109.52 179.507 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.413 HG23 HD13 ' A' ' 63' ' ' ILE . 86.9 mt -76.77 -41.66 33.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.3 0 O-C-N 121.217 -0.927 . . . . 0.0 109.216 179.399 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.443 ' OH ' ' NH1' ' A' ' 96' ' ' ARG . 46.8 t80 -59.54 -31.14 69.13 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.253 -0.904 . . . . 0.0 109.831 178.71 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.4 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 59.7 m -80.67 -37.52 30.7 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 120.917 -1.115 . . . . 0.0 110.364 179.837 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.408 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -82.96 -32.44 27.1 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 120.942 -1.099 . . . . 0.0 112.512 -179.061 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.426 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 62.1 t80 -86.52 -35.31 19.64 Favored 'General case' 0 N--CA 1.512 2.654 0 O-C-N 120.696 -1.253 . . . . 0.0 111.916 -179.207 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -98.37 -23.83 15.44 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.851 -1.156 . . . . 0.0 112.8 -178.29 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.421 ' HE2' ' CD2' ' A' ' 64' ' ' TYR . 0.7 OUTLIER -114.8 -56.45 2.38 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.617 -1.302 . . . . 0.0 111.26 -179.311 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.6 ttt85 -67.67 -30.65 70.24 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.067 -1.02 . . . . 0.0 110.63 -179.906 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 tttm 59.08 44.72 15.67 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 120.829 -1.169 . . . . 0.0 110.164 -179.817 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -114.24 37.05 3.47 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.307 -0.871 . . . . 0.0 109.716 179.181 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.451 HG22 HD13 ' A' ' 73' ' ' ILE . 14.6 tt -157.83 162.65 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.253 -0.904 . . . . 0.0 110.14 -179.694 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -108.74 148.89 29.81 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.098 -1.001 . . . . 0.0 110.226 179.759 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.7 tttm -46.6 -32.26 3.36 Favored 'General case' 0 N--CA 1.516 2.864 0 O-C-N 121.392 -0.818 . . . . 0.0 111.495 -179.859 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.29 -51.76 66.38 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.869 -1.145 . . . . 0.0 109.253 179.478 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 44.8 tp -65.34 -44.16 88.6 Favored 'General case' 0 N--CA 1.505 2.292 0 C-N-CA 119.19 -1.004 . . . . 0.0 108.504 178.812 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.426 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 18.0 t80 -59.57 -40.61 87.91 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.397 -0.814 . . . . 0.0 109.36 178.979 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -72.68 -42.95 63.7 Favored 'General case' 0 N--CA 1.504 2.249 0 C-N-CA 119.369 -0.932 . . . . 0.0 108.687 178.603 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.444 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 85.9 t90 -56.86 -35.76 69.25 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.228 -0.92 . . . . 0.0 109.432 178.462 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.452 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 13.9 mt -66.89 -59.43 3.53 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.159 -0.963 . . . . 0.0 108.963 178.898 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.419 HD11 ' CE1' ' A' ' 78' ' ' TYR . 1.6 mt -56.83 -27.02 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.614 0 O-C-N 120.938 -1.101 . . . . 0.0 109.99 179.577 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 6.3 mmtm -82.53 -18.54 41.12 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.793 -1.192 . . . . 0.0 111.105 178.669 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.426 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 72.4 mm-40 -108.72 23.32 14.7 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.731 -1.23 . . . . 0.0 111.968 179.983 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.413 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 2.6 tptp 76.51 71.2 0.07 Allowed 'General case' 0 N--CA 1.514 2.76 0 O-C-N 121.198 -0.939 . . . . 0.0 111.827 179.326 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.452 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 26.4 m-85 -133.13 -62.43 0.8 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.45 -0.781 . . . . 0.0 109.202 179.354 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -131.09 162.38 29.99 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.495 -0.753 . . . . 0.0 109.738 179.736 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.432 ' HB2' ' CE1' ' A' ' 56' ' ' HIS . 9.8 t70 -115.12 112.93 23.31 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.109 -0.995 . . . . 0.0 110.093 179.7 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 11.2 mttt -58.07 -37.17 73.94 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.212 -0.93 . . . . 0.0 110.286 -179.975 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.2 tp -60.61 -37.12 80.37 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.122 -0.986 . . . . 0.0 110.385 -179.734 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.422 HD23 ' CD2' ' A' ' 57' ' ' HIS . 55.2 tp -71.42 -49.11 45.07 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.998 -1.064 . . . . 0.0 108.835 179.343 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.429 HG21 ' CE1' ' A' ' 64' ' ' TYR . 51.7 mt -62.02 -38.93 81.99 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.307 0 O-C-N 121.124 -0.985 . . . . 0.0 108.347 178.245 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.32 -37.74 83.8 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.179 -0.95 . . . . 0.0 109.157 178.333 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.2 mmtm -57.89 -42.42 84.58 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.062 -1.024 . . . . 0.0 109.754 179.469 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.9 m0 -67.01 -31.65 72.35 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.231 -0.918 . . . . 0.0 110.869 -179.778 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.443 ' NH1' ' OH ' ' A' ' 64' ' ' TYR . 0.0 OUTLIER -77.39 -32.62 54.96 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.926 -1.109 . . . . 0.0 110.426 178.89 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 15.6 mmtt -54.98 -176.57 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.677 0 O-C-N 120.935 -1.103 . . . . 0.0 110.367 179.575 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 68.1 m -106.56 139.71 40.58 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.238 -0.914 . . . . 0.0 109.658 179.37 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.99 -22.05 41.98 Favored Glycine 0 N--CA 1.494 2.507 0 C-N-CA 119.83 -1.176 . . . . 0.0 110.735 -179.365 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -92.35 58.17 3.16 Favored 'General case' 0 N--CA 1.504 2.248 0 CA-C-N 119.254 1.527 . . . . 0.0 110.193 179.909 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -78.39 -38.61 41.31 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.076 -1.015 . . . . 0.0 109.865 179.39 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -113.99 79.66 1.28 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.095 -1.003 . . . . 0.0 109.753 179.664 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 14.3 tp -115.9 137.1 52.41 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.217 -0.927 . . . . 0.0 109.991 -179.49 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.423 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.9 p -108.39 -38.76 5.63 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.262 -0.899 . . . . 0.0 112.025 179.81 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.595 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 5.4 m -139.29 -170.31 2.86 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 120.36 -1.463 . . . . 0.0 109.718 178.881 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 12.4 mt -97.88 -35.58 10.45 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 120.896 -1.128 . . . . 0.0 110.84 179.32 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 -102.49 33.69 3.06 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.819 -1.176 . . . . 0.0 109.264 177.819 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.595 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.313 1.7 t -128.48 16.42 6.52 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.186 -0.946 . . . . 0.0 108.988 -179.017 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.3 pt -157.91 35.94 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 120.68 -1.263 . . . . 0.0 111.114 -178.732 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -138.19 132.02 31.22 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 120.637 -1.29 . . . . 0.0 111.558 -178.743 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.435 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 31.7 ttmt -96.68 -48.22 5.59 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.146 -0.971 . . . . 0.0 110.437 179.614 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 53.7 -167.72 0.07 Allowed 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.033 -1.042 . . . . 0.0 110.619 -179.968 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -118.04 93.91 4.31 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.213 -0.93 . . . . 0.0 110.248 -179.897 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 5.8 p -147.13 -175.52 4.86 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.142 -0.974 . . . . 0.0 110.404 -179.971 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 15.2 p-10 -130.04 37.97 3.85 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.171 -0.956 . . . . 0.0 110.406 179.805 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -153.16 93.45 1.72 Allowed 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.134 -0.979 . . . . 0.0 110.424 179.886 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 63.26 103.9 0.01 OUTLIER Glycine 0 N--CA 1.494 2.524 0 N-CA-C 109.152 -1.579 . . . . 0.0 109.152 -179.573 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 44.3 m -116.67 125.69 52.1 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.166 -1.197 . . . . 0.0 110.523 -179.581 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.435 ' OG1' ' HA ' ' A' ' 111' ' ' LYS . 0.2 OUTLIER 55.28 173.95 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.24 -0.913 . . . . 0.0 110.938 179.76 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 46.0 t -113.71 156.53 23.61 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.509 -0.744 . . . . 0.0 109.251 179.466 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.46 ' CG2' ' CE1' ' A' ' 142' ' ' PHE . 15.4 tt -75.0 -29.88 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.338 0 C-N-CA 119.097 -1.041 . . . . 0.0 111.708 -179.517 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.511 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 12.3 p -55.14 -33.56 63.02 Favored 'General case' 0 N--CA 1.514 2.746 0 O-C-N 120.444 -1.41 . . . . 0.0 109.875 -179.902 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 7.5 tpt180 -59.49 -34.01 72.05 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.042 -1.036 . . . . 0.0 108.698 176.885 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.3 t -68.7 116.55 41.9 Favored Pre-proline 0 N--CA 1.507 2.389 0 O-C-N 121.147 -0.971 . . . . 0.0 109.801 179.271 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -66.11 179.48 1.89 Allowed 'Trans proline' 0 N--CA 1.488 1.189 0 O-C-N 123.015 1.008 . . . . 0.0 110.597 179.1 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.9 tpt180 -75.1 -40.26 60.08 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.259 -0.901 . . . . 0.0 110.154 179.979 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.96 -41.4 91.85 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.141 -0.975 . . . . 0.0 109.945 -179.929 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -63.72 -40.82 97.7 Favored 'General case' 0 N--CA 1.507 2.394 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.724 179.761 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.401 ' CD1' ' CB ' ' A' ' 142' ' ' PHE . 12.3 mt -62.19 -40.92 97.67 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.174 -0.954 . . . . 0.0 109.696 179.665 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -57.71 -37.52 73.67 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.132 -0.98 . . . . 0.0 110.219 179.853 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -58.21 -37.49 74.92 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.045 -1.034 . . . . 0.0 110.42 179.86 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -68.37 -40.08 81.55 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.204 -0.935 . . . . 0.0 109.848 179.798 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -68.09 -38.24 82.12 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.112 -0.993 . . . . 0.0 109.968 179.59 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 29.9 mtp85 -68.07 -32.03 72.07 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.107 -0.996 . . . . 0.0 110.586 179.59 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 4.3 mtmp? -79.62 -31.19 41.63 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 120.99 -1.069 . . . . 0.0 110.992 -179.934 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 2.6 mmtt -100.57 22.94 11.04 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 120.884 -1.135 . . . . 0.0 111.761 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.08 46.92 42.03 Favored Glycine 0 N--CA 1.501 2.969 0 O-C-N 120.745 -1.222 . . . . 0.0 110.998 179.201 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.7 t -146.46 -167.65 2.8 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.095 -1.239 . . . . 0.0 110.5 179.855 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -123.61 171.11 9.79 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.304 -0.872 . . . . 0.0 110.357 -179.913 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.1 p -157.99 161.0 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 O-C-N 121.359 -0.838 . . . . 0.0 110.672 -179.926 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 29.4 t -169.9 100.99 0.3 Allowed 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.137 -0.977 . . . . 0.0 111.074 179.859 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.511 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 87.8 t80 -97.85 156.72 16.46 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.231 -0.918 . . . . 0.0 110.203 179.643 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 20.3 m80 -136.23 -61.74 0.69 Allowed 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.782 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -145.84 147.67 32.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.563 -0.711 . . . . 0.0 109.373 178.896 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . 0.43 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 29.5 p -88.33 157.04 18.85 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.074 -1.016 . . . . 0.0 111.152 -179.344 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.2 p -74.91 -24.1 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.403 0 O-C-N 121.319 -0.863 . . . . 0.0 111.753 -179.488 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -52.73 -44.89 66.7 Favored 'General case' 0 N--CA 1.516 2.836 0 O-C-N 120.715 -1.241 . . . . 0.0 109.274 179.559 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.477 ' HB2' ' CE ' ' A' ' 53' ' ' MET . 29.4 p -142.66 -178.89 6.0 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 121.451 -0.78 . . . . 0.0 110.564 179.619 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . 0.413 ' CA ' ' CE3' ' A' ' 50' ' ' TRP . . . -92.43 61.71 2.45 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 107.526 -2.23 . . . . 0.0 107.526 178.035 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 15.9 t -100.66 138.49 37.65 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.366 -1.079 . . . . 0.0 109.336 -179.053 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -93.27 56.43 2.48 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.163 -0.961 . . . . 0.0 109.648 179.468 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 63.17 96.71 0.01 OUTLIER Glycine 0 N--CA 1.487 2.041 0 N-CA-C 110.055 -1.218 . . . . 0.0 110.055 179.71 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 28.7 p -104.82 118.55 36.84 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.282 -1.128 . . . . 0.0 110.128 179.291 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -118.97 136.16 54.24 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.758 -1.214 . . . . 0.0 110.099 -179.433 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 1.2 m -117.12 -56.71 2.23 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.269 -0.894 . . . . 0.0 110.285 -179.969 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 60.1 m -144.61 48.46 1.34 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.158 -0.964 . . . . 0.0 110.358 -179.916 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 . . . . . 0 N--CA 1.494 1.756 0 CA-C-O 117.987 -1.006 . . . . 0.0 110.194 -179.937 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.32 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -112.32 -114.02 3.31 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 -179.97 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.2 m -126.91 93.93 40.84 Favored Pre-proline 0 N--CA 1.494 1.768 0 O-C-N 121.204 -1.174 . . . . 0.0 110.221 179.978 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.67 110.14 2.94 Favored 'Trans proline' 0 C--N 1.317 -1.101 0 O-C-N 123.441 1.232 . . . . 0.0 110.453 179.996 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -116.82 162.69 17.32 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.204 -0.935 . . . . 0.0 110.184 179.986 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 6.5 tt -132.37 155.05 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.189 -0.944 . . . . 0.0 110.158 -179.928 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.47 124.63 27.38 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.253 -0.904 . . . . 0.0 110.169 179.978 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.1 t -142.88 49.32 1.48 Allowed 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.229 -0.919 . . . . 0.0 110.326 179.943 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.2 ttt-85 -141.45 119.04 11.63 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.197 -0.939 . . . . 0.0 110.128 -179.965 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -143.18 133.75 25.0 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.195 -0.941 . . . . 0.0 110.351 -179.962 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.8 p -143.03 -64.21 0.4 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.214 -0.929 . . . . 0.0 110.203 179.93 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.2 mttt -141.28 70.03 27.36 Favored Pre-proline 0 N--CA 1.494 1.744 0 O-C-N 121.209 -0.932 . . . . 0.0 110.06 179.965 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -73.12 158.67 48.88 Favored 'Trans proline' 0 C--N 1.318 -1.055 0 O-C-N 123.307 1.162 . . . . 0.0 110.815 -179.898 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.432 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -101.91 149.68 36.73 Favored Pre-proline 0 N--CA 1.5 2.036 0 O-C-N 121.486 -0.759 . . . . 0.0 109.777 179.583 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -69.97 160.0 51.24 Favored 'Trans proline' 0 C--N 1.316 -1.166 0 O-C-N 123.353 1.186 . . . . 0.0 110.95 -179.727 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -48.96 -31.92 8.23 Favored 'General case' 0 N--CA 1.515 2.804 0 O-C-N 121.411 -0.805 . . . . 0.0 111.254 -179.821 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.94 -32.81 35.04 Favored Glycine 0 N--CA 1.498 2.819 0 O-C-N 120.997 -1.064 . . . . 0.0 110.711 179.782 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -55.24 -33.64 63.31 Favored 'General case' 0 N--CA 1.511 2.596 0 O-C-N 120.876 -1.367 . . . . 0.0 110.709 179.861 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -54.09 -37.17 63.97 Favored 'General case' 0 N--CA 1.512 2.639 0 O-C-N 121.048 -1.033 . . . . 0.0 110.313 179.772 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.5 mttt -58.58 -36.44 73.97 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.234 -0.917 . . . . 0.0 110.279 179.592 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.3 pt -116.5 36.73 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.066 -1.022 . . . . 0.0 110.524 179.747 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.427 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -83.75 -44.3 0.8 Allowed Pre-proline 0 N--CA 1.509 2.507 0 O-C-N 121.119 -0.988 . . . . 0.0 113.161 -179.087 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.0 Cg_endo -75.97 -36.36 2.05 Favored 'Trans proline' 0 N--CA 1.486 1.069 0 O-C-N 122.606 0.792 . . . . 0.0 111.872 -178.016 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.411 HG21 ' CE2' ' A' ' 62' ' ' TYR . 89.9 m -59.51 -41.35 89.71 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 120.926 -1.109 . . . . 0.0 110.044 -179.691 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.9 mt -66.34 -40.85 90.11 Favored 'General case' 0 N--CA 1.508 2.428 0 C-N-CA 119.351 -0.94 . . . . 0.0 109.364 179.318 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.08 -34.9 70.64 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.214 -0.929 . . . . 0.0 110.221 179.4 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -56.84 -36.53 70.12 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 121.069 -1.019 . . . . 0.0 110.327 179.691 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.424 ' CE1' ' HG2' ' A' ' 59' ' ' ARG . 11.3 m-85 -57.84 -38.35 75.48 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.117 -0.989 . . . . 0.0 110.527 179.882 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -58.54 -34.7 71.3 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.156 -0.965 . . . . 0.0 110.648 -179.875 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.2 mp -70.14 -40.73 78.59 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.117 -0.989 . . . . 0.0 108.823 179.409 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 26.1 tp60 -69.06 -47.14 66.06 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.306 -0.958 . . . . 0.0 108.769 178.794 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.413 ' CD1' ' CG2' ' A' ' 52' ' ' ILE . 2.3 tp -60.52 -36.84 79.37 Favored 'General case' 0 N--CA 1.509 2.501 0 C-N-CA 119.401 -0.92 . . . . 0.0 109.525 178.759 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.1 -37.46 71.96 Favored 'General case' 0 N--CA 1.51 2.525 0 O-C-N 121.093 -1.004 . . . . 0.0 110.326 179.788 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -63.36 -50.36 70.23 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.194 -1.002 . . . . 0.0 109.662 -179.777 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.424 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -68.69 -40.36 80.11 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 119.058 -1.057 . . . . 0.0 109.057 178.944 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -60.94 -33.2 72.81 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.285 -0.884 . . . . 0.0 110.223 179.396 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.2 mmmt -93.83 -36.84 12.05 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.063 -1.023 . . . . 0.0 110.709 179.924 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -57.48 -35.43 70.17 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 121.097 -1.002 . . . . 0.0 110.451 -179.945 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -94.2 -38.86 10.84 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.1 -1.0 . . . . 0.0 110.37 179.835 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.9 m -54.32 -36.03 63.31 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 121.007 -1.058 . . . . 0.0 110.672 179.983 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.5 p -94.65 -37.33 11.37 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.124 -0.985 . . . . 0.0 110.426 179.817 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.1 tptt -107.77 106.15 16.32 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.133 -0.979 . . . . 0.0 110.069 179.745 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.1 tp -116.16 43.13 2.22 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.224 -0.922 . . . . 0.0 110.277 -179.944 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -124.2 -58.72 1.53 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.274 -0.891 . . . . 0.0 110.267 -179.966 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -117.14 149.76 39.81 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.19 -0.944 . . . . 0.0 110.282 -179.891 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.5 mptt 52.76 61.7 3.06 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.07 -1.019 . . . . 0.0 110.747 179.973 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.2 m -114.31 -57.07 2.32 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.139 -0.976 . . . . 0.0 110.088 179.865 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.3 m-80 -57.6 -40.0 78.11 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.239 -0.913 . . . . 0.0 109.752 179.611 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -60.81 -37.61 82.58 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.273 -0.892 . . . . 0.0 109.906 179.421 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 38.0 tp60 -60.15 -44.05 95.27 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 121.137 -0.977 . . . . 0.0 109.912 179.881 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 83.3 mt -60.19 -38.04 82.07 Favored 'General case' 0 N--CA 1.509 2.505 0 C-N-CA 119.368 -0.933 . . . . 0.0 109.98 179.731 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.456 ' CE3' ' CA ' ' A' ' 149' ' ' GLY . 39.6 m0 -58.98 -34.03 71.35 Favored 'General case' 0 N--CA 1.509 2.505 0 C-N-CA 119.338 -0.945 . . . . 0.0 109.469 179.548 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -66.6 -33.47 75.73 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 120.628 -1.295 . . . . 0.0 109.443 178.073 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.424 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 16.5 mt -70.47 -55.37 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.234 0 O-C-N 120.971 -1.081 . . . . 0.0 109.49 179.336 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.471 ' CE ' ' HB2' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -58.97 -32.2 69.43 Favored 'General case' 0 N--CA 1.509 2.475 0 C-N-CA 118.763 -1.175 . . . . 0.0 109.78 179.212 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -61.09 -40.39 93.55 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.886 -1.134 . . . . 0.0 109.267 178.96 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.42 HD23 ' CD1' ' A' ' 26' ' ' PHE . 30.4 mt -55.0 -31.95 61.41 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.206 -0.934 . . . . 0.0 110.117 179.084 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.434 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 23.6 t60 -58.04 -39.64 78.93 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 120.984 -1.073 . . . . 0.0 110.038 179.645 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.442 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 8.7 m170 -59.58 -47.12 86.8 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.066 -1.022 . . . . 0.0 109.224 179.329 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -62.77 -38.54 91.0 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.299 -0.876 . . . . 0.0 109.176 178.789 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.424 ' HG2' ' CE1' ' A' ' 26' ' ' PHE . 0.7 OUTLIER -62.07 -47.07 86.33 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.193 -0.942 . . . . 0.0 109.555 179.441 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 82.9 p -66.64 -40.31 88.65 Favored 'General case' 0 N--CA 1.501 2.125 0 C-N-CA 119.253 -0.979 . . . . 0.0 109.032 179.142 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.417 ' O ' ' OG1' ' A' ' 65' ' ' THR . 2.4 ttt180 -63.74 -37.65 88.16 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.261 -0.976 . . . . 0.0 109.427 178.883 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.411 ' CE2' HG21 ' A' ' 22' ' ' THR . 41.6 t80 -62.18 -52.37 64.07 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.093 -1.004 . . . . 0.0 109.372 179.522 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.423 HG23 HD13 ' A' ' 63' ' ' ILE . 81.1 mt -72.27 -38.64 62.41 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.38 0 C-N-CA 119.371 -0.932 . . . . 0.0 109.298 179.274 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.497 ' CD1' ' CD2' ' A' ' 68' ' ' TYR . 68.2 t80 -63.94 -37.49 87.6 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.257 -0.902 . . . . 0.0 109.645 179.001 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.417 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 80.0 m -72.06 -37.04 69.74 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 120.949 -1.094 . . . . 0.0 110.811 -179.74 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.6 pp -82.87 -31.03 28.17 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 120.894 -1.128 . . . . 0.0 112.144 -179.109 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.422 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 60.5 t80 -85.95 -33.97 21.0 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 120.674 -1.266 . . . . 0.0 111.663 -179.35 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.497 ' CD2' ' CD1' ' A' ' 64' ' ' TYR . 21.7 m-85 -95.97 -27.07 15.31 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.859 -1.151 . . . . 0.0 112.355 -178.77 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.2 mttt -111.92 -61.2 1.75 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.676 -1.265 . . . . 0.0 111.269 -179.626 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.11 -31.79 70.38 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 121.037 -1.04 . . . . 0.0 110.708 -179.532 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.5 mttt 56.63 41.6 28.2 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.803 -1.186 . . . . 0.0 110.177 -179.61 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.25 36.12 3.68 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.411 -0.806 . . . . 0.0 109.882 179.123 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.45 HD11 HG23 ' A' ' 73' ' ' ILE . 14.2 tt -153.77 162.74 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.932 0 O-C-N 121.254 -0.904 . . . . 0.0 109.889 -179.825 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 4.3 m -108.15 146.96 31.96 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.064 -1.022 . . . . 0.0 110.273 179.941 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -46.7 -32.37 3.52 Favored 'General case' 0 N--CA 1.515 2.798 0 O-C-N 121.34 -0.85 . . . . 0.0 111.457 -179.938 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -61.69 -50.19 73.45 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.034 -1.041 . . . . 0.0 109.285 179.488 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 31.7 tp -67.51 -43.64 80.37 Favored 'General case' 0 N--CA 1.504 2.253 0 C-N-CA 119.091 -1.044 . . . . 0.0 108.505 178.774 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.422 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 13.3 t80 -60.58 -38.24 83.96 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.3 -0.875 . . . . 0.0 109.501 179.201 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -76.17 -41.72 48.79 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.08 -1.013 . . . . 0.0 108.829 178.813 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.433 ' CE2' ' HG3' ' A' ' 84' ' ' GLU . 84.9 t90 -59.2 -38.99 81.23 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.202 -0.937 . . . . 0.0 109.226 178.795 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.447 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 16.5 mt -66.33 -55.56 15.37 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.198 -0.939 . . . . 0.0 109.147 179.04 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -56.2 -27.24 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.517 0 O-C-N 121.115 -0.99 . . . . 0.0 110.644 -179.788 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.9 mttt -89.08 -20.33 24.47 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 120.917 -1.115 . . . . 0.0 111.54 179.259 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.433 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 10.5 mm-40 -101.53 23.46 11.1 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 120.764 -1.21 . . . . 0.0 111.928 179.985 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.406 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 7.3 ttmm 76.05 70.79 0.08 Allowed 'General case' 0 N--CA 1.512 2.638 0 O-C-N 121.12 -0.987 . . . . 0.0 111.872 179.347 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.447 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 30.3 m-85 -133.33 -62.86 0.78 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.454 -0.779 . . . . 0.0 109.075 179.214 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -128.98 -177.0 4.03 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.496 -0.752 . . . . 0.0 109.216 179.356 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.434 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 5.5 t0 -130.91 108.61 9.95 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.055 -1.028 . . . . 0.0 110.608 -179.849 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -62.97 -38.09 89.72 Favored 'General case' 0 N--CA 1.508 2.425 0 C-N-CA 119.417 -0.913 . . . . 0.0 109.78 179.506 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.1 tp -58.57 -37.95 76.84 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.106 -0.996 . . . . 0.0 110.131 179.936 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 65.4 tp -71.66 -49.08 43.15 Favored 'General case' 0 N--CA 1.506 2.349 0 C-N-CA 119.148 -1.021 . . . . 0.0 108.651 179.043 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.413 HD12 ' CD1' ' A' ' 64' ' ' TYR . 61.5 mt -60.33 -36.15 67.06 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.435 0 C-N-CA 119.389 -0.924 . . . . 0.0 108.764 178.323 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.12 -38.89 75.71 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.084 -1.01 . . . . 0.0 109.01 178.283 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.4 ' HB3' ' CD2' ' A' ' 103' ' ' LEU . 6.0 mmtt -57.44 -41.75 81.07 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.079 -1.013 . . . . 0.0 109.535 179.272 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.5 m0 -68.63 -32.55 72.49 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.248 -0.907 . . . . 0.0 110.54 179.853 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.457 ' NE ' ' OH ' ' A' ' 64' ' ' TYR . 0.1 OUTLIER -82.62 -30.31 29.54 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.952 -1.092 . . . . 0.0 110.611 179.226 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.7 mmtp -54.16 -176.55 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.613 0 O-C-N 120.991 -1.068 . . . . 0.0 110.552 179.798 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -105.44 134.0 49.26 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.203 -0.935 . . . . 0.0 109.736 179.314 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.12 5.5 56.17 Favored Glycine 0 N--CA 1.493 2.456 0 C-N-CA 120.113 -1.041 . . . . 0.0 111.28 -179.54 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -112.83 49.86 0.91 Allowed 'General case' 0 N--CA 1.497 1.922 0 CA-C-N 119.594 1.697 . . . . 0.0 110.036 179.752 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -65.15 -39.85 93.56 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.062 -1.023 . . . . 0.0 110.027 -179.962 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.56 108.44 15.98 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.172 -0.955 . . . . 0.0 110.131 179.942 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.4 ' CD2' ' HB3' ' A' ' 94' ' ' LYS . 14.1 tp -143.65 136.09 27.05 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.187 -0.946 . . . . 0.0 110.037 -179.699 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.442 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.6 p -110.53 -38.61 5.15 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.322 -0.861 . . . . 0.0 112.093 179.876 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.605 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 4.6 m -138.72 -171.6 3.11 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 120.333 -1.479 . . . . 0.0 109.405 178.817 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 12.5 mt -96.59 -35.51 11.04 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.982 -1.074 . . . . 0.0 110.586 179.401 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 12.0 ttt85 -102.51 33.59 3.1 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 120.899 -1.125 . . . . 0.0 109.19 177.919 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.605 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.303 1.7 t -128.98 17.74 6.15 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.283 -0.886 . . . . 0.0 109.256 -179.109 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.406 ' CG2' ' O ' ' A' ' 108' ' ' CYS . 1.2 pt -158.57 38.39 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 O-C-N 120.897 -1.127 . . . . 0.0 110.369 -178.905 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.435 ' O ' ' OG1' ' A' ' 119' ' ' THR . 19.9 mt-30 -80.55 66.45 6.06 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 120.835 -1.165 . . . . 0.0 110.718 -179.14 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.53 -44.74 5.76 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.087 -1.008 . . . . 0.0 110.435 179.632 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -56.58 -39.18 73.05 Favored 'General case' 0 N--CA 1.511 2.575 0 O-C-N 121.052 -1.03 . . . . 0.0 110.295 -179.976 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -118.52 142.7 47.34 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.188 -0.945 . . . . 0.0 110.276 179.998 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 9.8 m -136.25 71.28 1.42 Allowed 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.179 -0.951 . . . . 0.0 110.159 179.956 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -117.67 -56.51 2.2 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.127 -0.983 . . . . 0.0 110.396 -179.885 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -113.28 116.36 29.62 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.128 -0.982 . . . . 0.0 110.263 -179.988 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 91.77 -167.69 31.05 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 179.967 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 9.9 m -129.33 -165.03 1.46 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.237 -1.155 . . . . 0.0 110.082 179.99 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.435 ' OG1' ' O ' ' A' ' 110' ' ' GLN . 2.9 m -112.37 168.14 9.87 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.242 -0.911 . . . . 0.0 110.184 179.881 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 46.7 t -100.8 155.16 18.08 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.301 -0.875 . . . . 0.0 109.365 179.151 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.454 HG23 HD11 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -73.03 -36.26 50.5 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.324 0 O-C-N 121.105 -0.997 . . . . 0.0 110.853 -179.539 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.454 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 5.1 p -54.72 -33.03 60.5 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 120.773 -1.204 . . . . 0.0 110.989 -178.928 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -60.13 -36.64 77.93 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 120.858 -1.151 . . . . 0.0 109.414 178.368 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 57.1 t -78.53 124.9 85.28 Favored Pre-proline 0 N--CA 1.504 2.233 0 O-C-N 121.213 -0.929 . . . . 0.0 109.702 179.612 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -64.98 175.06 4.08 Favored 'Trans proline' 0 N--CA 1.488 1.18 0 O-C-N 123.154 1.081 . . . . 0.0 110.712 179.623 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 11.1 tpp85 -75.07 -37.34 61.65 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.249 -0.907 . . . . 0.0 110.615 -179.679 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.05 -40.97 82.29 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 120.93 -1.106 . . . . 0.0 109.997 -179.704 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -68.79 -41.48 78.66 Favored 'General case' 0 N--CA 1.506 2.368 0 C-N-CA 119.325 -0.95 . . . . 0.0 109.259 179.252 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.8 mt -64.02 -39.18 93.53 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.295 -0.878 . . . . 0.0 109.633 179.233 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -60.98 -40.04 91.93 Favored 'General case' 0 N--CA 1.508 2.454 0 C-N-CA 119.408 -0.917 . . . . 0.0 109.929 179.765 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.93 -38.38 82.21 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.16 -0.962 . . . . 0.0 110.316 179.958 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -63.99 -43.39 95.84 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.123 -0.985 . . . . 0.0 109.981 179.937 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -64.03 -39.17 93.49 Favored 'General case' 0 N--CA 1.508 2.442 0 C-N-CA 119.373 -0.931 . . . . 0.0 109.943 179.846 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 3.8 ttt85 -68.03 -38.87 83.05 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.128 -0.982 . . . . 0.0 109.975 179.648 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 50.1 mmtt -70.9 -35.34 72.25 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.165 -0.959 . . . . 0.0 110.346 179.655 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 8.6 tttt -82.57 -17.2 45.72 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 120.994 -1.066 . . . . 0.0 111.726 179.714 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 91.5 31.22 9.71 Favored Glycine 0 N--CA 1.494 2.526 0 O-C-N 120.702 -1.249 . . . . 0.0 110.121 -179.744 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.6 t -140.94 -161.48 1.22 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.023 -1.28 . . . . 0.0 109.79 179.677 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -133.73 148.72 51.45 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.123 -0.985 . . . . 0.0 110.179 179.993 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.9 p -132.64 161.37 41.64 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.211 -0.931 . . . . 0.0 110.326 -179.879 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 31.2 t -166.62 87.87 0.33 Allowed 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.227 -0.921 . . . . 0.0 110.904 179.988 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.454 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 53.5 t80 -97.29 160.87 14.08 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.299 -0.875 . . . . 0.0 110.499 -179.823 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 4.5 m80 -137.61 -60.47 0.65 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.553 -0.717 . . . . 0.0 109.075 179.061 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -137.27 149.84 47.39 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.359 -0.838 . . . . 0.0 109.324 178.803 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 26.3 p -92.11 155.31 18.14 Favored 'General case' 0 N--CA 1.505 2.276 0 C-N-CA 119.219 -0.992 . . . . 0.0 110.929 -179.581 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.5 p -73.31 -26.01 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 O-C-N 121.368 -0.833 . . . . 0.0 111.539 -179.489 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -51.0 -45.84 61.31 Favored 'General case' 0 N--CA 1.516 2.849 0 O-C-N 120.784 -1.198 . . . . 0.0 109.736 179.895 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.471 ' HB2' ' CE ' ' A' ' 53' ' ' MET . 29.5 p -142.44 -179.52 6.33 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.341 -0.849 . . . . 0.0 110.766 179.733 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . 0.456 ' CA ' ' CE3' ' A' ' 50' ' ' TRP . . . -90.43 63.1 3.05 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 107.836 -2.106 . . . . 0.0 107.836 178.161 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 27.0 t -105.69 139.37 40.38 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.389 -1.065 . . . . 0.0 109.79 -178.986 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 20.4 mmt85 -92.37 56.9 2.87 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 121.165 -0.959 . . . . 0.0 109.556 179.344 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 60.51 95.22 0.01 OUTLIER Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 -179.852 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 p -103.27 126.88 50.67 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.305 -1.114 . . . . 0.0 110.33 179.693 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -142.19 141.67 32.6 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.153 -0.967 . . . . 0.0 109.919 -179.691 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -98.68 -42.17 7.36 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.189 -0.944 . . . . 0.0 110.574 -179.952 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 26.7 p -54.84 -38.11 67.01 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 120.968 -1.082 . . . . 0.0 110.582 -179.85 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 . . . . . 0 N--CA 1.494 1.757 0 CA-C-O 117.955 -1.021 . . . . 0.0 110.278 179.982 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.278 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 78.15 -137.19 19.5 Favored Glycine 0 N--CA 1.492 2.413 0 N-CA-C 109.619 -1.392 . . . . 0.0 109.619 -179.976 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 97.8 p -124.5 88.94 52.8 Favored Pre-proline 0 N--CA 1.493 1.717 0 O-C-N 121.186 -1.185 . . . . 0.0 110.235 179.962 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.6 -174.46 1.48 Allowed 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.429 1.226 . . . . 0.0 110.43 -179.998 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -140.14 111.11 6.93 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.224 -0.922 . . . . 0.0 110.189 -179.959 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 45.6 pt -136.3 150.74 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.205 -0.934 . . . . 0.0 110.255 179.976 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 8.5 mptt 52.86 -178.41 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.122 0 O-C-N 120.987 -1.071 . . . . 0.0 110.595 -179.971 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -138.76 103.05 4.73 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.208 -0.933 . . . . 0.0 110.268 179.983 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -116.71 158.14 24.31 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.206 -0.934 . . . . 0.0 110.128 179.968 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 36.6 mtt-85 -122.04 143.0 49.77 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.249 -0.907 . . . . 0.0 110.263 179.983 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -129.97 151.75 50.19 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.317 -0.864 . . . . 0.0 110.147 179.957 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.2 ttmt -130.78 82.53 64.22 Favored Pre-proline 0 N--CA 1.494 1.742 0 O-C-N 121.141 -0.974 . . . . 0.0 110.326 -179.992 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -73.25 157.79 49.61 Favored 'Trans proline' 0 C--N 1.318 -1.058 0 O-C-N 123.395 1.208 . . . . 0.0 110.366 179.98 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.431 ' HB3' ' CE3' ' A' ' 80' ' ' TRP . . . 61.43 151.5 0.1 Allowed Pre-proline 0 N--CA 1.503 2.188 0 O-C-N 121.334 -0.854 . . . . 0.0 110.475 179.93 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.28 162.5 42.25 Favored 'Trans proline' 0 C--N 1.317 -1.109 0 O-C-N 123.225 1.118 . . . . 0.0 110.794 -179.794 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -48.87 -32.05 8.23 Favored 'General case' 0 N--CA 1.514 2.729 0 O-C-N 121.391 -0.818 . . . . 0.0 111.307 -179.784 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.83 -34.33 44.79 Favored Glycine 0 N--CA 1.499 2.88 0 O-C-N 120.994 -1.066 . . . . 0.0 110.53 179.84 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.422 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 18.0 t80 -55.06 -32.69 62.12 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 120.938 -1.33 . . . . 0.0 110.78 179.873 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -54.65 -37.84 66.19 Favored 'General case' 0 N--CA 1.513 2.69 0 O-C-N 120.933 -1.104 . . . . 0.0 110.21 179.71 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.19 -35.65 71.93 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.29 -0.882 . . . . 0.0 110.252 179.49 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pt -115.7 36.05 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 121.068 -1.02 . . . . 0.0 110.563 179.65 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.435 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 3.5 tptm -82.64 -43.35 0.93 Allowed Pre-proline 0 N--CA 1.508 2.474 0 O-C-N 121.028 -1.045 . . . . 0.0 112.802 -179.506 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.435 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.4 Cg_endo -75.76 -37.66 1.59 Allowed 'Trans proline' 0 N--CA 1.486 1.039 0 O-C-N 122.479 0.726 . . . . 0.0 111.345 -178.393 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.416 HG22 ' CE2' ' A' ' 62' ' ' TYR . 72.4 m -61.39 -42.92 99.5 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.071 -1.018 . . . . 0.0 110.125 -179.788 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.423 HD22 ' CD2' ' A' ' 86' ' ' TYR . 3.1 mt -64.48 -41.2 96.62 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.192 -0.943 . . . . 0.0 109.747 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.11 -34.99 72.66 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.088 -1.008 . . . . 0.0 110.149 179.512 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -58.04 -35.46 71.35 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.067 -1.021 . . . . 0.0 110.22 179.505 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.491 ' CE2' HD13 ' A' ' 55' ' ' LEU . 6.7 m-85 -56.73 -44.17 81.39 Favored 'General case' 0 N--CA 1.513 2.687 0 O-C-N 120.972 -1.08 . . . . 0.0 109.999 179.297 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -57.56 -26.52 61.55 Favored 'General case' 0 N--CA 1.506 2.333 0 C-N-CA 119.317 -0.953 . . . . 0.0 110.527 179.419 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 16.6 mm -65.53 -48.61 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.314 0 O-C-N 120.954 -1.091 . . . . 0.0 109.119 179.426 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -67.39 -51.8 47.64 Favored 'General case' 0 N--CA 1.506 2.336 0 C-N-CA 119.251 -0.98 . . . . 0.0 108.72 179.027 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.57 -32.37 68.86 Favored 'General case' 0 N--CA 1.508 2.432 0 C-N-CA 119.439 -0.905 . . . . 0.0 109.608 178.65 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.0 mtt-85 -59.82 -43.25 94.62 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 120.967 -1.083 . . . . 0.0 110.077 179.791 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -61.14 -46.04 92.2 Favored 'General case' 0 N--CA 1.508 2.443 0 C-N-CA 119.281 -0.968 . . . . 0.0 109.735 -179.69 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.428 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -70.26 -42.37 72.23 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 119.311 -0.956 . . . . 0.0 108.994 178.984 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -61.05 -32.22 71.85 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.28 -0.888 . . . . 0.0 110.158 179.341 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.1 mmmt -91.8 -33.94 14.78 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 120.98 -1.075 . . . . 0.0 110.745 179.894 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -56.43 -37.95 70.93 Favored 'General case' 0 N--CA 1.512 2.645 0 O-C-N 121.032 -1.042 . . . . 0.0 110.278 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 36.2 tttt -58.88 -51.67 69.02 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.069 -1.019 . . . . 0.0 110.002 179.916 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 51.74 -168.7 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.058 -1.026 . . . . 0.0 111.018 179.911 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.5 p -113.62 155.41 25.53 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.308 -0.87 . . . . 0.0 109.933 179.833 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 52.58 39.61 28.42 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.021 -1.049 . . . . 0.0 110.455 -179.658 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 tt -149.15 86.17 1.48 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.288 -0.882 . . . . 0.0 110.267 -179.801 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.06 106.08 18.27 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.22 -0.925 . . . . 0.0 110.286 -179.912 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -166.74 116.99 0.91 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.273 -0.892 . . . . 0.0 110.602 -179.977 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 20.0 mmtt 52.94 49.37 20.36 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.04 -1.038 . . . . 0.0 110.36 -179.562 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.8 m -94.92 -36.9 11.42 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.266 -0.896 . . . . 0.0 110.632 -179.907 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -58.17 -40.53 81.7 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.041 -1.037 . . . . 0.0 109.961 179.926 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.41 ' HA ' ' CE3' ' A' ' 50' ' ' TRP . 23.0 mt-10 -67.39 -43.81 80.42 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.166 -0.959 . . . . 0.0 109.268 179.368 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 46.6 tp60 -67.43 -41.17 85.25 Favored 'General case' 0 N--CA 1.505 2.285 0 C-N-CA 119.328 -0.949 . . . . 0.0 109.113 179.095 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -60.22 -37.18 79.52 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.236 -0.915 . . . . 0.0 109.713 179.222 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.434 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 51.5 m0 -59.91 -36.03 76.14 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.116 -0.99 . . . . 0.0 109.898 179.474 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -62.25 -30.09 70.87 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.037 -1.04 . . . . 0.0 109.986 178.501 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.428 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 63.9 mt -72.25 -58.73 4.42 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.233 0 O-C-N 120.979 -1.076 . . . . 0.0 109.373 179.519 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.6 ptm -57.34 -26.67 61.32 Favored 'General case' 0 N--CA 1.512 2.662 0 C-N-CA 118.298 -1.361 . . . . 0.0 109.814 178.77 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.4 mm-40 -60.6 -36.82 79.51 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 120.753 -1.217 . . . . 0.0 109.314 177.915 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.491 HD13 ' CE2' ' A' ' 26' ' ' PHE . 0.6 OUTLIER -53.0 -34.5 56.53 Favored 'General case' 0 N--CA 1.514 2.771 0 O-C-N 120.981 -1.074 . . . . 0.0 109.522 178.84 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.446 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 33.2 t60 -51.23 -39.04 55.76 Favored 'General case' 0 N--CA 1.511 2.582 0 O-C-N 121.062 -1.024 . . . . 0.0 110.42 179.954 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.44 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.0 m170 -70.24 -53.21 17.95 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.114 -1.034 . . . . 0.0 109.181 178.945 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.434 ' HB3' ' CE2' ' A' ' 26' ' ' PHE . 35.1 tp60 -60.64 -29.92 69.56 Favored 'General case' 0 N--CA 1.504 2.24 0 C-N-CA 119.395 -0.922 . . . . 0.0 110.119 178.893 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.419 ' HD2' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -74.39 -46.65 38.99 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 120.99 -1.069 . . . . 0.0 109.009 179.163 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 86.8 p -67.05 -37.8 84.7 Favored 'General case' 0 N--CA 1.5 2.046 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.124 178.793 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 7.8 ttm-85 -64.27 -37.96 89.34 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 120.985 -1.072 . . . . 0.0 109.653 179.141 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.416 ' CE2' HG22 ' A' ' 22' ' ' THR . 60.9 t80 -63.4 -50.2 70.8 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.21 -0.931 . . . . 0.0 109.497 179.451 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 80.8 mt -72.82 -40.12 60.21 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.366 0 O-C-N 121.181 -0.949 . . . . 0.0 109.198 179.202 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.452 ' CE1' ' CG2' ' A' ' 92' ' ' ILE . 46.5 t80 -60.64 -31.19 70.41 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.233 -0.917 . . . . 0.0 109.989 178.878 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 48.6 m -80.87 -36.17 31.68 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.879 -1.138 . . . . 0.0 110.694 -179.904 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.404 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -82.92 -32.71 27.11 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 120.873 -1.142 . . . . 0.0 112.314 -179.078 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.431 ' CD1' ' HB2' ' A' ' 78' ' ' TYR . 77.4 t80 -86.5 -35.75 19.41 Favored 'General case' 0 N--CA 1.511 2.61 0 O-C-N 120.624 -1.297 . . . . 0.0 111.901 -179.281 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -98.36 -21.5 16.58 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.859 -1.15 . . . . 0.0 112.882 -178.324 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.411 ' HE2' ' CD2' ' A' ' 64' ' ' TYR . 0.7 OUTLIER -117.7 -57.99 2.07 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.571 -1.331 . . . . 0.0 111.408 -179.262 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -64.45 -30.81 71.84 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 121.005 -1.059 . . . . 0.0 110.71 -179.83 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp 58.45 43.6 19.34 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.769 -1.207 . . . . 0.0 110.127 -179.708 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.04 38.02 3.48 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.383 -0.823 . . . . 0.0 109.744 179.331 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.466 HG22 HD12 ' A' ' 73' ' ' ILE . 13.9 tt -156.47 162.7 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 O-C-N 121.22 -0.925 . . . . 0.0 110.227 -179.644 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 19.5 p -108.11 146.36 32.76 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.076 -1.015 . . . . 0.0 110.078 179.541 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.8 tttt -45.6 -32.82 2.5 Favored 'General case' 0 N--CA 1.516 2.831 0 O-C-N 121.33 -0.856 . . . . 0.0 111.661 -179.78 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -61.54 -49.98 74.49 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.002 -1.061 . . . . 0.0 109.31 179.535 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 36.6 tp -67.48 -43.09 81.83 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.19 -1.004 . . . . 0.0 108.538 178.765 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.431 ' HB2' ' CD1' ' A' ' 67' ' ' TYR . 17.8 t80 -60.98 -38.14 84.93 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.343 -0.848 . . . . 0.0 109.333 179.008 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -75.48 -41.05 56.45 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.076 -1.015 . . . . 0.0 108.963 178.75 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.431 ' CE3' ' HB3' ' A' ' 12' ' ' ALA . 88.2 t90 -60.21 -38.37 83.1 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.073 -1.017 . . . . 0.0 109.178 178.758 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.457 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 16.1 mt -66.37 -54.8 20.27 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.236 -0.915 . . . . 0.0 109.328 179.072 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -56.03 -27.21 22.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.47 0 O-C-N 121.114 -0.991 . . . . 0.0 110.71 -179.724 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.75 -20.64 24.51 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.96 -1.088 . . . . 0.0 111.533 179.447 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.42 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 68.0 mm-40 -101.48 23.73 10.68 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 120.678 -1.264 . . . . 0.0 111.886 179.936 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.41 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 3.9 ttmm 75.85 71.76 0.08 Allowed 'General case' 0 N--CA 1.511 2.621 0 O-C-N 121.134 -0.979 . . . . 0.0 111.843 179.324 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.457 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 31.9 m-85 -134.42 -62.78 0.74 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.418 -0.801 . . . . 0.0 109.2 179.305 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -131.42 173.54 10.98 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.427 -0.796 . . . . 0.0 109.46 179.478 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.446 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.0 t70 -127.6 127.55 44.03 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.028 -1.045 . . . . 0.0 110.711 -179.872 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -73.65 -35.73 65.3 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 121.338 -0.851 . . . . 0.0 110.018 179.43 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 12.9 tp -60.3 -39.32 86.51 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.09 -1.006 . . . . 0.0 110.157 179.981 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.42 HD23 ' CD2' ' A' ' 57' ' ' HIS . 56.3 tp -72.81 -49.78 28.3 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.018 -1.051 . . . . 0.0 108.526 179.039 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.452 ' CG2' ' CE1' ' A' ' 64' ' ' TYR . 52.2 mt -59.12 -34.91 54.81 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.425 0 C-N-CA 119.189 -1.004 . . . . 0.0 108.783 178.16 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.81 -37.95 76.44 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.01 -1.057 . . . . 0.0 108.885 177.951 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.424 ' HD2' ' CZ ' ' A' ' 100' ' ' TYR . 5.2 mmtt -56.74 -42.49 79.36 Favored 'General case' 0 N--CA 1.51 2.561 0 O-C-N 121.001 -1.062 . . . . 0.0 109.41 179.17 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.3 m0 -66.7 -37.47 84.78 Favored 'General case' 0 N--CA 1.507 2.383 0 C-N-CA 119.404 -0.918 . . . . 0.0 109.824 179.441 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.37 -35.52 71.14 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.167 -0.958 . . . . 0.0 110.233 179.266 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.1 mmtp -54.21 -176.44 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.693 0 O-C-N 121.117 -0.989 . . . . 0.0 110.536 179.919 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.45 139.34 39.53 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.206 -0.934 . . . . 0.0 109.715 179.158 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 93.68 8.8 60.52 Favored Glycine 0 N--CA 1.495 2.574 0 C-N-CA 120.172 -1.013 . . . . 0.0 111.138 -179.436 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.424 ' CZ ' ' HD2' ' A' ' 94' ' ' LYS . 45.0 m-85 -116.7 70.03 0.76 Allowed 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 119.486 1.643 . . . . 0.0 109.839 179.694 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -98.34 -35.83 10.19 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.163 -0.961 . . . . 0.0 111.091 -179.614 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.66 59.49 0.98 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.931 -1.106 . . . . 0.0 111.032 -179.448 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.2 pp -107.88 152.57 24.24 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.027 -1.046 . . . . 0.0 109.616 179.057 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.44 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.4 p -113.18 -27.04 8.14 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.113 -0.992 . . . . 0.0 113.628 -178.929 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.558 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 10.3 m -144.62 -167.71 2.72 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 120.137 -1.602 . . . . 0.0 109.877 179.18 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 12.5 mt -95.87 -39.87 9.6 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.091 -1.006 . . . . 0.0 109.915 178.88 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.9 ttm-85 -101.68 29.11 5.09 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.06 -1.025 . . . . 0.0 110.054 178.392 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.558 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.299 1.8 t -126.79 16.33 7.45 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.037 -1.039 . . . . 0.0 109.065 -179.661 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.402 ' CG2' ' O ' ' A' ' 108' ' ' CYS . 1.0 OUTLIER -159.31 39.31 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 O-C-N 120.969 -1.082 . . . . 0.0 110.184 -178.903 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.425 ' O ' ' OG1' ' A' ' 119' ' ' THR . 5.9 tt0 -101.57 97.3 7.75 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 120.918 -1.114 . . . . 0.0 111.19 -178.784 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 12.7 ttmt -112.33 -55.74 2.48 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.378 -0.826 . . . . 0.0 109.942 179.391 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 27.8 m-20 52.55 -178.7 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.08 -1.012 . . . . 0.0 110.924 179.874 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -137.77 155.15 49.36 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.234 -0.916 . . . . 0.0 110.134 179.897 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 5.3 m 52.38 38.33 24.86 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.098 -1.002 . . . . 0.0 110.851 -179.934 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -146.61 -178.32 6.11 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.133 -0.979 . . . . 0.0 110.405 -179.947 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -118.05 162.88 17.46 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.157 -0.965 . . . . 0.0 110.124 179.944 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 140.56 -157.78 25.83 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 109.673 -1.371 . . . . 0.0 109.673 -179.97 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 63.6 m -143.5 145.55 32.66 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.242 -1.152 . . . . 0.0 110.355 -179.972 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.425 ' OG1' ' O ' ' A' ' 110' ' ' GLN . 1.4 m -119.8 171.44 8.41 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.241 -0.912 . . . . 0.0 110.279 179.945 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 47.2 t -100.73 155.44 17.9 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.348 -0.845 . . . . 0.0 108.988 178.635 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.449 HG22 ' CE1' ' A' ' 142' ' ' PHE . 14.4 tt -77.8 -29.56 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.441 0 O-C-N 121.078 -1.014 . . . . 0.0 112.099 -179.063 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.492 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 14.1 p -55.05 -34.87 63.92 Favored 'General case' 0 N--CA 1.513 2.688 0 O-C-N 120.586 -1.321 . . . . 0.0 110.382 -179.136 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -27.7 64.01 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.066 -1.021 . . . . 0.0 109.586 177.53 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 49.5 t -73.03 118.75 71.13 Favored Pre-proline 0 N--CA 1.508 2.431 0 O-C-N 120.975 -1.078 . . . . 0.0 110.397 179.845 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . 0.413 ' HB3' ' CB ' ' A' ' 154' ' ' ALA . 37.4 Cg_endo -64.57 171.88 7.59 Favored 'Trans proline' 0 N--CA 1.489 1.234 0 O-C-N 123.053 1.028 . . . . 0.0 110.591 178.646 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.11 -38.44 61.14 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.201 -0.937 . . . . 0.0 110.505 -179.85 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.41 -42.73 92.46 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.115 -0.99 . . . . 0.0 110.082 -179.789 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -64.15 -41.55 97.12 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.214 -0.929 . . . . 0.0 109.551 179.703 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 9.4 mt -61.0 -39.76 90.94 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.273 -0.892 . . . . 0.0 109.827 179.662 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -59.32 -39.43 83.08 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.174 -0.954 . . . . 0.0 110.144 -179.929 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.97 -39.02 84.22 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.216 -0.927 . . . . 0.0 110.293 -179.975 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -64.51 -40.41 95.59 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.295 -0.878 . . . . 0.0 110.015 -179.935 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -67.12 -40.25 86.79 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.128 -0.982 . . . . 0.0 109.914 179.762 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 13.0 ttp85 -67.27 -33.56 75.57 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.166 -0.959 . . . . 0.0 110.403 179.526 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 18.6 mmtp -75.35 -31.6 60.61 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.025 -1.047 . . . . 0.0 111.04 -179.986 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -101.79 23.07 11.87 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 120.896 -1.127 . . . . 0.0 111.845 -179.917 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.84 47.0 48.47 Favored Glycine 0 N--CA 1.5 2.911 0 O-C-N 120.72 -1.238 . . . . 0.0 110.913 179.238 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 10.1 t -146.07 -162.31 1.49 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.137 -1.214 . . . . 0.0 110.254 179.884 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -132.79 160.61 36.36 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.039 -1.038 . . . . 0.0 110.177 -179.925 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 8.8 p -147.56 161.21 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 O-C-N 121.16 -0.962 . . . . 0.0 110.473 -179.794 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 36.1 t -171.62 108.38 0.25 Allowed 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.126 -0.983 . . . . 0.0 111.039 179.727 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.492 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 87.0 t80 -104.15 157.07 17.37 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.106 -0.996 . . . . 0.0 110.649 179.906 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.09 -61.9 0.65 Allowed 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 178.662 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -146.43 148.68 32.54 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.54 -0.725 . . . . 0.0 109.164 178.676 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . 0.444 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.4 p -91.68 154.89 18.7 Favored 'General case' 0 N--CA 1.508 2.435 0 C-N-CA 119.011 -1.076 . . . . 0.0 110.983 -179.405 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.4 m -72.6 -25.28 22.48 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.5 0 O-C-N 121.367 -0.833 . . . . 0.0 111.735 -179.362 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -49.74 -59.0 4.22 Favored 'General case' 0 N--CA 1.517 2.88 0 O-C-N 120.879 -1.138 . . . . 0.0 110.219 -179.756 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.434 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.3 p -128.0 -163.91 1.32 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.218 -0.926 . . . . 0.0 110.319 179.356 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . 0.407 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -101.87 64.26 0.48 Allowed Glycine 0 N--CA 1.491 2.307 0 N-CA-C 107.784 -2.126 . . . . 0.0 107.784 178.278 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 27.6 t -98.95 143.9 28.73 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.36 -1.083 . . . . 0.0 109.724 -179.099 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -100.77 44.3 1.02 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.2 -0.937 . . . . 0.0 109.775 179.41 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 77.69 93.93 0.25 Allowed Glycine 0 N--CA 1.485 1.966 0 N-CA-C 109.872 -1.291 . . . . 0.0 109.872 179.897 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.1 p -108.18 129.01 55.2 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.191 -1.182 . . . . 0.0 110.069 179.67 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . 0.413 ' CB ' ' HB3' ' A' ' 125' ' ' PRO . . . -148.36 148.1 29.99 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.187 -0.946 . . . . 0.0 110.245 -179.316 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -112.86 -58.11 2.2 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.199 -0.938 . . . . 0.0 110.37 179.994 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -156.12 50.26 0.52 Allowed 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.135 -0.978 . . . . 0.0 110.635 -179.889 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 . . . . . 0 N--CA 1.495 1.79 0 CA-C-O 117.893 -1.051 . . . . 0.0 110.134 -179.959 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 N-CA-C 109.491 -1.443 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 118.47 100.29 1.98 Allowed Glycine 0 N--CA 1.492 2.413 0 N-CA-C 109.509 -1.437 . . . . 0.0 109.509 -179.966 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -133.7 92.79 22.34 Favored Pre-proline 0 N--CA 1.494 1.726 0 O-C-N 121.215 -1.168 . . . . 0.0 110.218 179.956 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.55 132.32 18.77 Favored 'Trans proline' 0 C--N 1.317 -1.131 0 O-C-N 123.425 1.224 . . . . 0.0 110.366 179.971 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 13.4 tpp85 -133.39 62.36 1.66 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.136 -0.978 . . . . 0.0 110.161 179.904 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.4 tp -137.15 145.51 29.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.19 -0.944 . . . . 0.0 110.113 -179.964 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.0 mtpt -141.32 137.11 32.18 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.205 -0.934 . . . . 0.0 110.218 179.952 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -124.22 40.16 3.8 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.223 -0.923 . . . . 0.0 110.207 -179.941 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -144.57 -174.6 4.37 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.222 -0.924 . . . . 0.0 110.242 179.949 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 31.9 mtt85 -140.06 73.82 1.44 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.184 -0.947 . . . . 0.0 110.263 -179.953 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 46.7 t -142.92 118.02 10.09 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.267 -0.896 . . . . 0.0 110.157 -179.978 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.5 mttp -144.65 153.17 54.39 Favored Pre-proline 0 N--CA 1.494 1.767 0 O-C-N 121.152 -0.967 . . . . 0.0 110.441 -179.911 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -72.66 158.92 49.84 Favored 'Trans proline' 0 C--N 1.318 -1.044 0 O-C-N 123.407 1.214 . . . . 0.0 110.63 179.877 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.43 ' HB1' ' CH2' ' A' ' 80' ' ' TRP . . . -55.84 145.0 54.72 Favored Pre-proline 0 N--CA 1.513 2.721 0 O-C-N 121.305 -0.872 . . . . 0.0 110.035 -179.945 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -71.91 163.25 39.42 Favored 'Trans proline' 0 C--N 1.318 -1.073 0 O-C-N 123.331 1.174 . . . . 0.0 110.719 -179.889 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -48.36 -32.13 7.09 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.465 -0.772 . . . . 0.0 111.399 -179.784 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.75 -33.35 42.17 Favored Glycine 0 N--CA 1.498 2.802 0 O-C-N 120.994 -1.067 . . . . 0.0 110.59 179.73 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -54.04 -32.43 54.43 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 120.884 -1.363 . . . . 0.0 110.723 179.783 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -54.03 -36.39 62.97 Favored 'General case' 0 N--CA 1.512 2.645 0 O-C-N 121.052 -1.03 . . . . 0.0 110.325 179.682 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.9 mtmt -57.12 -35.14 69.11 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.091 -1.005 . . . . 0.0 110.328 179.507 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 3.5 pt -118.21 37.16 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 O-C-N 121.072 -1.018 . . . . 0.0 110.57 179.606 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -82.63 -43.58 0.93 Allowed Pre-proline 0 N--CA 1.508 2.46 0 O-C-N 121.063 -1.023 . . . . 0.0 112.989 -179.545 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.8 Cg_endo -75.44 -38.68 1.32 Allowed 'Trans proline' 0 N--CA 1.486 1.048 0 O-C-N 122.577 0.777 . . . . 0.0 111.529 -178.266 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.419 HG23 ' CE2' ' A' ' 62' ' ' TYR . 89.9 m -58.83 -41.77 87.7 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.025 -1.047 . . . . 0.0 109.808 179.898 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.419 HD23 ' CE2' ' A' ' 86' ' ' TYR . 1.5 mt -65.24 -38.72 91.25 Favored 'General case' 0 N--CA 1.506 2.366 0 C-N-CA 119.466 -0.894 . . . . 0.0 109.508 179.216 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.2 m -58.3 -35.71 72.26 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.046 -1.034 . . . . 0.0 110.082 179.314 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -56.55 -34.57 67.22 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.098 -1.001 . . . . 0.0 110.427 179.563 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.503 ' CE2' HD12 ' A' ' 55' ' ' LEU . 8.8 m-85 -57.71 -36.18 71.64 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.088 -1.007 . . . . 0.0 110.432 179.829 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -56.64 -35.61 68.55 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.163 -0.961 . . . . 0.0 110.656 -179.638 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.1 mp -63.84 -42.17 94.98 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.423 0 O-C-N 120.969 -1.082 . . . . 0.0 108.716 179.372 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -67.69 -57.19 6.81 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 119.133 -1.027 . . . . 0.0 108.298 178.521 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.2 tp -54.74 -33.0 60.58 Favored 'General case' 0 N--CA 1.512 2.632 0 C-N-CA 119.363 -0.935 . . . . 0.0 109.75 178.318 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.05 -36.12 70.13 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.09 -1.006 . . . . 0.0 110.404 179.657 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.68 -52.77 61.99 Favored 'General case' 0 N--CA 1.507 2.381 0 C-N-CA 119.075 -1.05 . . . . 0.0 109.427 179.98 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.432 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -69.39 -42.13 75.54 Favored 'General case' 0 N--CA 1.504 2.236 0 C-N-CA 119.048 -1.061 . . . . 0.0 108.609 178.638 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -61.34 -33.65 73.97 Favored 'General case' 0 N--CA 1.503 2.22 0 C-N-CA 119.525 -0.87 . . . . 0.0 110.069 179.266 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 6.4 mtmt -87.79 -34.48 18.28 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.064 -1.022 . . . . 0.0 110.612 179.754 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -55.16 -35.95 65.32 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.938 -1.101 . . . . 0.0 110.262 179.692 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 14.6 tttp -54.19 -37.73 64.84 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 121.048 -1.032 . . . . 0.0 110.485 179.767 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.3 t -107.51 39.99 1.79 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.135 -0.978 . . . . 0.0 110.063 179.691 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -163.15 101.57 0.97 Allowed 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.195 -0.941 . . . . 0.0 110.634 -179.9 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.5 ttmt 53.29 95.26 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.037 -1.039 . . . . 0.0 110.585 -179.891 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.5 tp -147.08 83.87 1.58 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.128 -0.983 . . . . 0.0 110.448 -179.947 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -108.92 -53.16 2.68 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.258 -0.901 . . . . 0.0 110.146 179.854 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -120.97 42.4 3.06 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.09 -1.006 . . . . 0.0 110.194 179.935 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -159.24 77.77 0.72 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.337 -0.852 . . . . 0.0 110.752 -179.887 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 m -115.92 -55.51 2.41 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.113 -0.992 . . . . 0.0 110.616 -179.881 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.42 ' HB3' ' CZ2' ' A' ' 50' ' ' TRP . 74.1 m-80 -56.41 -39.38 72.92 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.124 -0.985 . . . . 0.0 110.014 179.853 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -60.81 -38.55 85.78 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.213 -0.929 . . . . 0.0 109.771 179.482 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -57.87 -40.98 81.5 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.077 -1.014 . . . . 0.0 109.894 179.827 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 54.0 mt -75.04 -33.11 61.7 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.256 -0.902 . . . . 0.0 110.502 179.844 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.434 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 45.9 m0 -58.66 -38.85 79.05 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 120.905 -1.122 . . . . 0.0 109.738 179.566 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -66.02 -32.39 73.83 Favored 'General case' 0 N--CA 1.502 2.136 0 C-N-CA 119.035 -1.066 . . . . 0.0 109.371 178.271 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.432 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 4.4 mt -72.44 -55.56 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.214 0 O-C-N 120.981 -1.075 . . . . 0.0 109.7 179.585 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.3 ptm -60.08 -24.36 64.53 Favored 'General case' 0 N--CA 1.509 2.492 0 C-N-CA 118.259 -1.376 . . . . 0.0 110.003 178.883 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -64.98 -35.41 81.08 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 120.756 -1.215 . . . . 0.0 109.76 178.369 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.503 HD12 ' CE2' ' A' ' 26' ' ' PHE . 0.8 OUTLIER -54.62 -35.8 63.8 Favored 'General case' 0 N--CA 1.514 2.73 0 O-C-N 120.846 -1.159 . . . . 0.0 109.834 179.387 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.437 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 26.2 t60 -52.22 -37.15 54.22 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 120.949 -1.095 . . . . 0.0 110.483 -179.746 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.451 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.4 m170 -67.95 -48.53 65.63 Favored 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 119.143 -1.023 . . . . 0.0 109.463 179.494 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -61.81 -37.04 82.93 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 119.286 -0.966 . . . . 0.0 109.594 179.154 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.417 ' HG3' ' CE2' ' A' ' 26' ' ' PHE . 3.0 mtt180 -66.27 -46.48 76.88 Favored 'General case' 0 N--CA 1.508 2.451 0 C-N-CA 119.29 -0.964 . . . . 0.0 109.641 179.364 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.5 p -62.25 -39.53 93.18 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.13 -0.981 . . . . 0.0 109.503 179.526 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.42 ' O ' ' OG1' ' A' ' 65' ' ' THR . 10.7 tpp85 -64.31 -42.61 96.26 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.103 -0.998 . . . . 0.0 109.101 179.307 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.419 ' CE2' HG23 ' A' ' 22' ' ' THR . 59.6 t80 -63.19 -49.04 75.81 Favored 'General case' 0 N--CA 1.507 2.389 0 C-N-CA 119.491 -0.884 . . . . 0.0 109.464 179.422 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.453 HG22 HD12 ' A' ' 63' ' ' ILE . 85.2 mt -69.31 -38.74 78.01 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.331 0 C-N-CA 119.305 -0.958 . . . . 0.0 109.238 179.538 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.412 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 9.0 t80 -66.57 -41.7 88.2 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.169 -0.957 . . . . 0.0 108.943 178.978 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.42 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 86.9 m -60.49 -41.28 93.92 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.126 -0.984 . . . . 0.0 110.366 -179.735 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.403 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.7 pp -83.2 -34.8 25.83 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 118.825 -1.15 . . . . 0.0 112.528 -178.978 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 32.9 t80 -86.49 -32.59 20.7 Favored 'General case' 0 N--CA 1.513 2.706 0 O-C-N 120.628 -1.295 . . . . 0.0 112.066 -179.184 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.412 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 7.5 m-85 -98.43 -8.84 26.11 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 120.787 -1.196 . . . . 0.0 113.178 -178.524 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 5.1 mtpm? -127.8 -58.4 1.23 Allowed 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.373 -1.454 . . . . 0.0 110.69 179.693 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 -69.84 -28.82 66.01 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.119 -0.988 . . . . 0.0 110.741 -179.802 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.0 ttmt 58.92 43.5 17.91 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.768 -1.207 . . . . 0.0 109.932 -179.451 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.71 34.47 3.96 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.366 -0.834 . . . . 0.0 109.897 179.288 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.43 HD13 HG23 ' A' ' 73' ' ' ILE . 13.9 tt -153.21 162.34 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.144 -0.973 . . . . 0.0 109.856 -179.962 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.6 p -108.61 147.48 31.77 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.103 -0.998 . . . . 0.0 110.128 179.844 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 24.8 ttmt -46.36 -31.7 2.76 Favored 'General case' 0 N--CA 1.514 2.733 0 O-C-N 121.333 -0.854 . . . . 0.0 111.653 -179.978 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -62.2 -51.3 68.33 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.944 -1.097 . . . . 0.0 109.412 179.566 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 32.4 tp -65.97 -44.36 85.17 Favored 'General case' 0 N--CA 1.504 2.273 0 C-N-CA 119.168 -1.013 . . . . 0.0 108.538 178.902 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 17.0 t80 -60.77 -39.2 87.91 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.369 -0.832 . . . . 0.0 109.344 179.169 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -72.47 -42.04 65.38 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.141 -0.975 . . . . 0.0 108.876 178.771 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.435 ' CE2' ' HG3' ' A' ' 84' ' ' GLU . 88.8 t90 -56.28 -36.65 68.86 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 121.195 -0.941 . . . . 0.0 109.734 178.926 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.461 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 62.8 mt -70.14 -46.77 64.07 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.177 -0.952 . . . . 0.0 108.897 178.954 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 33.3 mm -55.68 -33.02 32.57 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.669 0 O-C-N 121.24 -0.913 . . . . 0.0 109.83 179.261 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.34 -15.11 34.14 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 120.99 -1.069 . . . . 0.0 112.261 -179.909 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.435 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 64.3 mm-40 -104.94 23.15 14.01 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 120.475 -1.391 . . . . 0.0 112.165 -179.609 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.4 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 7.5 tttt 75.99 68.42 0.07 Allowed 'General case' 0 N--CA 1.511 2.62 0 O-C-N 121.051 -1.031 . . . . 0.0 112.028 179.277 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.461 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 31.4 m-85 -131.87 -63.35 0.82 Allowed 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 178.784 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -137.41 162.07 34.62 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.482 -0.761 . . . . 0.0 109.07 178.914 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.437 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 21.8 t0 -113.71 117.07 30.5 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.084 -1.01 . . . . 0.0 110.403 -179.804 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 6.1 mtpt -58.51 -38.76 78.37 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.206 -0.934 . . . . 0.0 109.86 179.742 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 47.4 tp -59.65 -40.22 87.01 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.101 -0.999 . . . . 0.0 109.756 179.629 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 66.1 tp -67.09 -52.45 41.88 Favored 'General case' 0 N--CA 1.508 2.426 0 C-N-CA 119.271 -0.972 . . . . 0.0 108.643 179.227 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 54.6 mt -58.6 -32.53 46.29 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.396 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.103 178.409 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.48 -42.86 78.06 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.046 -1.034 . . . . 0.0 109.521 178.833 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.417 ' CD ' ' CD2' ' A' ' 106' ' ' LEU . 7.5 mttp -59.6 -41.22 89.82 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.119 -0.988 . . . . 0.0 110.14 179.465 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.3 m0 -65.1 -39.49 93.22 Favored 'General case' 0 N--CA 1.508 2.469 0 C-N-CA 119.125 -1.03 . . . . 0.0 109.836 179.569 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 3.2 mtp85 -75.95 -29.93 58.47 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.268 -0.895 . . . . 0.0 110.566 179.304 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.5 mmtm -54.18 -176.49 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.652 0 O-C-N 120.86 -1.15 . . . . 0.0 110.589 179.771 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 53.7 m -105.07 131.57 52.4 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.166 -0.959 . . . . 0.0 109.772 179.296 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.35 8.33 50.11 Favored Glycine 0 N--CA 1.493 2.489 0 C-N-CA 120.196 -1.002 . . . . 0.0 111.109 -179.449 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -114.75 68.17 0.7 Allowed 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 119.499 1.65 . . . . 0.0 109.946 179.672 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -84.54 -38.53 19.89 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.079 -1.013 . . . . 0.0 109.983 179.787 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.82 90.34 3.31 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.126 -0.984 . . . . 0.0 109.969 179.842 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 9.9 tp -126.99 134.68 50.31 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.279 -0.888 . . . . 0.0 109.664 -179.647 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.451 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.3 p -108.76 -37.93 5.76 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.201 -0.937 . . . . 0.0 112.356 -179.791 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.585 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.5 m -139.92 -167.93 2.4 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.22 -1.55 . . . . 0.0 109.877 178.905 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.417 ' CD2' ' CD ' ' A' ' 94' ' ' LYS . 17.3 mt -98.22 -37.76 9.56 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.132 -0.98 . . . . 0.0 110.674 179.493 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 30.8 ttm-85 -102.52 33.33 3.2 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.949 -1.095 . . . . 0.0 109.311 178.055 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.585 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.312 1.7 t -128.61 17.12 6.41 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.322 -0.861 . . . . 0.0 108.838 -179.06 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.405 ' CG2' ' O ' ' A' ' 108' ' ' CYS . 1.1 pt -159.1 38.54 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 120.814 -1.179 . . . . 0.0 110.434 -178.904 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.409 ' O ' ' OG1' ' A' ' 119' ' ' THR . 12.7 mm-40 -103.96 106.83 17.46 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 120.74 -1.225 . . . . 0.0 110.913 -178.769 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.43 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 14.3 ttmt -105.38 -50.51 3.21 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.332 -0.855 . . . . 0.0 110.445 179.688 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -113.69 118.79 35.32 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.129 -0.982 . . . . 0.0 110.309 179.901 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -150.82 -164.87 2.12 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.26 -0.9 . . . . 0.0 110.379 -179.88 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 8.1 p -115.95 163.84 15.3 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.179 -0.951 . . . . 0.0 110.215 179.957 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 64.48 -70.93 0.08 Allowed 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.137 -0.977 . . . . 0.0 110.809 179.917 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -116.21 163.94 15.22 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.95 -1.094 . . . . 0.0 110.299 -179.894 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -141.19 96.48 0.2 Allowed Glycine 0 N--CA 1.493 2.44 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 179.997 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 4.5 m -137.01 132.02 33.69 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.192 -1.181 . . . . 0.0 110.138 179.952 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.43 ' OG1' ' HA ' ' A' ' 111' ' ' LYS . 0.2 OUTLIER -126.88 173.18 9.79 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.137 -0.977 . . . . 0.0 110.527 -179.865 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 43.3 t -108.02 155.31 20.5 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.436 -0.79 . . . . 0.0 108.922 178.727 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.45 ' CG2' ' CE1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -70.62 -37.15 68.48 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.425 0 O-C-N 121.027 -1.045 . . . . 0.0 110.633 -179.404 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.477 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 6.7 p -55.36 -33.6 63.56 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 120.818 -1.176 . . . . 0.0 110.752 -179.29 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.92 -33.46 70.59 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 120.924 -1.11 . . . . 0.0 109.71 178.325 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 62.0 t -81.17 125.22 79.96 Favored Pre-proline 0 N--CA 1.504 2.269 0 O-C-N 121.163 -0.961 . . . . 0.0 109.725 179.688 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -65.73 170.26 11.63 Favored 'Trans proline' 0 N--CA 1.487 1.111 0 O-C-N 123.119 1.062 . . . . 0.0 110.659 179.582 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 5.9 tpt180 -75.12 -36.42 61.64 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.303 -0.873 . . . . 0.0 110.721 -179.753 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.76 -41.4 81.87 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 120.963 -1.085 . . . . 0.0 110.093 -179.8 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -68.33 -41.34 80.94 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.215 -0.928 . . . . 0.0 109.232 179.275 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.7 mt -63.63 -39.28 93.95 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.249 -0.907 . . . . 0.0 109.676 179.308 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -59.31 -39.66 83.76 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.13 -0.981 . . . . 0.0 109.924 179.716 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -59.88 -37.9 80.68 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.1 -1.0 . . . . 0.0 110.127 179.724 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -61.81 -46.43 89.55 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.178 -0.952 . . . . 0.0 109.869 179.904 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.07 -40.98 95.73 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.218 -0.926 . . . . 0.0 109.906 -179.998 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 19.9 ttt85 -64.98 -30.96 71.99 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.185 -0.947 . . . . 0.0 110.689 179.798 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.43 -29.03 23.16 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 120.95 -1.094 . . . . 0.0 111.361 -179.811 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 23.6 mttt -98.6 24.12 7.84 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 120.783 -1.198 . . . . 0.0 111.724 -179.909 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.16 46.74 42.73 Favored Glycine 0 N--CA 1.5 2.952 0 O-C-N 120.771 -1.205 . . . . 0.0 111.077 179.26 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.7 t -148.93 -164.18 1.96 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.069 -1.253 . . . . 0.0 110.533 179.846 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -139.52 149.7 44.24 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.224 -0.923 . . . . 0.0 110.302 -179.867 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.4 p -132.66 161.0 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 O-C-N 121.221 -0.924 . . . . 0.0 110.2 -179.979 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 41.0 t -168.19 85.6 0.2 Allowed 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.167 -0.958 . . . . 0.0 111.099 -179.963 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.477 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 50.5 t80 -99.38 160.48 14.25 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.261 -0.899 . . . . 0.0 110.486 -179.926 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 -137.06 -61.29 0.66 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.509 -0.744 . . . . 0.0 109.02 178.967 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -134.69 152.04 51.47 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.428 -0.795 . . . . 0.0 108.95 178.669 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 31.5 p -92.85 152.77 19.23 Favored 'General case' 0 N--CA 1.504 2.267 0 C-N-CA 119.028 -1.069 . . . . 0.0 111.085 -179.552 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.9 m -70.61 -26.38 28.35 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.407 0 O-C-N 121.427 -0.795 . . . . 0.0 111.307 -179.522 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -50.49 -58.49 5.65 Favored 'General case' 0 N--CA 1.516 2.841 0 O-C-N 120.855 -1.153 . . . . 0.0 110.213 -179.993 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.434 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 26.0 p -127.59 -166.71 1.64 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.261 -0.899 . . . . 0.0 110.566 179.656 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . 0.419 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.06 57.66 0.8 Allowed Glycine 0 N--CA 1.493 2.442 0 N-CA-C 107.958 -2.057 . . . . 0.0 107.958 178.405 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 19.3 t -101.67 142.61 32.75 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.318 -1.107 . . . . 0.0 109.784 -179.305 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 57.5 mtp85 -95.9 52.45 1.32 Allowed 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.273 -0.892 . . . . 0.0 109.736 179.353 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.89 98.41 0.03 OUTLIER Glycine 0 N--CA 1.488 2.123 0 N-CA-C 109.866 -1.293 . . . . 0.0 109.866 179.956 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 22.6 p -110.44 131.08 55.36 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.266 -1.138 . . . . 0.0 110.356 179.552 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -142.32 141.38 32.37 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.096 -1.003 . . . . 0.0 110.038 -179.802 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 155' ' ' SER . . . . . 0.44 ' O ' ' OG1' ' A' ' 156' ' ' THR . 0.7 OUTLIER -108.05 69.38 0.73 Allowed 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.258 -0.901 . . . . 0.0 110.223 179.972 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 156' ' ' THR . . . . . 0.44 ' OG1' ' O ' ' A' ' 155' ' ' SER . 80.0 p 46.42 52.61 10.57 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.346 -0.846 . . . . 0.0 111.452 179.896 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.229 179.917 . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.344 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 62.69 76.57 0.25 Allowed Glycine 0 N--CA 1.493 2.435 0 N-CA-C 109.534 -1.427 . . . . 0.0 109.534 179.938 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.412 ' OG ' ' HD2' ' A' ' 2' ' ' PRO . 0.1 OUTLIER -135.43 173.03 6.18 Favored Pre-proline 0 N--CA 1.494 1.742 0 O-C-N 121.24 -1.153 . . . . 0.0 110.162 179.977 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.412 ' HD2' ' OG ' ' A' ' 1' ' ' SER . 46.0 Cg_endo -72.68 -38.54 3.14 Favored 'Trans proline' 0 C--N 1.317 -1.117 0 O-C-N 123.443 1.233 . . . . 0.0 110.613 -179.973 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 52.1 mtm-85 -114.28 -172.66 2.14 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.199 -0.938 . . . . 0.0 110.146 -179.995 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 79.6 mt -110.25 -54.82 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.192 -0.943 . . . . 0.0 110.145 179.901 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.5 pttt -157.66 157.0 32.74 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.346 -0.847 . . . . 0.0 110.831 179.869 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.8 t -132.58 157.43 44.76 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.216 -0.927 . . . . 0.0 110.241 -179.972 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.7 mtt85 -143.63 -177.5 5.43 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.288 -0.882 . . . . 0.0 110.359 -179.982 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.21 132.05 56.77 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.234 -0.916 . . . . 0.0 110.106 179.902 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.5 p -134.13 -175.39 3.84 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.165 -0.96 . . . . 0.0 110.288 -179.865 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 24.2 tptt -138.88 107.0 7.49 Favored Pre-proline 0 N--CA 1.494 1.759 0 O-C-N 121.272 -0.893 . . . . 0.0 110.193 -179.96 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.38 157.98 52.28 Favored 'Trans proline' 0 C--N 1.319 -1.016 0 O-C-N 123.186 1.098 . . . . 0.0 110.746 179.969 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.441 ' HB3' ' CE3' ' A' ' 80' ' ' TRP . . . -108.47 153.46 42.07 Favored Pre-proline 0 N--CA 1.498 1.966 0 O-C-N 121.484 -0.76 . . . . 0.0 109.906 179.754 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -69.67 164.79 33.12 Favored 'Trans proline' 0 C--N 1.316 -1.134 0 O-C-N 123.377 1.199 . . . . 0.0 110.869 -179.682 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -47.66 -32.48 5.71 Favored 'General case' 0 N--CA 1.516 2.844 0 O-C-N 121.435 -0.791 . . . . 0.0 111.493 -179.743 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.61 -35.39 51.78 Favored Glycine 0 N--CA 1.498 2.812 0 N-CA-C 110.373 -1.091 . . . . 0.0 110.373 179.771 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -55.75 -33.58 64.42 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 120.948 -1.324 . . . . 0.0 110.681 179.713 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -54.99 -38.45 67.87 Favored 'General case' 0 N--CA 1.513 2.676 0 O-C-N 120.993 -1.067 . . . . 0.0 110.106 179.807 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.2 mmtm -58.81 -35.52 73.0 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.359 -0.838 . . . . 0.0 110.192 179.44 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 3.2 pt -116.73 36.13 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.135 -0.978 . . . . 0.0 110.616 179.732 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 3.5 tmtt? -82.53 -43.38 0.95 Allowed Pre-proline 0 N--CA 1.509 2.484 0 O-C-N 121.003 -1.06 . . . . 0.0 112.941 -179.43 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 48.8 Cg_endo -76.95 -36.58 1.4 Allowed 'Trans proline' 0 N--CA 1.486 1.08 0 O-C-N 122.639 0.81 . . . . 0.0 111.527 -178.561 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.453 ' CG2' ' CE2' ' A' ' 62' ' ' TYR . 91.1 m -59.37 -43.45 92.87 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 120.932 -1.105 . . . . 0.0 110.083 -179.664 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.415 HD23 ' CE2' ' A' ' 86' ' ' TYR . 1.0 OUTLIER -61.26 -36.33 79.7 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.263 -0.898 . . . . 0.0 110.021 179.642 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.45 -36.52 73.81 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 120.92 -1.112 . . . . 0.0 110.176 179.472 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -58.1 -34.31 70.06 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.049 -1.032 . . . . 0.0 110.379 179.601 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.497 ' CE2' HD13 ' A' ' 55' ' ' LEU . 8.8 m-85 -56.65 -42.49 79.01 Favored 'General case' 0 N--CA 1.512 2.65 0 O-C-N 120.911 -1.118 . . . . 0.0 110.008 179.54 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -57.81 -26.53 62.11 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.367 -0.933 . . . . 0.0 110.453 179.274 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 13.1 mm -67.12 -51.08 57.62 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.291 0 O-C-N 120.945 -1.097 . . . . 0.0 108.485 179.225 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.4 tp60 -64.23 -52.02 60.8 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.227 -0.92 . . . . 0.0 108.546 178.852 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.1 tp -57.03 -36.89 71.0 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.24 -0.913 . . . . 0.0 109.64 178.905 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -57.38 -37.62 72.95 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.084 -1.01 . . . . 0.0 110.123 179.784 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.61 -50.14 72.45 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.11 -0.993 . . . . 0.0 109.517 179.803 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.421 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -68.14 -42.86 79.49 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 119.016 -1.074 . . . . 0.0 108.89 178.96 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -61.3 -32.11 71.96 Favored 'General case' 0 N--CA 1.504 2.266 0 C-N-CA 119.576 -0.849 . . . . 0.0 110.213 179.374 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.5 mmpt? -96.28 -20.46 18.51 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 120.975 -1.078 . . . . 0.0 111.71 -179.96 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -53.48 -35.13 60.24 Favored 'General case' 0 N--CA 1.513 2.681 0 O-C-N 120.672 -1.268 . . . . 0.0 110.534 -179.966 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.8 tttp -53.71 -47.31 70.64 Favored 'General case' 0 N--CA 1.512 2.661 0 O-C-N 121.091 -1.005 . . . . 0.0 110.378 -179.997 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 52.31 -165.59 0.06 Allowed 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.097 -1.002 . . . . 0.0 110.895 179.908 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.51 -47.73 4.18 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.177 -0.952 . . . . 0.0 110.389 179.965 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.81 83.7 1.84 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.177 -0.952 . . . . 0.0 109.902 179.83 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.4 tp -148.41 -57.37 0.22 Allowed 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.215 -0.928 . . . . 0.0 110.731 -179.9 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 54.91 176.87 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.014 -1.053 . . . . 0.0 110.593 -179.93 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . 58.9 162.25 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.15 -0.968 . . . . 0.0 110.355 -179.879 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.2 mttp 51.28 66.07 1.3 Allowed 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.886 -1.134 . . . . 0.0 110.709 -179.8 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 63.2 m -110.9 -53.24 2.72 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.199 -0.938 . . . . 0.0 110.482 -179.92 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.408 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 18.0 m120 -57.29 -40.96 78.87 Favored 'General case' 0 N--CA 1.51 2.561 0 O-C-N 121.205 -0.934 . . . . 0.0 109.844 179.838 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -59.94 -38.67 83.09 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.219 -0.926 . . . . 0.0 109.941 179.62 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.405 ' HG2' ' CA ' ' A' ' 33' ' ' ALA . 0.5 OUTLIER -59.47 -40.23 86.25 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.17 -0.956 . . . . 0.0 110.265 179.985 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 91.4 mt -74.8 -31.69 61.79 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.227 -0.921 . . . . 0.0 110.716 -179.929 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.418 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 40.2 m0 -57.98 -39.69 78.81 Favored 'General case' 0 N--CA 1.512 2.67 0 O-C-N 120.842 -1.161 . . . . 0.0 109.245 179.134 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.0 -34.74 78.4 Favored 'General case' 0 N--CA 1.499 1.985 0 C-N-CA 119.046 -1.062 . . . . 0.0 108.807 177.626 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.421 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 5.1 mt -71.74 -56.75 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.175 0 O-C-N 121.114 -0.991 . . . . 0.0 109.358 179.106 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -58.22 -25.88 62.18 Favored 'General case' 0 N--CA 1.512 2.633 0 C-N-CA 118.208 -1.397 . . . . 0.0 109.884 178.72 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.5 mt-30 -62.17 -37.14 84.11 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.874 -1.141 . . . . 0.0 109.376 178.165 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.497 HD13 ' CE2' ' A' ' 26' ' ' PHE . 1.0 OUTLIER -53.76 -35.67 61.52 Favored 'General case' 0 N--CA 1.513 2.683 0 O-C-N 120.933 -1.105 . . . . 0.0 109.73 179.099 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.441 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 33.5 t60 -51.51 -36.86 46.49 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.039 -1.038 . . . . 0.0 110.449 179.975 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.453 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 15.3 m170 -71.2 -46.77 60.54 Favored 'General case' 0 N--CA 1.505 2.29 0 C-N-CA 119.225 -0.99 . . . . 0.0 109.088 179.222 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.425 ' HB3' ' CE2' ' A' ' 26' ' ' PHE . 5.6 tt0 -63.2 -35.4 80.18 Favored 'General case' 0 N--CA 1.505 2.284 0 C-N-CA 119.249 -0.98 . . . . 0.0 109.41 178.696 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.447 ' CD ' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -68.26 -48.91 63.79 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.138 -0.976 . . . . 0.0 109.292 179.259 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.4 p -63.86 -38.53 91.43 Favored 'General case' 0 N--CA 1.503 2.198 0 C-N-CA 119.356 -0.938 . . . . 0.0 109.231 179.161 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.416 ' O ' ' OG1' ' A' ' 65' ' ' THR . 5.1 ttt-85 -65.73 -42.04 91.52 Favored 'General case' 0 N--CA 1.504 2.275 0 C-N-CA 119.246 -0.982 . . . . 0.0 109.106 179.125 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.453 ' CE2' ' CG2' ' A' ' 22' ' ' THR . 54.4 t80 -62.8 -48.75 77.75 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.189 -0.944 . . . . 0.0 109.357 179.377 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.434 HG22 HD12 ' A' ' 63' ' ' ILE . 89.6 mt -71.02 -39.94 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.328 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.245 179.574 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 10.3 t80 -65.3 -42.12 93.37 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.245 -0.91 . . . . 0.0 108.839 179.027 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.416 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 92.0 m -61.27 -41.83 97.6 Favored 'General case' 0 N--CA 1.502 2.135 0 C-N-CA 119.283 -0.967 . . . . 0.0 110.54 -179.614 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.4 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.6 pp -83.09 -32.35 26.82 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 118.811 -1.156 . . . . 0.0 112.323 -178.944 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -86.44 -32.53 20.81 Favored 'General case' 0 N--CA 1.511 2.591 0 O-C-N 120.708 -1.245 . . . . 0.0 111.781 -179.454 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -98.42 -25.38 14.82 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 120.716 -1.24 . . . . 0.0 112.525 -178.661 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 63.3 mttt -108.55 -57.52 2.12 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.596 -1.315 . . . . 0.0 110.717 179.968 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 28.4 ttt-85 -72.92 -30.22 63.73 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.242 -0.911 . . . . 0.0 111.009 -179.388 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.5 mttp 56.62 42.39 27.14 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.743 -1.223 . . . . 0.0 110.041 -179.468 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -108.84 34.18 3.83 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.423 -0.798 . . . . 0.0 109.845 179.119 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.489 HG23 HD12 ' A' ' 73' ' ' ILE . 13.9 tt -149.21 162.84 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.17 -0.956 . . . . 0.0 109.58 -179.938 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 62.0 m -107.44 144.24 34.64 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.013 -1.054 . . . . 0.0 110.378 179.972 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -45.24 -32.71 2.03 Favored 'General case' 0 N--CA 1.515 2.805 0 O-C-N 121.353 -0.842 . . . . 0.0 111.562 179.988 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -61.82 -51.09 69.66 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 120.908 -1.12 . . . . 0.0 109.19 179.329 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 37.2 tp -66.13 -43.85 85.91 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.186 -1.006 . . . . 0.0 108.322 178.637 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.421 ' CE1' HD13 ' A' ' 82' ' ' ILE . 15.5 t80 -58.98 -41.45 87.58 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.359 -0.838 . . . . 0.0 109.173 178.956 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -72.32 -42.3 65.59 Favored 'General case' 0 N--CA 1.504 2.271 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 178.222 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.441 ' CE3' ' HB3' ' A' ' 12' ' ' ALA . 86.5 t90 -56.12 -36.78 68.6 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.231 -0.918 . . . . 0.0 109.359 178.464 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.446 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 11.1 mt -66.59 -59.56 3.51 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.232 -0.917 . . . . 0.0 108.769 178.927 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.421 HD13 ' CE1' ' A' ' 78' ' ' TYR . 2.5 mt -56.27 -27.73 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.584 0 O-C-N 120.907 -1.12 . . . . 0.0 109.927 179.352 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 56.1 tttt -81.5 -21.02 38.91 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.896 -1.127 . . . . 0.0 110.971 178.579 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.422 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 20.3 mm-40 -105.44 22.72 14.96 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.809 -1.182 . . . . 0.0 111.979 179.91 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.416 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 4.2 tmtt? 77.3 67.73 0.05 OUTLIER 'General case' 0 N--CA 1.515 2.811 0 O-C-N 121.207 -0.933 . . . . 0.0 112.075 179.167 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.446 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 20.8 m-85 -130.28 -62.59 0.93 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.409 -0.807 . . . . 0.0 108.938 178.839 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -131.26 167.62 18.9 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.406 -0.809 . . . . 0.0 109.581 179.463 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.441 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 13.3 t0 -120.13 114.6 22.2 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.187 -0.945 . . . . 0.0 110.338 179.897 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -58.1 -38.16 75.93 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.24 -0.912 . . . . 0.0 110.028 179.803 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.5 tp -58.69 -38.19 77.72 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.211 -0.931 . . . . 0.0 110.144 179.842 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.419 ' HG ' ' CZ3' ' A' ' 95' ' ' TRP . 62.8 tp -69.42 -52.34 27.83 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.007 -1.058 . . . . 0.0 108.854 179.41 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.429 HG23 HD12 ' A' ' 92' ' ' ILE . 69.0 mt -60.33 -32.7 51.57 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 C-N-CA 119.249 -0.98 . . . . 0.0 108.978 178.33 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.42 -49.27 67.32 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 120.989 -1.069 . . . . 0.0 109.267 178.826 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.4 ' CD ' ' CD2' ' A' ' 106' ' ' LEU . 11.2 mttp -56.55 -42.11 77.97 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.004 -1.06 . . . . 0.0 109.618 179.243 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.419 ' CZ3' ' HG ' ' A' ' 91' ' ' LEU . 3.8 m0 -62.17 -30.99 71.44 Favored 'General case' 0 N--CA 1.504 2.273 0 C-N-CA 119.142 -1.023 . . . . 0.0 109.634 178.682 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.15 22.58 10.23 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 120.953 -1.092 . . . . 0.0 111.117 179.048 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.428 ' HB2' ' CD2' ' A' ' 100' ' ' TYR . 8.0 mmtp -102.17 -174.06 2.49 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 120.686 -1.259 . . . . 0.0 109.628 179.052 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 56.5 m -102.57 127.43 49.65 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.112 -0.992 . . . . 0.0 109.678 179.244 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.69 9.22 50.37 Favored Glycine 0 N--CA 1.493 2.454 0 C-N-CA 120.187 -1.006 . . . . 0.0 111.038 -179.218 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.428 ' CD2' ' HB2' ' A' ' 97' ' ' LYS . 44.6 m-85 -111.15 48.87 0.91 Allowed 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 119.598 1.699 . . . . 0.0 110.219 179.744 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -59.52 -38.48 81.1 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.112 -0.992 . . . . 0.0 109.988 179.862 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -122.06 121.25 36.56 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.18 -0.95 . . . . 0.0 110.202 -179.966 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 9.7 tp -153.74 131.3 11.42 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.185 -0.947 . . . . 0.0 110.259 -179.674 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.453 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.4 p -108.98 -37.06 5.93 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.228 -0.92 . . . . 0.0 112.227 179.988 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.587 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.3 m -140.97 -168.62 2.64 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.216 -1.552 . . . . 0.0 110.118 178.943 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.4 ' CD2' ' CD ' ' A' ' 94' ' ' LYS . 15.8 mt -97.18 -38.44 9.71 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.97 -1.082 . . . . 0.0 110.368 179.298 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 1.1 ttt85 -101.71 31.57 3.77 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.954 -1.091 . . . . 0.0 109.612 178.195 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.587 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.305 1.7 t -127.72 16.13 6.94 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.123 -0.986 . . . . 0.0 109.021 -179.344 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.403 ' CG2' ' O ' ' A' ' 108' ' ' CYS . 1.1 pt -158.88 38.41 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.369 0 O-C-N 120.937 -1.102 . . . . 0.0 110.423 -178.953 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.426 ' O ' ' OG1' ' A' ' 119' ' ' THR . 4.2 tt0 -107.49 109.14 20.75 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 120.838 -1.164 . . . . 0.0 111.314 -178.625 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.44 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 14.3 ttmt -111.75 -55.14 2.54 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.332 -0.855 . . . . 0.0 110.114 179.473 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 9.1 t30 53.04 -170.05 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.028 -1.045 . . . . 0.0 110.85 179.951 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -116.48 93.35 4.18 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.226 -0.921 . . . . 0.0 110.071 179.895 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -142.4 -174.04 4.02 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.3 -0.875 . . . . 0.0 110.094 -179.867 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.44 -43.21 7.74 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.213 -0.929 . . . . 0.0 109.915 179.648 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -127.46 49.44 2.11 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.19 -0.944 . . . . 0.0 110.009 179.728 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -65.32 -164.01 1.06 Allowed Glycine 0 N--CA 1.493 2.494 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.927 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 47.2 m -144.15 101.27 3.69 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.233 -1.157 . . . . 0.0 110.366 -179.933 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.44 ' OG1' ' HA ' ' A' ' 111' ' ' LYS . 1.1 m -119.27 172.9 7.27 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.251 -0.906 . . . . 0.0 110.123 179.749 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 47.2 t -103.93 155.05 18.95 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.361 -0.837 . . . . 0.0 109.113 178.889 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.465 HG21 HD12 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -71.72 -36.19 58.16 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.372 0 O-C-N 121.056 -1.027 . . . . 0.0 110.77 -179.344 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.473 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.4 p -54.58 -32.55 58.79 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 120.772 -1.205 . . . . 0.0 110.9 -179.108 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 6.7 ttt-85 -58.75 -35.02 72.07 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 120.974 -1.079 . . . . 0.0 109.409 178.123 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 47.3 t -81.39 125.5 78.71 Favored Pre-proline 0 N--CA 1.504 2.253 0 O-C-N 121.282 -0.886 . . . . 0.0 109.669 179.539 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.01 177.93 2.71 Favored 'Trans proline' 0 N--CA 1.489 1.242 0 O-C-N 123.126 1.067 . . . . 0.0 110.698 179.807 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -75.18 -37.78 61.09 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.23 -0.919 . . . . 0.0 110.548 -179.766 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.51 -41.72 86.06 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.062 -1.024 . . . . 0.0 109.967 -179.804 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -68.6 -41.36 79.71 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.22 -0.925 . . . . 0.0 109.209 179.307 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 3.5 mt -64.29 -38.78 92.24 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.265 -0.897 . . . . 0.0 109.651 179.278 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -61.65 -40.56 95.35 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.123 -0.986 . . . . 0.0 109.721 179.802 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -60.42 -39.13 86.33 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.214 -0.929 . . . . 0.0 110.099 179.848 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -59.9 -41.07 90.84 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.232 -0.917 . . . . 0.0 110.038 -179.985 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.0 -45.17 94.8 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.186 -0.946 . . . . 0.0 109.91 179.911 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 3.5 ttt85 -59.33 -38.49 80.46 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.131 -0.98 . . . . 0.0 109.867 179.46 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -58.54 -35.62 72.6 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.223 -0.923 . . . . 0.0 110.509 179.859 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 13.9 mttp -105.37 18.24 22.6 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 120.98 -1.075 . . . . 0.0 111.908 -179.959 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 56.17 44.95 88.77 Favored Glycine 0 N--CA 1.498 2.775 0 O-C-N 120.601 -1.312 . . . . 0.0 110.312 179.374 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.2 t -136.89 -163.0 1.35 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.131 -1.217 . . . . 0.0 109.967 179.848 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -137.12 146.09 44.64 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.075 -1.015 . . . . 0.0 110.276 -179.957 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.7 p -132.79 161.38 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.226 -0.921 . . . . 0.0 110.117 -179.954 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 42.2 t -167.36 82.1 0.21 Allowed 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.212 -0.93 . . . . 0.0 111.041 179.943 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.473 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 44.7 t80 -94.42 161.45 14.23 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.253 -0.904 . . . . 0.0 110.337 179.997 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 -140.67 -60.71 0.51 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.534 -0.728 . . . . 0.0 109.098 179.124 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -131.15 151.56 51.32 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.427 -0.796 . . . . 0.0 109.055 178.871 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 28.1 p -96.73 154.79 17.08 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 121.052 -1.03 . . . . 0.0 110.957 -179.698 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.1 m -73.89 -25.68 20.61 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.464 0 O-C-N 121.382 -0.824 . . . . 0.0 111.813 -179.218 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -49.99 -51.66 39.97 Favored 'General case' 0 N--CA 1.516 2.829 0 O-C-N 120.839 -1.163 . . . . 0.0 110.268 -179.768 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.418 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 28.1 p -134.87 -165.53 1.68 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.198 -0.938 . . . . 0.0 110.606 179.832 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -99.17 58.08 0.87 Allowed Glycine 0 N--CA 1.493 2.441 0 N-CA-C 108.013 -2.035 . . . . 0.0 108.013 178.492 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 27.8 t -103.06 144.05 31.79 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.339 -1.095 . . . . 0.0 109.988 -179.196 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 74.7 mtt85 -99.06 49.02 0.95 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.331 -0.855 . . . . 0.0 109.629 179.298 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.94 98.58 0.05 OUTLIER Glycine 0 N--CA 1.488 2.133 0 N-CA-C 109.866 -1.294 . . . . 0.0 109.866 179.938 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.5 p -111.98 128.01 56.04 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.302 -1.116 . . . . 0.0 110.237 179.652 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -141.87 146.12 35.41 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.014 -1.054 . . . . 0.0 110.005 -179.626 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -109.21 -57.76 2.12 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.269 -0.894 . . . . 0.0 110.203 -179.901 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 7.5 t -147.28 49.91 1.09 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.286 -0.884 . . . . 0.0 110.439 -179.911 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 . . . . . 0 N--CA 1.494 1.756 0 CA-C-O 117.98 -1.01 . . . . 0.0 110.231 -179.935 . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.249 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 69.89 50.85 27.18 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 109.45 -1.46 . . . . 0.0 109.45 179.968 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.2 m -139.03 93.45 10.37 Favored Pre-proline 0 N--CA 1.494 1.756 0 O-C-N 121.201 -1.176 . . . . 0.0 110.243 -179.991 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.42 154.22 55.69 Favored 'Trans proline' 0 C--N 1.317 -1.096 0 O-C-N 123.469 1.247 . . . . 0.0 110.502 -179.946 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -120.37 78.72 1.39 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.146 -0.971 . . . . 0.0 110.212 -179.978 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 55.0 mt -124.71 96.23 3.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.164 -0.96 . . . . 0.0 110.064 -179.964 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.0 mtmt 52.13 -177.14 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.982 -1.074 . . . . 0.0 110.866 179.897 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.8 p -119.53 160.75 21.8 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.232 -0.917 . . . . 0.0 110.18 179.964 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.4 mtt-85 -135.55 152.39 51.24 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.219 -0.925 . . . . 0.0 110.245 -179.983 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 31.0 mtt-85 -119.26 171.17 8.49 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.244 -0.91 . . . . 0.0 110.138 179.941 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -144.77 164.96 29.45 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.246 -0.909 . . . . 0.0 110.314 -179.941 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.5 mmmm -118.08 80.88 15.59 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.142 -0.974 . . . . 0.0 110.205 179.908 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.89 161.3 44.03 Favored 'Trans proline' 0 C--N 1.317 -1.12 0 O-C-N 123.456 1.24 . . . . 0.0 110.741 -179.922 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.444 ' HB3' ' CH2' ' A' ' 80' ' ' TRP . . . -76.95 135.34 67.35 Favored Pre-proline 0 N--CA 1.507 2.4 0 C-N-CA 119.662 -0.815 . . . . 0.0 109.229 179.492 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -76.22 79.14 3.02 Favored 'Trans proline' 0 N--CA 1.487 1.089 0 O-C-N 123.251 1.132 . . . . 0.0 112.168 -178.299 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.9 t70 48.04 90.05 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.332 -0.855 . . . . 0.0 111.826 178.397 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 164.23 -42.19 0.31 Allowed Glycine 0 N--CA 1.501 2.969 0 C-N-CA 119.782 -1.199 . . . . 0.0 110.641 179.58 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -55.07 -29.4 57.45 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.183 -1.186 . . . . 0.0 110.801 179.872 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -54.52 -37.81 65.79 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 120.92 -1.113 . . . . 0.0 110.18 179.596 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.08 -35.04 70.82 Favored 'General case' 0 N--CA 1.511 2.585 0 O-C-N 121.231 -0.918 . . . . 0.0 110.376 179.425 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.1 pt -124.4 36.82 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 121.173 -0.954 . . . . 0.0 110.325 179.835 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -83.81 -42.69 0.79 Allowed Pre-proline 0 N--CA 1.509 2.507 0 O-C-N 121.128 -0.982 . . . . 0.0 113.474 -179.168 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.0 Cg_endo -74.41 -33.8 5.14 Favored 'Trans proline' 0 N--CA 1.488 1.166 0 O-C-N 122.623 0.802 . . . . 0.0 112.04 -177.978 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 93.2 m -58.73 -41.46 86.45 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.791 -1.193 . . . . 0.0 110.044 -179.814 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.429 HD21 ' CE2' ' A' ' 86' ' ' TYR . 0.3 OUTLIER -62.22 -37.27 84.7 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.26 -0.9 . . . . 0.0 110.109 179.636 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -57.43 -37.06 72.18 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 120.964 -1.085 . . . . 0.0 110.22 179.809 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -59.91 -35.38 74.74 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.105 -0.997 . . . . 0.0 110.198 179.592 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.492 ' CE2' HD12 ' A' ' 55' ' ' LEU . 6.9 m-85 -57.37 -43.53 83.64 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 120.987 -1.07 . . . . 0.0 110.071 179.355 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -57.49 -26.55 61.46 Favored 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 119.264 -0.974 . . . . 0.0 110.45 179.259 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.6 mm -65.15 -49.63 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.325 0 O-C-N 120.987 -1.07 . . . . 0.0 109.05 179.402 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -66.96 -52.01 48.12 Favored 'General case' 0 N--CA 1.505 2.323 0 C-N-CA 119.201 -1.0 . . . . 0.0 108.61 179.042 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.403 ' CD2' ' CG2' ' A' ' 52' ' ' ILE . 0.1 OUTLIER -57.84 -33.25 68.44 Favored 'General case' 0 N--CA 1.51 2.552 0 C-N-CA 119.331 -0.948 . . . . 0.0 109.738 178.802 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.27 -44.9 96.47 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 120.877 -1.139 . . . . 0.0 110.0 179.875 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.34 -43.33 96.56 Favored 'General case' 0 N--CA 1.508 2.468 0 C-N-CA 119.218 -0.993 . . . . 0.0 109.884 -179.629 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.421 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -71.79 -41.69 68.0 Favored 'General case' 0 N--CA 1.503 2.218 0 C-N-CA 119.247 -0.981 . . . . 0.0 109.093 178.954 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -62.48 -32.72 73.66 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.288 -0.883 . . . . 0.0 110.28 179.474 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.4 mmtt -94.96 -38.37 10.72 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 120.896 -1.128 . . . . 0.0 110.723 179.906 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -58.21 -39.64 79.55 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.055 -1.028 . . . . 0.0 109.984 179.836 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.52 -50.34 73.94 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.195 -0.941 . . . . 0.0 109.789 179.736 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.3 t 50.83 -169.22 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.109 0 O-C-N 120.975 -1.078 . . . . 0.0 111.051 179.832 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.2 p -114.77 152.92 31.27 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.244 -0.91 . . . . 0.0 109.837 179.825 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.1 ttpt 53.28 48.69 21.49 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.019 -1.051 . . . . 0.0 110.545 -179.831 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.8 tp -132.29 77.13 1.74 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.18 -0.95 . . . . 0.0 110.068 -179.925 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.75 104.99 0.17 Allowed 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.151 -0.968 . . . . 0.0 110.361 -179.707 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -169.91 -165.95 0.53 Allowed 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.234 -0.916 . . . . 0.0 110.823 -179.987 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.0 mttt -59.86 89.82 0.02 OUTLIER 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.144 -0.972 . . . . 0.0 109.871 179.791 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.1 m -102.63 -50.24 3.62 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.25 -0.906 . . . . 0.0 110.005 179.788 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.403 ' O ' ' CG ' ' A' ' 50' ' ' TRP . 68.5 m-20 -58.51 -39.02 78.93 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.206 -0.934 . . . . 0.0 109.856 179.483 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -66.32 -45.64 79.57 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.164 -0.96 . . . . 0.0 109.333 179.344 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 49.2 tp60 -66.78 -41.66 87.29 Favored 'General case' 0 N--CA 1.505 2.296 0 C-N-CA 119.341 -0.943 . . . . 0.0 109.015 179.048 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -61.0 -37.33 82.15 Favored 'General case' 0 N--CA 1.506 2.332 0 C-N-CA 119.506 -0.878 . . . . 0.0 109.78 179.318 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.426 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.4 m0 -58.6 -35.95 73.24 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.947 -1.096 . . . . 0.0 110.259 179.712 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -63.92 -29.49 70.66 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.022 -1.049 . . . . 0.0 109.87 178.513 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.421 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 68.1 mt -71.88 -57.9 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.279 0 O-C-N 120.92 -1.112 . . . . 0.0 109.564 179.542 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 ptm -57.93 -26.65 62.52 Favored 'General case' 0 N--CA 1.511 2.602 0 C-N-CA 118.284 -1.366 . . . . 0.0 109.796 178.769 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -62.39 -35.97 80.85 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 120.812 -1.18 . . . . 0.0 109.503 178.19 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.492 HD12 ' CE2' ' A' ' 26' ' ' PHE . 0.5 OUTLIER -53.64 -36.51 62.15 Favored 'General case' 0 N--CA 1.513 2.695 0 O-C-N 120.868 -1.145 . . . . 0.0 109.869 179.378 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.43 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 22.4 t60 -53.14 -38.42 62.69 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.917 -1.114 . . . . 0.0 110.427 -179.684 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.44 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 5.5 m170 -67.48 -54.79 17.14 Favored 'General case' 0 N--CA 1.506 2.338 0 C-N-CA 119.207 -0.997 . . . . 0.0 109.318 179.369 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.432 ' HB3' ' CE2' ' A' ' 26' ' ' PHE . 13.7 tt0 -56.76 -32.93 66.1 Favored 'General case' 0 N--CA 1.507 2.381 0 C-N-CA 119.404 -0.918 . . . . 0.0 109.726 178.975 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.409 ' HG3' ' CE2' ' A' ' 26' ' ' PHE . 0.4 OUTLIER -67.18 -52.42 41.54 Favored 'General case' 0 N--CA 1.509 2.475 0 O-C-N 120.965 -1.084 . . . . 0.0 109.184 178.834 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.8 p -63.31 -37.63 88.0 Favored 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 119.253 -0.979 . . . . 0.0 109.318 178.997 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.422 ' O ' ' OG1' ' A' ' 65' ' ' THR . 48.6 ttt85 -65.06 -39.33 93.12 Favored 'General case' 0 N--CA 1.505 2.289 0 C-N-CA 119.251 -0.98 . . . . 0.0 109.355 179.053 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 35.7 t80 -62.27 -50.51 71.41 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.013 -1.054 . . . . 0.0 109.375 179.441 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.43 HG21 HD12 ' A' ' 63' ' ' ILE . 86.8 mt -71.8 -40.33 69.2 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.34 0 O-C-N 121.188 -0.945 . . . . 0.0 109.232 179.28 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -64.08 -42.59 96.9 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.157 -0.964 . . . . 0.0 109.123 179.272 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.422 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 94.0 m -61.67 -42.28 98.7 Favored 'General case' 0 N--CA 1.501 2.116 0 C-N-CA 119.3 -0.96 . . . . 0.0 110.297 -179.642 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.404 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.6 pp -83.25 -31.85 26.76 Favored 'General case' 0 N--CA 1.504 2.267 0 C-N-CA 118.828 -1.149 . . . . 0.0 112.485 -179.022 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 66.8 t80 -86.24 -33.16 20.8 Favored 'General case' 0 N--CA 1.514 2.732 0 O-C-N 120.659 -1.275 . . . . 0.0 111.71 -179.508 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -98.37 -18.95 18.03 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 120.813 -1.179 . . . . 0.0 112.726 -178.662 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 5.6 mttt -120.97 -59.32 1.74 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 120.439 -1.413 . . . . 0.0 110.944 179.844 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.1 -30.76 71.85 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.124 -0.985 . . . . 0.0 110.763 -179.648 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 42.0 tttt 57.68 42.35 23.95 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 120.751 -1.218 . . . . 0.0 110.062 -179.554 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -111.9 35.12 3.83 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.406 -0.809 . . . . 0.0 109.879 179.285 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.404 ' CG2' ' CD1' ' A' ' 66' ' ' LEU . 14.0 tt -154.17 162.48 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 O-C-N 121.234 -0.916 . . . . 0.0 109.895 179.969 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 43.5 m -107.6 145.08 33.75 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.137 -0.977 . . . . 0.0 110.301 179.863 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -46.71 -30.6 2.46 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.293 -0.879 . . . . 0.0 111.772 179.95 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.44 -50.46 73.5 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.781 -1.199 . . . . 0.0 109.462 179.677 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 24.5 tp -69.26 -44.02 72.76 Favored 'General case' 0 N--CA 1.505 2.277 0 C-N-CA 118.918 -1.113 . . . . 0.0 108.232 178.637 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -57.41 -38.6 74.59 Favored 'General case' 0 N--CA 1.509 2.475 0 C-N-CA 119.547 -0.861 . . . . 0.0 109.228 178.662 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -74.99 -42.45 57.51 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 177.925 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.444 ' CH2' ' HB3' ' A' ' 12' ' ' ALA . 81.4 t90 -55.44 -37.86 68.27 Favored 'General case' 0 N--CA 1.511 2.596 0 O-C-N 121.27 -0.894 . . . . 0.0 109.361 178.444 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.458 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 9.2 mt -68.32 -50.2 55.02 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.17 -0.956 . . . . 0.0 108.828 178.917 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.404 HG23 HD13 ' A' ' 82' ' ' ILE . 36.5 mm -56.4 -30.72 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.647 0 O-C-N 121.271 -0.893 . . . . 0.0 110.115 179.36 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 54.1 mttt -89.09 -22.17 23.03 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.932 -1.105 . . . . 0.0 111.753 -179.999 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.418 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 60.2 mm-40 -98.46 21.58 10.95 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 120.618 -1.301 . . . . 0.0 111.941 -179.97 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.6 tttm 74.39 74.1 0.11 Allowed 'General case' 0 N--CA 1.511 2.624 0 O-C-N 121.062 -1.024 . . . . 0.0 111.765 179.258 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.458 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 29.7 m-85 -133.22 -62.4 0.79 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.488 -0.757 . . . . 0.0 109.342 179.603 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -127.65 161.81 28.01 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.423 -0.798 . . . . 0.0 109.402 179.219 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.43 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 8.5 t0 -108.33 111.39 23.3 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.125 -0.984 . . . . 0.0 110.445 -179.853 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.0 mmtp -58.23 -36.81 73.73 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.313 -0.867 . . . . 0.0 110.109 179.707 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.1 tp -58.2 -38.64 77.14 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.075 -1.016 . . . . 0.0 110.131 179.707 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.403 HD21 ' CD2' ' A' ' 57' ' ' HIS . 64.1 tp -70.24 -53.22 17.89 Favored 'General case' 0 N--CA 1.505 2.311 0 C-N-CA 119.196 -1.002 . . . . 0.0 108.751 179.284 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.412 HD13 HG21 ' A' ' 92' ' ' ILE . 54.8 mt -59.38 -31.33 46.19 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.47 0 C-N-CA 119.225 -0.99 . . . . 0.0 109.299 178.469 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.5 -45.57 83.03 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 120.962 -1.086 . . . . 0.0 109.733 179.219 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.415 ' CD ' ' CD2' ' A' ' 106' ' ' LEU . 7.2 mttp -60.89 -45.03 96.2 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.088 -1.007 . . . . 0.0 109.882 179.376 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.7 m0 -58.31 -37.6 75.4 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.987 -1.071 . . . . 0.0 109.843 179.366 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.09 -36.75 55.48 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.204 -0.935 . . . . 0.0 109.743 178.864 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 31.1 mmtt -54.36 -177.12 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.641 0 O-C-N 121.075 -1.016 . . . . 0.0 110.226 179.588 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 33.1 m -108.57 141.03 41.08 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.247 -0.908 . . . . 0.0 109.341 178.807 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 106.5 -29.72 10.57 Favored Glycine 0 N--CA 1.492 2.42 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 -178.987 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 51.9 m-85 -92.64 56.83 2.77 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 120.895 -1.356 . . . . 0.0 110.061 179.747 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -69.44 -39.42 77.82 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 120.939 -1.101 . . . . 0.0 109.707 179.649 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.56 81.54 1.74 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.234 -0.916 . . . . 0.0 110.094 179.923 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.2 tt -113.99 137.14 52.09 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.107 -0.996 . . . . 0.0 110.212 -179.983 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.44 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.0 p -105.56 -30.07 9.75 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.394 -0.816 . . . . 0.0 111.871 179.259 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.588 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 13.1 m -145.28 -168.03 2.84 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 120.323 -1.486 . . . . 0.0 109.444 178.813 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.415 ' CD2' ' CD ' ' A' ' 94' ' ' LYS . 15.1 mt -99.13 -37.03 9.49 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.119 -0.988 . . . . 0.0 110.492 178.898 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 1.8 ttt-85 -103.95 34.98 2.81 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.851 -1.156 . . . . 0.0 109.417 178.456 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.588 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.309 1.7 t -129.46 21.17 5.62 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -179.39 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.6 pt -156.73 37.08 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.282 0 O-C-N 120.953 -1.092 . . . . 0.0 110.634 -178.626 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.433 ' O ' ' OG1' ' A' ' 119' ' ' THR . 1.7 mt-30 -65.83 78.39 0.08 Allowed 'General case' 0 N--CA 1.514 2.745 0 O-C-N 120.858 -1.151 . . . . 0.0 110.833 -178.864 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.12 171.55 16.24 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.033 -1.042 . . . . 0.0 110.353 179.451 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -157.12 -58.71 0.09 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.133 -0.979 . . . . 0.0 110.772 179.954 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -161.99 -55.9 0.04 OUTLIER 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.144 -0.972 . . . . 0.0 110.939 -179.993 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -138.62 81.57 1.86 Allowed 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.329 -0.857 . . . . 0.0 110.174 179.972 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 23.3 m-80 -136.57 -59.85 0.71 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.203 -0.936 . . . . 0.0 110.158 179.94 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 4.0 m120 52.97 73.84 0.33 Allowed 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.072 -1.017 . . . . 0.0 110.803 179.953 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -139.44 -84.21 0.1 Allowed Glycine 0 N--CA 1.492 2.422 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 179.961 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 56.0 m -117.05 91.49 3.59 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.258 -1.142 . . . . 0.0 110.055 179.895 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.433 ' OG1' ' O ' ' A' ' 110' ' ' GLN . 4.0 m -139.14 166.97 23.13 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.26 -0.9 . . . . 0.0 110.372 -179.835 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 49.5 t -89.32 153.75 20.63 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.242 -0.911 . . . . 0.0 109.183 178.99 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.448 ' CG2' ' CE1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -74.12 -35.63 41.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 121.048 -1.032 . . . . 0.0 111.184 -178.898 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.486 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.7 p -56.05 -35.84 67.37 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.886 -1.134 . . . . 0.0 111.058 -178.613 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.82 -33.96 70.97 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.004 -1.06 . . . . 0.0 109.959 178.662 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 47.2 t -76.51 125.36 87.55 Favored Pre-proline 0 N--CA 1.505 2.28 0 O-C-N 121.065 -1.022 . . . . 0.0 110.077 179.957 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . 0.409 ' HB3' ' CB ' ' A' ' 154' ' ' ALA . 37.9 Cg_endo -65.04 175.64 3.69 Favored 'Trans proline' 0 N--CA 1.488 1.204 0 O-C-N 123.236 1.124 . . . . 0.0 110.801 179.428 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -75.02 -36.66 61.91 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.274 -0.891 . . . . 0.0 110.542 -179.977 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.29 -40.36 77.63 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.035 -1.04 . . . . 0.0 109.989 -179.935 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.21 -42.43 75.77 Favored 'General case' 0 N--CA 1.506 2.356 0 C-N-CA 119.358 -0.937 . . . . 0.0 109.169 179.313 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 3.5 mt -66.94 -39.68 87.38 Favored 'General case' 0 N--CA 1.505 2.279 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.342 178.989 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -60.51 -38.02 82.99 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.237 -0.915 . . . . 0.0 109.82 179.404 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -57.74 -37.0 72.83 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.17 -0.956 . . . . 0.0 110.372 179.787 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -63.57 -50.38 69.69 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.131 -0.981 . . . . 0.0 109.673 179.862 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.53 -38.35 87.1 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.186 -0.946 . . . . 0.0 109.991 179.745 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 5.1 ttt85 -68.96 -36.53 78.0 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 121.057 -1.027 . . . . 0.0 110.265 179.61 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -79.03 -33.83 44.43 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.01 -1.056 . . . . 0.0 110.587 179.861 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 23.1 mttt -83.97 -19.28 34.88 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.054 -1.029 . . . . 0.0 111.765 179.758 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.37 32.73 10.07 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 -179.502 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 7.8 t -135.88 -160.88 1.1 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.031 -1.276 . . . . 0.0 109.738 179.883 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -132.72 142.21 48.93 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.063 -1.023 . . . . 0.0 110.232 179.905 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.7 p -125.6 160.54 31.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 O-C-N 121.246 -0.909 . . . . 0.0 110.027 179.738 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 32.4 t -167.71 83.14 0.2 Allowed 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.223 -0.923 . . . . 0.0 111.277 -179.828 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.486 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 46.6 t80 -92.72 159.61 15.35 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.175 -0.953 . . . . 0.0 109.981 179.601 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 20.7 m170 -136.97 -61.31 0.67 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.434 -0.791 . . . . 0.0 109.136 179.245 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -135.63 151.65 50.46 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.48 -0.762 . . . . 0.0 109.227 178.988 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 29.8 p -92.85 154.05 18.47 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.107 -0.996 . . . . 0.0 110.877 -179.761 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 26.8 m -72.05 -25.63 24.02 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.533 0 O-C-N 121.422 -0.799 . . . . 0.0 111.481 -179.487 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -51.32 -55.14 19.98 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 120.811 -1.18 . . . . 0.0 109.94 -179.958 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.426 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 28.4 p -131.39 -170.15 2.32 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.235 -0.915 . . . . 0.0 110.583 179.571 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -97.7 58.44 1.09 Allowed Glycine 0 N--CA 1.492 2.425 0 N-CA-C 107.937 -2.065 . . . . 0.0 107.937 178.421 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 13.0 t -97.71 146.21 25.58 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.369 -1.077 . . . . 0.0 109.797 -179.157 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 14.9 mmt85 -98.16 50.29 1.01 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.287 -0.883 . . . . 0.0 109.503 179.123 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.95 98.0 0.03 OUTLIER Glycine 0 N--CA 1.486 2.008 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 -179.877 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.0 p -110.48 129.35 55.8 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.298 -1.119 . . . . 0.0 110.336 179.699 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . 0.409 ' CB ' ' HB3' ' A' ' 125' ' ' PRO . . . -143.08 145.75 33.16 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.05 -1.031 . . . . 0.0 110.046 -179.789 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -104.48 -48.38 3.83 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.159 -0.963 . . . . 0.0 110.62 -179.752 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.17 -39.92 70.08 Favored 'General case' 0 N--CA 1.511 2.62 0 O-C-N 120.994 -1.066 . . . . 0.0 110.517 -179.667 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 . . . . . 0 N--CA 1.494 1.768 0 CA-C-O 117.958 -1.02 . . . . 0.0 110.24 179.962 . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.343 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -90.21 131.65 10.86 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 -179.965 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.412 ' OG ' ' HD2' ' A' ' 2' ' ' PRO . 28.4 t -119.25 152.92 53.09 Favored Pre-proline 0 N--CA 1.494 1.746 0 O-C-N 121.209 -1.171 . . . . 0.0 110.183 179.93 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.412 ' HD2' ' OG ' ' A' ' 1' ' ' SER . 45.9 Cg_endo -72.22 115.2 4.23 Favored 'Trans proline' 0 C--N 1.316 -1.171 0 O-C-N 123.416 1.219 . . . . 0.0 110.44 -179.977 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -125.27 80.99 1.93 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.188 -0.945 . . . . 0.0 110.213 -179.989 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 82.4 mt -130.91 130.05 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 121.221 -0.925 . . . . 0.0 110.0 179.974 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 8.6 tptt -130.32 122.37 27.79 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.17 -0.956 . . . . 0.0 110.179 179.921 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 39.5 p -126.05 120.98 31.66 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.222 -0.924 . . . . 0.0 110.272 -179.994 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 34.6 mtt180 -134.26 -65.82 0.64 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.239 -0.913 . . . . 0.0 110.186 179.902 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.7 ttt85 -147.51 90.05 1.83 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.142 -0.974 . . . . 0.0 110.358 179.99 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.4 m -131.38 157.88 42.22 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.239 -0.913 . . . . 0.0 110.239 179.998 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.9 tttt -124.26 96.21 42.22 Favored Pre-proline 0 N--CA 1.494 1.73 0 O-C-N 121.253 -0.904 . . . . 0.0 110.273 -179.952 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.64 160.7 45.84 Favored 'Trans proline' 0 C--N 1.317 -1.129 0 O-C-N 123.464 1.244 . . . . 0.0 110.608 179.944 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.435 ' HB3' ' CE3' ' A' ' 80' ' ' TRP . . . -62.56 134.38 95.12 Favored Pre-proline 0 N--CA 1.511 2.579 0 C-N-CA 119.467 -0.893 . . . . 0.0 109.006 179.724 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -83.12 83.08 1.99 Allowed 'Trans proline' 0 C--N 1.318 -1.057 0 O-C-N 123.186 1.098 . . . . 0.0 112.434 -178.131 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 48.81 92.07 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.322 -0.862 . . . . 0.0 111.676 178.473 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.06 -39.58 0.46 Allowed Glycine 0 N--CA 1.5 2.95 0 C-N-CA 119.658 -1.258 . . . . 0.0 110.579 179.554 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -58.03 -31.47 67.02 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.073 -1.251 . . . . 0.0 110.509 179.812 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -52.69 -33.81 49.21 Favored 'General case' 0 N--CA 1.512 2.671 0 O-C-N 120.968 -1.083 . . . . 0.0 110.218 179.247 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 42.8 mmtt -58.4 -38.2 76.87 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.147 -0.971 . . . . 0.0 110.111 179.525 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 3.8 pt -116.65 36.94 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.213 -0.929 . . . . 0.0 110.499 179.727 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 1.4 tmtt? -84.1 -42.64 0.76 Allowed Pre-proline 0 N--CA 1.508 2.447 0 O-C-N 121.173 -0.954 . . . . 0.0 113.523 -178.941 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.6 Cg_endo -74.58 -36.88 2.63 Favored 'Trans proline' 0 N--CA 1.486 1.054 0 O-C-N 122.518 0.746 . . . . 0.0 111.967 -177.971 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.449 ' CG2' ' CE2' ' A' ' 62' ' ' TYR . 70.4 m -62.22 -48.0 81.91 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 120.96 -1.088 . . . . 0.0 109.786 -179.97 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.2 mt -60.09 -35.42 75.16 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.252 -0.905 . . . . 0.0 109.825 179.196 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 25.2 m -55.76 -36.91 67.84 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.026 -1.046 . . . . 0.0 110.11 179.324 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -57.47 -38.42 74.48 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.184 -0.948 . . . . 0.0 109.946 179.554 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.422 ' CE2' ' HG3' ' A' ' 59' ' ' ARG . 20.5 m-85 -59.34 -40.66 87.08 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.15 -0.969 . . . . 0.0 109.887 179.616 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -58.63 -25.27 62.52 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.299 -0.875 . . . . 0.0 111.321 -179.874 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 2.6 mp -79.0 -34.61 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.442 0 O-C-N 120.889 -1.132 . . . . 0.0 109.833 179.705 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -81.85 -36.72 27.95 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.007 -1.058 . . . . 0.0 109.109 178.554 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.9 -31.98 63.37 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.163 -0.96 . . . . 0.0 110.109 178.81 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.1 ptm180 -69.57 -36.49 76.34 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 120.799 -1.188 . . . . 0.0 109.753 179.354 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.49 -42.19 99.33 Favored 'General case' 0 N--CA 1.508 2.435 0 C-N-CA 119.043 -1.063 . . . . 0.0 109.123 179.316 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.413 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -69.7 -42.4 74.14 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.373 -0.931 . . . . 0.0 108.839 178.775 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 34.3 mm-40 -58.98 -35.02 72.51 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.308 -0.87 . . . . 0.0 110.138 179.436 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -90.04 -39.45 12.93 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 120.976 -1.077 . . . . 0.0 110.133 179.653 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -57.42 -35.2 69.76 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.2 -0.937 . . . . 0.0 110.308 179.639 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.418 ' HG3' ' OG ' ' A' ' 45' ' ' SER . 9.7 ttpp -84.94 -47.42 10.3 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.017 -1.052 . . . . 0.0 109.827 179.743 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.8 t 51.97 69.46 0.67 Allowed 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.163 -0.96 . . . . 0.0 111.014 179.755 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 51.62 -163.82 0.06 Allowed 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.921 -1.112 . . . . 0.0 110.679 179.774 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 16.5 mtpt -83.79 82.05 8.5 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.124 -0.985 . . . . 0.0 109.8 179.687 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.4 tt -113.37 -54.13 2.64 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.341 -0.849 . . . . 0.0 110.498 -179.778 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -110.96 -163.97 0.88 Allowed 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.136 -0.978 . . . . 0.0 110.122 179.983 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -100.25 -172.3 2.19 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.111 -0.993 . . . . 0.0 110.139 179.834 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.4 tttt 53.02 51.5 15.69 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 120.996 -1.065 . . . . 0.0 110.415 -179.756 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.418 ' OG ' ' HG3' ' A' ' 37' ' ' LYS . 28.3 t -96.69 -37.99 10.1 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.269 -0.894 . . . . 0.0 110.733 -179.933 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.403 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 15.1 m-80 -57.51 -40.62 79.09 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.073 -1.017 . . . . 0.0 109.954 179.918 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -61.23 -40.0 92.37 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.229 -0.92 . . . . 0.0 109.878 179.667 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 25.4 tp60 -68.13 -38.96 82.78 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.123 -0.986 . . . . 0.0 109.858 179.574 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 63.4 mt -70.19 -33.51 71.81 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.193 -0.942 . . . . 0.0 110.599 179.91 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.425 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.1 m0 -57.43 -40.89 79.37 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 120.865 -1.147 . . . . 0.0 109.85 179.824 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -63.18 -33.83 76.33 Favored 'General case' 0 N--CA 1.504 2.24 0 C-N-CA 119.177 -1.009 . . . . 0.0 109.481 178.413 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.413 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 76.1 mt -71.28 -56.04 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.217 0 O-C-N 121.059 -1.025 . . . . 0.0 109.218 179.323 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.3 ptm -63.21 -30.19 71.39 Favored 'General case' 0 N--CA 1.506 2.374 0 C-N-CA 118.547 -1.261 . . . . 0.0 109.883 178.816 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -66.6 -38.97 88.12 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 120.817 -1.177 . . . . 0.0 108.907 178.227 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.417 HD23 ' CE2' ' A' ' 26' ' ' PHE . 11.5 mt -53.63 -33.13 54.01 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 121.105 -0.997 . . . . 0.0 110.117 178.93 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.449 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 69.6 t60 -54.73 -37.9 66.46 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.048 -1.032 . . . . 0.0 109.973 179.668 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.434 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.0 m170 -60.89 -49.38 77.68 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.2 -0.938 . . . . 0.0 109.257 179.437 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.57 -36.21 77.93 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.386 -0.925 . . . . 0.0 109.374 178.74 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.422 ' HG3' ' CE2' ' A' ' 26' ' ' PHE . 0.5 OUTLIER -62.6 -49.76 73.96 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.139 -0.976 . . . . 0.0 109.299 179.229 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 92.3 p -64.65 -39.97 94.63 Favored 'General case' 0 N--CA 1.503 2.199 0 C-N-CA 119.222 -0.991 . . . . 0.0 108.982 179.175 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.428 ' O ' ' OG1' ' A' ' 65' ' ' THR . 2.1 ttp85 -63.18 -40.25 96.97 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.135 -0.978 . . . . 0.0 109.091 178.927 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.449 ' CE2' ' CG2' ' A' ' 22' ' ' THR . 43.6 t80 -64.15 -53.76 44.35 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.202 -0.937 . . . . 0.0 109.187 179.293 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.45 HG22 HD13 ' A' ' 63' ' ' ILE . 78.6 mt -66.28 -34.71 72.0 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 C-N-CA 119.163 -1.015 . . . . 0.0 109.36 179.292 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.436 ' CE2' ' CD2' ' A' ' 68' ' ' TYR . 12.4 t80 -68.87 -42.57 76.82 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.993 -1.067 . . . . 0.0 108.797 178.789 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.428 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 85.4 m -59.45 -39.28 83.08 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.219 -0.926 . . . . 0.0 110.615 -179.608 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.401 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.6 pp -83.02 -34.42 26.29 Favored 'General case' 0 N--CA 1.503 2.224 0 C-N-CA 118.596 -1.241 . . . . 0.0 112.114 -179.08 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.406 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 36.5 t80 -86.52 -32.09 20.92 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 120.705 -1.247 . . . . 0.0 111.948 -179.395 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.436 ' CD2' ' CE2' ' A' ' 64' ' ' TYR . 9.4 m-85 -98.39 -17.9 18.58 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.764 -1.21 . . . . 0.0 112.943 -178.495 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 21.0 mtpt -118.29 -57.16 2.1 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.433 -1.417 . . . . 0.0 110.846 -179.962 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 46.4 mtp180 -68.8 -29.25 67.57 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.177 -0.952 . . . . 0.0 110.964 -179.581 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.21 42.02 22.66 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 120.881 -1.137 . . . . 0.0 109.896 -179.425 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.86 35.25 3.97 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.453 -0.779 . . . . 0.0 109.927 179.286 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.442 HG22 HD13 ' A' ' 73' ' ' ILE . 13.4 tt -152.91 162.05 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.2 -0.937 . . . . 0.0 109.775 179.933 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -108.33 149.57 28.5 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.155 -0.966 . . . . 0.0 110.204 -179.916 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.2 ttpt -46.84 -32.23 3.59 Favored 'General case' 0 N--CA 1.514 2.763 0 O-C-N 121.314 -0.866 . . . . 0.0 111.426 179.992 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -64.24 -47.82 78.18 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 120.846 -1.159 . . . . 0.0 109.319 179.349 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.39 -41.01 85.67 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.186 -0.946 . . . . 0.0 108.749 178.869 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.426 ' CE1' ' CD1' ' A' ' 82' ' ' ILE . 13.2 t80 -66.33 -41.34 89.77 Favored 'General case' 0 N--CA 1.505 2.298 0 C-N-CA 119.565 -0.854 . . . . 0.0 109.263 179.027 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -72.9 -41.78 64.24 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.136 -0.978 . . . . 0.0 108.788 178.78 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.435 ' CE3' ' HB3' ' A' ' 12' ' ' ALA . 87.8 t90 -55.8 -37.37 68.53 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.158 -0.964 . . . . 0.0 109.31 178.803 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.451 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 17.2 mt -67.81 -59.76 3.05 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.136 -0.978 . . . . 0.0 108.627 178.869 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.426 ' CD1' ' CE1' ' A' ' 78' ' ' TYR . 3.8 mt -57.18 -26.91 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 O-C-N 120.924 -1.11 . . . . 0.0 110.026 179.306 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.2 tptm -80.19 -18.74 48.77 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 120.873 -1.142 . . . . 0.0 110.946 178.549 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.418 ' O ' ' CB ' ' A' ' 85' ' ' LYS . 11.0 mm-40 -109.24 23.89 13.87 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.66 -1.275 . . . . 0.0 112.0 179.982 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.418 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 15.0 tttm 77.17 68.35 0.05 Allowed 'General case' 0 N--CA 1.515 2.775 0 O-C-N 121.212 -0.93 . . . . 0.0 112.133 179.243 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.451 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 21.6 m-85 -130.53 -62.4 0.92 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.404 -0.81 . . . . 0.0 109.186 179.196 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -128.6 173.32 10.38 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.447 -0.783 . . . . 0.0 109.602 179.596 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.449 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 13.7 t0 -120.29 108.54 14.3 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.035 -1.041 . . . . 0.0 110.453 179.965 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 20.8 mtmt -58.84 -39.17 80.46 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.195 -0.941 . . . . 0.0 110.1 179.863 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 16.5 tp -59.61 -38.58 81.66 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.108 -0.995 . . . . 0.0 110.258 -179.831 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.42 HD23 ' CD2' ' A' ' 57' ' ' HIS . 53.6 tp -68.18 -48.76 64.41 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.191 -1.004 . . . . 0.0 109.184 179.482 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.404 HD12 HG21 ' A' ' 92' ' ' ILE . 70.8 mt -59.59 -37.91 72.89 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.495 0 O-C-N 121.126 -0.984 . . . . 0.0 108.838 178.658 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.76 -38.98 87.67 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.12 -0.988 . . . . 0.0 109.059 178.442 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.42 ' HE3' ' CZ ' ' A' ' 100' ' ' TYR . 9.6 mmtm -57.17 -42.97 82.12 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.116 -0.99 . . . . 0.0 109.493 179.34 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 2.4 m0 -63.52 -33.43 75.57 Favored 'General case' 0 N--CA 1.507 2.418 0 C-N-CA 119.583 -0.847 . . . . 0.0 110.316 179.576 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.8 -33.25 25.0 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.024 -1.048 . . . . 0.0 110.655 179.611 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.8 mmmt -51.31 176.93 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.761 0 O-C-N 120.857 -1.152 . . . . 0.0 110.831 179.907 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -103.5 140.81 37.01 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.196 -0.94 . . . . 0.0 109.321 179.163 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 102.48 -26.91 22.53 Favored Glycine 0 N--CA 1.493 2.451 0 C-N-CA 119.755 -1.212 . . . . 0.0 110.106 -179.099 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.42 ' CZ ' ' HE3' ' A' ' 94' ' ' LYS . 67.6 m-85 -92.29 57.85 3.12 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 120.83 -1.394 . . . . 0.0 110.132 179.815 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -68.66 -36.87 79.13 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 120.936 -1.102 . . . . 0.0 110.009 179.637 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.31 81.75 2.0 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.064 -1.022 . . . . 0.0 110.481 -179.88 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.0 pp -116.4 140.23 49.57 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.084 -1.01 . . . . 0.0 110.1 179.703 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.434 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.1 p -107.4 -30.21 8.81 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.241 -0.912 . . . . 0.0 112.575 -179.722 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.618 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 10.9 m -146.41 -170.3 3.47 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 120.329 -1.482 . . . . 0.0 109.994 179.23 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 18.0 mt -99.61 -34.98 10.0 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.337 -0.852 . . . . 0.0 110.445 178.688 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 3.9 ttm180 -104.57 36.05 2.54 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.8 -1.188 . . . . 0.0 109.205 178.275 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.618 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.281 1.6 t -127.68 -59.55 1.2 Allowed 'General case' 0 N--CA 1.497 1.905 0 N-CA-C 105.901 -1.889 . . . . 0.0 105.901 -179.426 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 9.4 pt -67.81 -23.71 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.699 0 O-C-N 120.925 -1.109 . . . . 0.0 111.052 177.084 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -122.09 163.71 18.98 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.836 -1.165 . . . . 0.0 110.024 -179.321 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.2 156.96 18.75 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.203 -0.936 . . . . 0.0 110.373 179.978 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 22.9 m-80 -127.38 26.03 6.05 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.132 -0.98 . . . . 0.0 111.549 -179.714 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -106.53 165.53 11.22 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.814 -1.179 . . . . 0.0 110.071 179.89 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 12.3 p -115.28 64.56 0.68 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.207 -0.933 . . . . 0.0 110.282 -179.933 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -142.63 -59.95 0.44 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.154 -0.966 . . . . 0.0 110.135 179.912 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -150.32 171.16 17.42 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.216 -0.927 . . . . 0.0 110.499 -179.969 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -68.66 88.8 0.22 Allowed Glycine 0 N--CA 1.493 2.457 0 N-CA-C 109.391 -1.484 . . . . 0.0 109.391 179.942 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 1.8 m -123.02 99.72 6.52 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.17 -1.194 . . . . 0.0 110.351 -179.843 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 1.6 m -113.06 172.05 7.17 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.199 -0.938 . . . . 0.0 110.018 179.755 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 27.4 t -57.97 154.59 12.2 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.134 -0.979 . . . . 0.0 109.952 179.821 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.472 HG22 HD11 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -75.15 -34.92 32.79 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.471 0 O-C-N 121.14 -0.975 . . . . 0.0 111.239 -179.269 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.494 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 12.1 p -54.42 -33.6 59.74 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.763 -1.21 . . . . 0.0 111.251 -178.485 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.5 -34.99 73.29 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 120.916 -1.115 . . . . 0.0 109.615 178.471 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 47.7 t -79.91 124.87 82.97 Favored Pre-proline 0 N--CA 1.504 2.254 0 O-C-N 121.134 -0.979 . . . . 0.0 109.884 179.786 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -65.03 176.33 3.17 Favored 'Trans proline' 0 N--CA 1.489 1.233 0 O-C-N 123.113 1.059 . . . . 0.0 110.921 179.499 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -75.04 -37.21 61.77 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.296 -0.877 . . . . 0.0 110.481 -179.837 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.27 -40.75 78.36 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 120.954 -1.091 . . . . 0.0 109.926 179.946 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 9.9 tp60 -70.27 -41.61 73.19 Favored 'General case' 0 N--CA 1.505 2.305 0 C-N-CA 119.378 -0.929 . . . . 0.0 108.998 178.956 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.2 mt -65.09 -39.3 92.97 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.301 -0.875 . . . . 0.0 109.394 179.081 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -60.1 -39.51 86.44 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.134 -0.979 . . . . 0.0 109.905 179.639 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -58.72 -37.2 75.61 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.173 -0.955 . . . . 0.0 110.289 179.755 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -59.97 -43.46 95.05 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.159 -0.963 . . . . 0.0 109.957 179.925 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.12 -38.96 84.6 Favored 'General case' 0 N--CA 1.51 2.544 0 C-N-CA 119.374 -0.93 . . . . 0.0 109.993 179.879 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 20.9 mtt-85 -67.11 -40.27 86.84 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.142 -0.974 . . . . 0.0 109.822 179.803 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 26.6 mmtp -68.95 -35.99 77.42 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.206 -0.934 . . . . 0.0 110.34 179.714 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 2.4 tppt? -85.48 -21.7 28.55 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.045 -1.034 . . . . 0.0 111.446 179.781 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 91.61 31.47 9.44 Favored Glycine 0 N--CA 1.493 2.473 0 N-CA-C 110.069 -1.213 . . . . 0.0 110.069 -179.727 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.9 t -140.64 -161.66 1.24 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.961 -1.317 . . . . 0.0 109.835 179.682 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -123.2 171.54 9.27 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.124 -0.985 . . . . 0.0 110.266 179.997 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 10.1 p -155.18 160.45 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.203 -0.936 . . . . 0.0 110.702 179.801 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 44.2 t -168.51 89.28 0.24 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.288 -0.882 . . . . 0.0 111.086 -179.937 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.494 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 50.3 t80 -95.69 159.02 15.19 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.235 -0.915 . . . . 0.0 110.13 179.867 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 8.3 m80 -136.46 -61.4 0.69 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.47 -0.769 . . . . 0.0 109.08 179.179 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . 0.405 ' OE1' ' CZ3' ' A' ' 50' ' ' TRP . 11.5 pt20 -135.74 151.28 49.98 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 178.918 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . 0.417 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.3 p -90.13 153.09 20.79 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.155 -1.018 . . . . 0.0 111.008 -179.67 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.8 m -71.14 -26.73 27.71 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 C-N-CA 119.715 -0.794 . . . . 0.0 111.496 -179.436 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -51.69 -60.66 2.91 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 120.835 -1.166 . . . . 0.0 110.288 -179.856 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.425 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 24.3 p -125.29 -170.9 2.25 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.214 -0.929 . . . . 0.0 110.849 179.862 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -95.78 59.41 1.5 Allowed Glycine 0 N--CA 1.493 2.451 0 N-CA-C 108.297 -1.921 . . . . 0.0 108.297 178.752 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 19.3 t -100.91 140.38 35.29 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.372 -1.075 . . . . 0.0 109.849 -179.367 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.6 53.18 1.43 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.282 -0.886 . . . . 0.0 109.563 179.287 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.95 98.52 0.03 OUTLIER Glycine 0 N--CA 1.486 2.001 0 N-CA-C 109.81 -1.316 . . . . 0.0 109.81 -179.952 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.8 p -108.75 127.59 54.13 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.303 -1.116 . . . . 0.0 110.451 179.683 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -143.23 147.8 35.42 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.129 -0.982 . . . . 0.0 109.927 -179.68 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -106.08 -49.27 3.41 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.218 -0.926 . . . . 0.0 110.624 -179.709 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 5.9 m -54.44 -38.32 66.19 Favored 'General case' 0 N--CA 1.512 2.671 0 O-C-N 121.029 -1.044 . . . . 0.0 110.624 -179.775 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 . . . . . 0 N--CA 1.494 1.746 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.173 179.908 . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 65.12 149.6 0.06 OUTLIER Glycine 0 N--CA 1.493 2.437 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 179.995 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.6 m -126.5 145.0 51.44 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.195 -1.179 . . . . 0.0 110.219 179.994 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -73.71 -171.23 0.81 Allowed 'Trans proline' 0 C--N 1.318 -1.036 0 O-C-N 123.344 1.181 . . . . 0.0 110.332 -179.965 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.75 136.8 17.35 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.176 -0.952 . . . . 0.0 110.618 179.916 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 85.8 mt -117.26 145.87 22.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.228 -0.92 . . . . 0.0 110.077 -179.99 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -125.19 157.04 37.46 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.221 -0.924 . . . . 0.0 110.148 -179.941 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 53.0 -174.45 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.023 -1.048 . . . . 0.0 110.743 -179.972 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.2 mtt85 -140.22 84.34 1.96 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.215 -0.928 . . . . 0.0 110.201 -179.943 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.82 51.88 1.39 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.166 -0.958 . . . . 0.0 110.227 179.984 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.9 p -115.64 96.79 5.79 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.163 -0.961 . . . . 0.0 110.074 179.899 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.5 mttm -132.97 172.86 6.64 Favored Pre-proline 0 N--CA 1.495 1.776 0 O-C-N 121.227 -0.92 . . . . 0.0 110.331 -179.894 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.66 160.18 48.89 Favored 'Trans proline' 0 C--N 1.316 -1.138 0 O-C-N 123.409 1.215 . . . . 0.0 110.676 179.95 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.434 ' HB3' ' CH2' ' A' ' 80' ' ' TRP . . . -84.04 145.32 46.09 Favored Pre-proline 0 N--CA 1.505 2.282 0 O-C-N 121.323 -0.861 . . . . 0.0 109.765 179.75 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -71.21 163.74 38.11 Favored 'Trans proline' 0 C--N 1.316 -1.158 0 O-C-N 123.433 1.228 . . . . 0.0 110.89 -179.669 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -48.72 -31.67 7.25 Favored 'General case' 0 N--CA 1.513 2.715 0 O-C-N 121.416 -0.802 . . . . 0.0 111.463 -179.892 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.62 -34.88 36.5 Favored Glycine 0 N--CA 1.499 2.863 0 O-C-N 120.961 -1.087 . . . . 0.0 110.552 179.828 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -55.4 -32.79 62.95 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 121.008 -1.289 . . . . 0.0 110.614 179.692 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -54.3 -37.66 65.04 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 121.039 -1.038 . . . . 0.0 110.234 179.695 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 27.9 mttt -57.59 -36.74 72.14 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.303 -0.873 . . . . 0.0 110.177 179.452 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.424 HG22 ' OH ' ' A' ' 62' ' ' TYR . 2.1 pt -116.64 35.06 1.13 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.176 -0.952 . . . . 0.0 110.449 179.509 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.431 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 1.2 tmtt? -84.79 -43.04 0.69 Allowed Pre-proline 0 N--CA 1.509 2.511 0 O-C-N 121.122 -0.986 . . . . 0.0 113.172 -179.024 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.9 Cg_endo -76.22 -37.7 1.37 Allowed 'Trans proline' 0 N--CA 1.487 1.121 0 O-C-N 122.618 0.799 . . . . 0.0 111.571 -178.337 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 88.5 m -59.6 -41.62 90.74 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.031 -1.043 . . . . 0.0 109.959 -179.726 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.0 mt -65.19 -39.57 93.04 Favored 'General case' 0 N--CA 1.506 2.338 0 C-N-CA 119.484 -0.887 . . . . 0.0 109.461 179.238 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.15 -35.02 69.02 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.073 -1.017 . . . . 0.0 110.235 179.335 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -56.45 -35.82 68.33 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 121.118 -0.988 . . . . 0.0 110.407 179.82 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.507 ' CE2' HD11 ' A' ' 55' ' ' LEU . 15.8 m-85 -57.25 -36.84 71.45 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.074 -1.016 . . . . 0.0 110.673 -179.952 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -60.31 -37.96 82.2 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.149 -0.969 . . . . 0.0 110.893 -178.93 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 2.9 mp -63.28 -40.31 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.475 0 C-N-CA 118.992 -1.083 . . . . 0.0 108.961 179.783 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -70.08 -55.98 8.08 Favored 'General case' 0 N--CA 1.505 2.316 0 C-N-CA 119.115 -1.034 . . . . 0.0 108.468 178.63 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -56.67 -31.28 64.27 Favored 'General case' 0 N--CA 1.509 2.508 0 C-N-CA 119.242 -0.983 . . . . 0.0 109.738 178.382 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -57.75 -38.78 75.98 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 120.942 -1.099 . . . . 0.0 110.19 179.891 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -64.32 -50.29 68.4 Favored 'General case' 0 N--CA 1.506 2.351 0 C-N-CA 119.097 -1.041 . . . . 0.0 109.728 -179.902 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.426 ' CB ' ' CG1' ' A' ' 52' ' ' ILE . . . -70.61 -37.59 73.88 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.371 -0.932 . . . . 0.0 109.517 179.183 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 7.2 mm100 -71.55 -30.82 66.31 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 121.164 -0.96 . . . . 0.0 110.206 179.339 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.7 mtpp -91.79 -35.21 14.24 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.905 -1.122 . . . . 0.0 110.552 179.771 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -69.33 -40.18 77.73 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.109 -0.994 . . . . 0.0 109.356 179.377 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.76 -36.91 77.61 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.16 -0.962 . . . . 0.0 110.114 179.512 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 11.5 p -104.0 39.46 1.63 Allowed 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.084 -1.01 . . . . 0.0 110.188 179.733 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 46.8 t -154.8 -57.99 0.11 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.224 -0.922 . . . . 0.0 110.379 179.909 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.4 mmtp -134.08 103.33 5.74 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.272 -0.892 . . . . 0.0 109.848 179.737 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.8 tp -124.33 72.67 1.2 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.282 -0.886 . . . . 0.0 110.286 -179.887 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -108.79 -53.24 2.67 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.147 -0.971 . . . . 0.0 110.095 179.701 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -116.43 145.66 43.11 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.176 -0.953 . . . . 0.0 110.075 179.824 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 28.5 tttt 53.52 89.15 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.139 0 O-C-N 120.962 -1.086 . . . . 0.0 110.652 -179.927 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 38.6 t -115.49 -55.62 2.43 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.206 -0.934 . . . . 0.0 110.496 -179.96 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 -55.87 -39.23 71.23 Favored 'General case' 0 N--CA 1.512 2.642 0 O-C-N 121.208 -0.932 . . . . 0.0 109.91 179.846 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -59.55 -36.79 76.86 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.269 -0.894 . . . . 0.0 110.028 179.524 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -62.08 -47.47 84.49 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.076 -1.015 . . . . 0.0 109.718 179.89 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -58.52 -38.04 76.89 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.187 -0.945 . . . . 0.0 110.127 179.908 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 48.1 m0 -59.23 -34.04 71.73 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.122 -0.986 . . . . 0.0 110.049 179.464 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.76 -31.09 71.98 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.077 -1.015 . . . . 0.0 109.947 178.646 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.426 ' CG1' ' CB ' ' A' ' 33' ' ' ALA . 5.7 mt -71.41 -58.89 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.263 0 O-C-N 120.921 -1.112 . . . . 0.0 109.324 179.547 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.52 -25.95 60.62 Favored 'General case' 0 N--CA 1.513 2.717 0 C-N-CA 118.312 -1.355 . . . . 0.0 110.076 178.829 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.6 mm100 -64.07 -40.07 95.46 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 120.742 -1.224 . . . . 0.0 109.405 178.522 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.507 HD11 ' CE2' ' A' ' 26' ' ' PHE . 0.3 OUTLIER -55.0 -33.93 62.99 Favored 'General case' 0 N--CA 1.513 2.702 0 O-C-N 120.942 -1.099 . . . . 0.0 109.873 179.074 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.452 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 16.3 t60 -55.54 -39.78 71.02 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 120.972 -1.08 . . . . 0.0 110.291 -179.672 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 57' ' ' HIS . . . . . 0.446 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.2 m170 -64.85 -50.96 64.59 Favored 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 119.208 -0.997 . . . . 0.0 109.61 179.45 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 54.1 tp60 -57.11 -34.87 68.78 Favored 'General case' 0 N--CA 1.507 2.423 0 C-N-CA 119.436 -0.905 . . . . 0.0 109.962 179.286 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.433 ' HD3' ' CG ' ' A' ' 26' ' ' PHE . 19.2 mmm-85 -65.16 -50.32 66.43 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.027 -1.046 . . . . 0.0 109.567 179.333 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 53.8 p -60.76 -39.91 90.52 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.375 -0.93 . . . . 0.0 109.695 179.769 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.423 ' O ' ' OG1' ' A' ' 65' ' ' THR . 6.2 tpt180 -63.97 -41.19 97.63 Favored 'General case' 0 N--CA 1.505 2.314 0 C-N-CA 119.174 -1.01 . . . . 0.0 109.186 179.204 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.424 ' OH ' HG22 ' A' ' 19' ' ' ILE . 36.7 t80 -63.23 -49.95 72.16 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.177 -0.952 . . . . 0.0 109.682 179.499 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.421 HG23 HD12 ' A' ' 63' ' ' ILE . 74.0 mt -71.61 -36.03 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 O-C-N 121.209 -0.932 . . . . 0.0 109.654 179.585 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.416 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 10.5 t80 -69.28 -41.64 76.57 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 120.974 -1.079 . . . . 0.0 108.871 178.848 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.423 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 87.8 m -61.19 -40.85 95.47 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.046 -1.034 . . . . 0.0 109.876 179.683 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.416 ' CD1' ' CG2' ' A' ' 73' ' ' ILE . 3.8 pp -83.23 -35.89 25.03 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 120.962 -1.086 . . . . 0.0 112.374 -179.241 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.426 ' CD2' ' HB2' ' A' ' 78' ' ' TYR . 63.9 t80 -86.58 -35.14 19.64 Favored 'General case' 0 N--CA 1.513 2.71 0 O-C-N 120.585 -1.322 . . . . 0.0 111.839 -179.499 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.416 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 7.6 m-85 -98.26 -3.58 37.03 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 120.837 -1.164 . . . . 0.0 113.17 -178.574 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.76 -58.86 0.61 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.354 -1.466 . . . . 0.0 110.819 179.555 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -63.11 -29.12 70.55 Favored 'General case' 0 N--CA 1.51 2.561 0 O-C-N 121.063 -1.023 . . . . 0.0 110.609 179.956 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt 57.83 43.34 21.85 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 120.855 -1.153 . . . . 0.0 110.163 -179.512 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -115.02 36.86 3.69 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.499 -0.751 . . . . 0.0 109.737 179.213 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.462 HG23 HD12 ' A' ' 73' ' ' ILE . 13.8 tt -156.43 162.39 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.21 -0.931 . . . . 0.0 110.174 -179.83 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 31.8 m -109.93 147.54 33.24 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.163 -0.961 . . . . 0.0 109.971 179.595 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.2 tttm -45.29 -32.61 2.05 Favored 'General case' 0 N--CA 1.516 2.829 0 O-C-N 121.406 -0.809 . . . . 0.0 111.675 -179.866 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -61.72 -50.35 72.79 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 120.95 -1.093 . . . . 0.0 109.324 179.496 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 25.4 tp -67.27 -43.7 81.16 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 119.15 -1.02 . . . . 0.0 108.582 178.831 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.426 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 16.1 t80 -60.66 -37.97 83.3 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.312 -0.868 . . . . 0.0 109.435 178.913 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -74.88 -41.38 59.9 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.099 -1.0 . . . . 0.0 108.968 178.786 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.434 ' CH2' ' HB3' ' A' ' 12' ' ' ALA . 82.6 t90 -59.21 -38.45 79.94 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.111 -0.993 . . . . 0.0 109.212 178.816 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.449 ' CD2' ' CD2' ' A' ' 86' ' ' TYR . 15.1 mt -65.95 -55.8 14.99 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.249 -0.907 . . . . 0.0 109.278 179.116 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -56.22 -27.11 23.24 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.429 0 O-C-N 121.16 -0.962 . . . . 0.0 110.852 -179.633 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.18 -18.71 26.57 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.95 -1.094 . . . . 0.0 111.674 179.598 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.428 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 10.4 mm-40 -103.75 25.19 10.11 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 120.601 -1.312 . . . . 0.0 111.809 179.97 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 7.8 mmpt? 75.25 69.97 0.08 Allowed 'General case' 0 N--CA 1.513 2.72 0 O-C-N 121.319 -0.863 . . . . 0.0 111.989 179.362 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.449 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 27.7 m-85 -131.9 -64.0 0.8 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.41 -0.806 . . . . 0.0 109.192 178.997 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -129.71 -178.68 4.8 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.339 -0.85 . . . . 0.0 109.734 179.44 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.452 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 6.4 t70 -131.12 124.24 30.31 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.093 -1.004 . . . . 0.0 110.615 -179.835 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -74.35 -36.75 63.62 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.264 -0.897 . . . . 0.0 109.899 179.349 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 16.0 tp -60.1 -43.35 95.62 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.022 -1.049 . . . . 0.0 109.763 179.867 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 67.8 tp -67.56 -48.54 66.63 Favored 'General case' 0 N--CA 1.506 2.364 0 C-N-CA 119.16 -1.016 . . . . 0.0 108.511 179.014 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.463 HG23 HD11 ' A' ' 92' ' ' ILE . 63.9 mt -58.52 -40.0 77.26 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.473 0 O-C-N 121.112 -0.993 . . . . 0.0 108.628 178.464 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.91 -39.23 91.3 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.18 -0.95 . . . . 0.0 109.459 178.803 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 5.8 mmtt -59.0 -45.4 90.77 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.051 -1.031 . . . . 0.0 109.423 179.523 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 8.2 m0 -64.53 -41.93 96.07 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.45 -0.9 . . . . 0.0 109.718 179.639 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 3.0 mtp85 -65.27 -31.73 73.03 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.319 -0.863 . . . . 0.0 110.595 179.58 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 3.1 mmtp -54.26 -177.17 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.668 0 O-C-N 121.018 -1.051 . . . . 0.0 110.524 179.934 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.71 133.3 52.32 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.181 -0.949 . . . . 0.0 109.838 179.405 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.23 4.16 55.3 Favored Glycine 0 N--CA 1.493 2.458 0 C-N-CA 120.149 -1.024 . . . . 0.0 111.184 -179.488 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -110.29 46.86 1.0 Allowed 'General case' 0 N--CA 1.497 1.924 0 CA-C-N 119.658 1.729 . . . . 0.0 110.048 179.696 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -60.85 -39.74 90.25 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.171 -0.956 . . . . 0.0 109.829 179.835 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -116.01 101.89 9.16 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.3 -0.875 . . . . 0.0 109.899 179.906 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.2 tp -137.98 139.82 39.89 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.247 -0.908 . . . . 0.0 109.452 -179.372 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.446 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 29.4 p -112.36 -37.76 4.89 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.148 -0.97 . . . . 0.0 112.765 -179.521 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 105' ' ' CYS . . . . . 0.573 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 6.4 m -142.57 -169.43 2.98 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 120.209 -1.557 . . . . 0.0 110.361 179.292 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 18.0 mt -96.69 -38.76 9.79 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.103 -0.998 . . . . 0.0 110.28 179.124 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 8.1 ttm180 -101.03 29.2 4.76 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 120.944 -1.098 . . . . 0.0 109.883 178.012 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.573 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.299 1.8 t -126.64 14.35 7.55 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.052 -1.03 . . . . 0.0 109.344 -179.429 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.417 ' CG2' ' O ' ' A' ' 108' ' ' CYS . 1.0 OUTLIER -160.07 37.88 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.386 0 O-C-N 120.826 -1.171 . . . . 0.0 110.648 -178.963 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -127.91 145.0 51.09 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.678 -1.264 . . . . 0.0 111.552 -178.562 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.444 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 7.8 ttmt -121.22 -57.1 1.87 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.341 -0.849 . . . . 0.0 110.234 179.671 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 52.54 28.04 5.66 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 121.011 -1.055 . . . . 0.0 111.695 179.925 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -150.75 -171.46 3.93 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.959 -1.088 . . . . 0.0 110.553 -179.932 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 1.2 p -125.39 137.48 54.02 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.212 -0.93 . . . . 0.0 110.084 179.992 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 64.83 -70.63 0.08 Allowed 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.069 -1.019 . . . . 0.0 110.642 -179.942 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -127.86 114.1 16.78 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.009 -1.057 . . . . 0.0 110.193 -179.981 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -131.8 -144.43 5.36 Favored Glycine 0 N--CA 1.493 2.471 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 -179.978 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 4.1 m -117.53 89.07 3.04 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.241 -1.152 . . . . 0.0 110.208 179.994 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 119' ' ' THR . . . . . 0.444 ' OG1' ' HA ' ' A' ' 111' ' ' LYS . 1.7 m -134.34 170.9 15.04 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.233 -0.917 . . . . 0.0 110.255 179.969 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 48.1 t -97.7 155.52 16.97 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.319 -0.863 . . . . 0.0 109.068 178.996 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.448 HG22 ' CE1' ' A' ' 142' ' ' PHE . 14.6 tt -77.49 -29.43 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.296 0 O-C-N 120.995 -1.066 . . . . 0.0 112.022 -179.257 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.478 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.3 p -54.76 -35.78 64.15 Favored 'General case' 0 N--CA 1.512 2.643 0 O-C-N 120.517 -1.365 . . . . 0.0 110.2 -179.278 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.86 -29.39 64.97 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.984 -1.072 . . . . 0.0 109.514 177.476 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 51.2 t -73.16 118.37 68.0 Favored Pre-proline 0 N--CA 1.507 2.403 0 O-C-N 121.1 -1.0 . . . . 0.0 110.221 179.764 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . 0.408 ' HB3' ' CB ' ' A' ' 154' ' ' ALA . 37.7 Cg_endo -64.91 168.44 13.66 Favored 'Trans proline' 0 N--CA 1.489 1.221 0 O-C-N 123.088 1.046 . . . . 0.0 110.678 178.736 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 -74.98 -38.9 61.53 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.199 -0.938 . . . . 0.0 110.335 179.983 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.66 -40.62 83.99 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.079 -1.013 . . . . 0.0 110.078 -179.779 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -66.08 -41.65 90.43 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.167 -0.958 . . . . 0.0 109.514 179.604 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 58.0 mt -64.15 -40.2 95.64 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.191 -0.943 . . . . 0.0 109.633 179.502 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -60.34 -39.15 86.09 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.211 -0.93 . . . . 0.0 110.126 179.955 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.75 -39.01 93.24 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.059 -1.025 . . . . 0.0 110.184 179.924 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -65.46 -40.42 93.16 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.176 -0.952 . . . . 0.0 109.881 179.879 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -66.54 -41.08 89.24 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.149 -0.969 . . . . 0.0 109.647 179.704 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.26 -33.44 73.55 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.134 -0.979 . . . . 0.0 110.185 179.493 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 22.2 mttt -79.26 -29.22 42.52 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.893 -1.129 . . . . 0.0 111.147 179.975 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 36.9 mttt -97.53 21.96 9.55 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 120.825 -1.172 . . . . 0.0 111.855 -179.941 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.18 46.42 56.72 Favored Glycine 0 N--CA 1.499 2.898 0 O-C-N 120.666 -1.271 . . . . 0.0 110.8 179.317 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 7.9 t -149.39 -164.68 2.08 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.203 -1.174 . . . . 0.0 110.404 179.987 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -134.34 162.77 31.29 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.106 -0.996 . . . . 0.0 110.346 -179.902 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.9 p -151.16 161.43 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.257 -0.902 . . . . 0.0 110.453 -179.85 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 46.5 t -170.38 110.3 0.38 Allowed 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.179 -0.951 . . . . 0.0 111.202 179.789 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 142' ' ' PHE . . . . . 0.478 ' CE2' ' HA ' ' A' ' 122' ' ' CYS . 86.0 t80 -105.78 158.78 16.49 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.224 -0.922 . . . . 0.0 110.601 179.741 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 21.9 t-160 -138.42 -60.07 0.62 Allowed 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.673 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -148.05 149.01 31.32 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.42 -0.8 . . . . 0.0 109.175 178.646 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . 0.437 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 25.0 p -93.46 156.1 16.96 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.007 -1.058 . . . . 0.0 111.105 -179.247 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.9 p -73.31 -25.85 21.83 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.447 0 O-C-N 121.43 -0.794 . . . . 0.0 111.679 -179.235 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -49.06 -52.5 25.18 Favored 'General case' 0 N--CA 1.516 2.853 0 O-C-N 120.816 -1.177 . . . . 0.0 110.412 -179.724 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 28.2 p -135.39 -165.02 1.62 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.227 -0.921 . . . . 0.0 110.404 179.72 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.34 61.78 0.65 Allowed Glycine 0 N--CA 1.492 2.376 0 N-CA-C 107.867 -2.093 . . . . 0.0 107.867 178.309 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.8 t -103.26 137.38 41.48 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.368 -1.077 . . . . 0.0 109.847 -179.007 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 19.1 mtp85 -96.03 52.8 1.32 Allowed 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.206 -0.934 . . . . 0.0 109.612 179.305 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.52 97.59 0.05 OUTLIER Glycine 0 N--CA 1.488 2.164 0 N-CA-C 109.947 -1.261 . . . . 0.0 109.947 179.924 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.6 p -107.9 126.0 52.15 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.246 -1.149 . . . . 0.0 110.049 179.463 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 154' ' ' ALA . . . . . 0.408 ' CB ' ' HB3' ' A' ' 125' ' ' PRO . . . -139.45 137.52 35.66 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.047 -1.033 . . . . 0.0 109.924 -179.374 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.75 -51.07 2.96 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.124 -0.985 . . . . 0.0 110.485 -179.867 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 10.7 p -58.51 -40.2 82.17 Favored 'General case' 0 N--CA 1.511 2.575 0 O-C-N 121.064 -1.022 . . . . 0.0 110.279 -179.891 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 . . . . . 0 N--CA 1.496 1.848 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.442 -179.995 . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.687 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.501 2.095 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -70.58 161.73 45.01 Favored 'Trans proline' 0 C--N 1.317 -1.108 0 O-C-N 123.382 1.201 . . . . 0.0 110.81 -179.743 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -48.95 -31.69 7.82 Favored 'General case' 0 N--CA 1.514 2.758 0 O-C-N 121.42 -0.8 . . . . 0.0 111.384 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.71 -33.81 35.2 Favored Glycine 0 N--CA 1.499 2.855 0 O-C-N 120.925 -1.109 . . . . 0.0 110.671 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.411 ' HB2' HD11 ' A' ' 77' ' ' LEU . 25.1 t80 -55.42 -33.51 63.6 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 120.929 -1.336 . . . . 0.0 110.623 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -54.13 -36.8 63.67 Favored 'General case' 0 N--CA 1.512 2.654 0 O-C-N 121.01 -1.056 . . . . 0.0 110.331 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.4 mtpp -58.13 -36.22 72.63 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.248 -0.908 . . . . 0.0 110.261 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.848 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.9 pt -116.33 35.8 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 O-C-N 121.192 -0.942 . . . . 0.0 110.602 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.425 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 3.9 tmtt? -83.59 -43.16 0.81 Allowed Pre-proline 0 N--CA 1.508 2.451 0 O-C-N 121.04 -1.038 . . . . 0.0 113.12 -179.282 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.425 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.6 Cg_endo -76.24 -35.69 2.2 Favored 'Trans proline' 0 N--CA 1.486 1.061 0 O-C-N 122.582 0.78 . . . . 0.0 111.725 -178.4 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.912 HG21 ' CE2' ' A' ' 62' ' ' TYR . 85.3 m -59.6 -43.8 93.59 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 120.921 -1.112 . . . . 0.0 109.973 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.848 HD12 ' O ' ' A' ' 19' ' ' ILE . 7.2 mt -64.78 -39.88 94.33 Favored 'General case' 0 N--CA 1.506 2.349 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.472 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.8 m -58.23 -35.22 71.37 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.119 -0.988 . . . . 0.0 110.168 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -56.57 -35.88 68.69 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.037 -1.039 . . . . 0.0 110.383 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.61 ' CD1' HD22 ' A' ' 55' ' ' LEU . 11.7 m-85 -57.16 -38.27 73.32 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.085 -1.009 . . . . 0.0 110.578 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 55.2 mm-40 -58.64 -39.61 81.06 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.23 -0.919 . . . . 0.0 110.49 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.422 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.2 mp -65.75 -41.26 89.94 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.385 0 C-N-CA 119.187 -1.005 . . . . 0.0 108.77 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -69.18 -50.33 48.57 Favored 'General case' 0 N--CA 1.506 2.336 0 C-N-CA 119.244 -0.982 . . . . 0.0 108.534 178.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.023 HD11 HG23 ' A' ' 52' ' ' ILE . 3.1 tp -59.73 -35.29 74.25 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.254 -0.904 . . . . 0.0 109.453 178.5 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.63 -37.32 73.12 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.035 -1.041 . . . . 0.0 110.352 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -62.92 -51.61 66.28 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.201 -1.0 . . . . 0.0 109.588 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.437 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -69.76 -41.2 75.49 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 119.029 -1.069 . . . . 0.0 108.726 178.806 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -62.5 -34.85 77.69 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.242 -0.911 . . . . 0.0 109.868 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.8 mmtm -70.44 -38.68 74.56 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 120.984 -1.072 . . . . 0.0 110.183 179.809 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 N--CA 1.51 2.547 0 O-C-N 121.16 -0.962 . . . . 0.0 110.107 179.839 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.497 1.886 0 CA-C-O 120.614 0.245 . . . . 0.0 110.423 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.431 ' HB3' ' CZ2' ' A' ' 50' ' ' TRP . 5.3 m-20 -56.65 -39.66 74.08 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.194 -0.941 . . . . 0.0 109.989 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -60.1 -38.08 81.88 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.26 -0.9 . . . . 0.0 109.922 179.444 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.42 ' HG2' ' CB ' ' A' ' 33' ' ' ALA . 0.3 OUTLIER -60.02 -45.87 91.36 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.086 -1.008 . . . . 0.0 109.656 179.727 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.44 HD23 ' HA ' ' A' ' 49' ' ' LEU . 30.3 mt -65.39 -36.72 84.84 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.391 -0.924 . . . . 0.0 110.146 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.503 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.0 m0 -59.1 -38.57 79.85 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.058 -1.026 . . . . 0.0 109.635 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -63.01 -31.95 73.2 Favored 'General case' 0 N--CA 1.503 2.221 0 C-N-CA 119.097 -1.041 . . . . 0.0 109.464 178.174 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 1.023 HG23 HD11 ' A' ' 30' ' ' LEU . 11.3 mt -71.61 -58.55 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.184 0 O-C-N 121.0 -1.062 . . . . 0.0 109.111 179.205 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.7 ptm -59.87 -28.33 67.44 Favored 'General case' 0 N--CA 1.509 2.484 0 C-N-CA 118.601 -1.239 . . . . 0.0 109.988 178.83 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -69.24 -37.93 78.21 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.826 -1.171 . . . . 0.0 109.153 178.122 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.61 HD22 ' CD1' ' A' ' 26' ' ' PHE . 11.0 mt -53.66 -33.28 54.71 Favored 'General case' 0 N--CA 1.512 2.654 0 O-C-N 120.956 -1.09 . . . . 0.0 110.098 179.059 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.44 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 13.7 t60 -54.87 -36.27 64.93 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.082 -1.011 . . . . 0.0 110.137 179.576 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.435 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 8.0 m170 -59.64 -49.33 78.17 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.029 -1.045 . . . . 0.0 109.381 179.303 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -58.48 -34.46 70.91 Favored 'General case' 0 N--CA 1.507 2.421 0 C-N-CA 119.526 -0.87 . . . . 0.0 109.729 179.078 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.435 ' HG2' ' CE1' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -64.18 -50.58 67.58 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.068 -1.02 . . . . 0.0 109.545 179.363 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 87.9 p -63.49 -39.67 95.06 Favored 'General case' 0 N--CA 1.504 2.237 0 C-N-CA 119.25 -0.98 . . . . 0.0 109.296 179.399 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 18.9 ttt85 -63.99 -39.24 93.67 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 119.255 -0.978 . . . . 0.0 109.264 178.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.912 ' CE2' HG21 ' A' ' 22' ' ' THR . 40.4 t80 -63.49 -52.28 61.96 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.175 -0.953 . . . . 0.0 109.416 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.96 HD12 ' HB2' ' A' ' 87' ' ' ALA . 77.5 mt -70.2 -36.71 68.88 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 C-N-CA 119.163 -1.015 . . . . 0.0 109.34 179.44 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.41 ' HD2' HD13 ' A' ' 92' ' ' ILE . 13.0 t80 -66.83 -43.08 84.66 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.057 -1.027 . . . . 0.0 108.907 179.001 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.406 ' HA ' ' CD ' ' A' ' 69' ' ' LYS . 90.0 m -61.35 -40.46 94.36 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.132 -0.98 . . . . 0.0 110.475 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.576 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.05 -33.32 26.47 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 120.921 -1.112 . . . . 0.0 112.353 -178.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.502 ' N ' HD12 ' A' ' 66' ' ' LEU . 46.9 t80 -86.35 -32.16 21.13 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 120.64 -1.288 . . . . 0.0 111.807 -179.413 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -98.26 -19.32 17.9 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.817 -1.177 . . . . 0.0 112.645 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.406 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 9.1 mtpt -120.35 -59.28 1.79 Allowed 'General case' 0 N--CA 1.502 2.135 0 O-C-N 120.488 -1.382 . . . . 0.0 110.704 179.666 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.406 ' HB3' ' HA ' ' A' ' 66' ' ' LEU . 3.0 ttt85 -62.67 -30.83 71.68 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.164 -0.96 . . . . 0.0 110.837 -179.674 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 56.86 42.16 26.89 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 120.77 -1.207 . . . . 0.0 109.994 -179.516 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.66 35.4 3.87 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.38 -0.825 . . . . 0.0 109.991 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.676 HG13 HD23 ' A' ' 77' ' ' LEU . 14.3 tt -153.73 162.6 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.199 -0.938 . . . . 0.0 109.909 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -108.73 146.76 33.02 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.102 -0.999 . . . . 0.0 110.298 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -46.04 -32.11 2.66 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.341 -0.849 . . . . 0.0 111.586 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 38.4 m-20 -61.65 -49.95 74.47 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 120.895 -1.128 . . . . 0.0 109.352 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.676 HD23 HG13 ' A' ' 73' ' ' ILE . 28.9 tp -67.9 -44.28 77.31 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.16 -1.016 . . . . 0.0 108.408 178.737 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.55 ' HA ' HD12 ' A' ' 81' ' ' LEU . 18.3 t80 -60.03 -37.88 81.05 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.326 -0.859 . . . . 0.0 109.393 179.037 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -74.14 -42.66 59.61 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.154 -0.966 . . . . 0.0 108.695 178.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.687 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 77.7 t90 -57.43 -36.37 71.27 Favored 'General case' 0 N--CA 1.51 2.557 0 O-C-N 121.278 -0.889 . . . . 0.0 109.716 178.848 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.55 HD12 ' HA ' ' A' ' 78' ' ' TYR . 12.1 mt -69.92 -48.7 57.51 Favored 'General case' 0 N--CA 1.505 2.308 0 O-C-N 121.163 -0.961 . . . . 0.0 108.858 179.079 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.403 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 33.8 mm -56.9 -32.27 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.629 0 O-C-N 121.259 -0.901 . . . . 0.0 110.11 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.8 tmtt? -89.23 -17.9 28.13 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 120.958 -1.089 . . . . 0.0 112.074 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.443 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 21.3 mm-40 -103.68 21.71 15.69 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 120.645 -1.284 . . . . 0.0 112.087 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.7 tttp 74.6 75.07 0.11 Allowed 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.108 -0.995 . . . . 0.0 111.729 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.509 ' HB3' HD11 ' A' ' 63' ' ' ILE . 33.6 m-85 -135.94 -63.42 0.65 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.458 -0.776 . . . . 0.0 109.334 179.574 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.96 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -123.05 -171.23 2.25 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.401 -0.812 . . . . 0.0 109.276 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.462 ' OD1' HD11 ' A' ' 106' ' ' LEU . 5.5 t0 -131.09 120.25 23.13 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.086 -1.009 . . . . 0.0 110.522 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 10.8 mmtp -77.34 -39.84 46.23 Favored 'General case' 0 N--CA 1.505 2.306 0 C-N-CA 119.528 -0.869 . . . . 0.0 109.649 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 33.0 tp -60.64 -39.96 90.23 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.196 -0.94 . . . . 0.0 109.74 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.792 ' HA ' HD21 ' A' ' 106' ' ' LEU . 60.5 tp -69.85 -49.92 47.73 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.101 -0.999 . . . . 0.0 108.788 179.289 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.411 HG22 ' HD2' ' A' ' 96' ' ' ARG . 58.1 mt -58.87 -32.35 47.0 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.392 0 C-N-CA 119.361 -0.936 . . . . 0.0 108.993 178.25 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.04 -44.03 70.06 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 120.962 -1.087 . . . . 0.0 109.358 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.49 ' HD3' HD23 ' A' ' 106' ' ' LEU . 5.1 mttp -58.21 -39.14 78.24 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.099 -1.001 . . . . 0.0 110.106 179.151 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.0 m0 -69.09 -39.77 78.81 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.109 -0.995 . . . . 0.0 109.767 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.411 ' HD2' HG22 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -67.84 -33.95 75.75 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.245 -0.91 . . . . 0.0 110.349 179.494 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 10.3 mmtm -54.17 -177.18 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.679 0 O-C-N 121.081 -1.012 . . . . 0.0 110.526 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.96 131.75 53.69 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.217 -0.927 . . . . 0.0 109.614 179.246 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 101.44 1.91 53.58 Favored Glycine 0 N--CA 1.492 2.398 0 C-N-CA 120.066 -1.064 . . . . 0.0 111.192 -179.383 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 41.2 m-85 -105.64 64.03 0.69 Allowed 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 119.595 1.698 . . . . 0.0 109.903 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -88.82 -36.57 15.97 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.102 -0.998 . . . . 0.0 110.121 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -108.23 71.24 0.79 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.153 -0.967 . . . . 0.0 109.786 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.855 HD13 HD13 ' A' ' 109' ' ' ILE . 7.2 tp -117.84 133.08 56.28 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.223 -0.923 . . . . 0.0 109.627 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.435 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.3 p -109.72 -37.44 5.66 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.242 -0.911 . . . . 0.0 112.361 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.757 ' O ' HD11 ' A' ' 103' ' ' LEU . 6.6 m -141.04 -169.06 2.75 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.217 -1.552 . . . . 0.0 110.1 178.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.792 HD21 ' HA ' ' A' ' 91' ' ' LEU . 27.9 mt -97.34 -38.07 9.79 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.186 -0.946 . . . . 0.0 110.282 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 8.7 ttt-85 -101.15 30.06 4.34 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 120.966 -1.084 . . . . 0.0 109.734 177.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.667 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.3 1.7 t -126.56 15.07 7.63 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.07 -1.019 . . . . 0.0 108.995 -179.375 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.855 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -159.07 37.26 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.404 0 O-C-N 120.788 -1.195 . . . . 0.0 110.759 -179.015 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.619 ' C ' HG23 ' A' ' 119' ' ' THR . 10.6 mm100 . . . . . 0 N--CA 1.5 2.061 0 O-C-N 120.643 -1.286 . . . . 0.0 111.767 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.619 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.1 m . . . . . 0 N--CA 1.494 1.766 0 CA-C-O 120.735 0.302 . . . . 0.0 110.321 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.425 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 47.9 t -105.37 155.37 19.18 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.395 -0.816 . . . . 0.0 109.385 179.123 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.812 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -71.41 -35.94 59.05 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.344 0 O-C-N 121.113 -0.992 . . . . 0.0 110.801 -179.471 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.436 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.3 p -55.59 -34.27 64.67 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 120.8 -1.187 . . . . 0.0 110.929 -179.026 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -35.83 78.17 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 120.957 -1.09 . . . . 0.0 109.607 178.39 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.2 t -77.63 124.98 86.54 Favored Pre-proline 0 N--CA 1.505 2.291 0 O-C-N 121.167 -0.958 . . . . 0.0 109.952 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.618 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.0 Cg_endo -64.94 178.92 1.61 Allowed 'Trans proline' 0 N--CA 1.489 1.237 0 O-C-N 123.176 1.093 . . . . 0.0 110.718 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -75.01 -36.96 61.93 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.287 -0.883 . . . . 0.0 110.627 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.61 -41.57 81.52 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 120.985 -1.072 . . . . 0.0 109.886 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -70.1 -41.19 74.35 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.338 -0.945 . . . . 0.0 108.966 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.618 HD12 ' O ' ' A' ' 125' ' ' PRO . 4.2 mt -64.94 -39.3 93.3 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.27 -0.894 . . . . 0.0 109.465 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -60.41 -40.0 89.41 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.134 -0.979 . . . . 0.0 109.806 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -59.29 -37.67 78.28 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.152 -0.968 . . . . 0.0 110.251 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -59.37 -41.69 89.91 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.178 -0.951 . . . . 0.0 110.042 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.647 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -62.75 -48.23 80.09 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.192 -0.943 . . . . 0.0 109.614 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 1.1 ttt-85 -60.82 -37.1 80.85 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.211 -0.931 . . . . 0.0 110.067 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 33.4 mmtm -67.96 -34.12 75.96 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.103 -0.998 . . . . 0.0 110.781 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 18.4 mtmt -102.82 23.28 12.37 Favored 'General case' 0 N--CA 1.502 2.165 0 O-C-N 120.925 -1.109 . . . . 0.0 111.718 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.53 46.5 53.11 Favored Glycine 0 N--CA 1.499 2.866 0 O-C-N 120.715 -1.24 . . . . 0.0 110.851 179.277 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.647 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 9.2 t -147.18 -167.7 2.85 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.132 -1.216 . . . . 0.0 110.433 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -123.81 174.61 7.41 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.239 -0.913 . . . . 0.0 110.317 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.6 p -157.35 159.81 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.253 -0.904 . . . . 0.0 110.855 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 29.6 t -170.24 85.95 0.12 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.243 -0.911 . . . . 0.0 110.924 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.787 ' CG ' HD12 ' A' ' 121' ' ' ILE . 47.1 t80 -97.85 161.5 13.71 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.197 -0.939 . . . . 0.0 110.612 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 13.3 m80 -140.63 -61.08 0.5 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.521 -0.737 . . . . 0.0 109.104 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.7 151.48 51.1 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.413 -0.805 . . . . 0.0 109.037 178.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 29.2 p -95.79 153.26 17.83 Favored 'General case' 0 N--CA 1.503 2.203 0 C-N-CA 119.163 -1.015 . . . . 0.0 111.102 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.4 m -72.08 -25.7 24.07 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 O-C-N 121.44 -0.787 . . . . 0.0 111.563 -179.35 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 62.6 m170 -50.08 -60.41 2.97 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 120.868 -1.145 . . . . 0.0 110.219 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.503 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 25.0 p -125.83 -165.93 1.49 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.295 -0.878 . . . . 0.0 110.574 179.678 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -98.59 59.09 0.93 Allowed Glycine 0 N--CA 1.492 2.373 0 N-CA-C 108.16 -1.976 . . . . 0.0 108.16 178.578 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.7 t -103.84 143.97 32.13 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.316 -1.108 . . . . 0.0 109.931 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 14.0 ttt-85 -98.67 49.78 0.98 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.289 -0.882 . . . . 0.0 109.545 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.25 97.57 0.05 OUTLIER Glycine 0 N--CA 1.488 2.105 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.7 p -109.51 123.79 49.99 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.293 -1.122 . . . . 0.0 110.221 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -140.02 121.56 15.18 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.108 -0.995 . . . . 0.0 109.605 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.502 2.171 0 O-C-N 121.121 -0.987 . . . . 0.0 110.419 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.718 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.503 2.197 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.407 ' HG2' HD13 ' A' ' 77' ' ' LEU . 45.6 Cg_endo -70.7 162.77 41.37 Favored 'Trans proline' 0 C--N 1.317 -1.109 0 O-C-N 123.405 1.213 . . . . 0.0 110.879 -179.59 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -48.64 -31.88 7.39 Favored 'General case' 0 N--CA 1.514 2.764 0 O-C-N 121.443 -0.785 . . . . 0.0 111.375 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.03 -35.14 40.22 Favored Glycine 0 N--CA 1.5 2.931 0 O-C-N 121.046 -1.034 . . . . 0.0 110.542 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -56.03 -32.93 64.47 Favored 'General case' 0 N--CA 1.511 2.621 0 O-C-N 120.973 -1.31 . . . . 0.0 110.554 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -54.61 -38.5 66.87 Favored 'General case' 0 N--CA 1.511 2.62 0 O-C-N 120.98 -1.075 . . . . 0.0 110.123 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.0 mtmt -58.64 -37.44 75.93 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.315 -0.866 . . . . 0.0 110.087 179.401 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.712 HD12 ' CD1' ' A' ' 23' ' ' LEU . 2.1 pt -114.86 34.79 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.152 -0.967 . . . . 0.0 110.452 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.5 OUTLIER -83.57 -43.79 0.81 Allowed Pre-proline 0 N--CA 1.509 2.48 0 O-C-N 121.052 -1.03 . . . . 0.0 113.12 -179.177 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.2 Cg_endo -76.13 -36.96 1.67 Allowed 'Trans proline' 0 N--CA 1.486 1.079 0 O-C-N 122.712 0.849 . . . . 0.0 111.455 -178.409 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.782 HG21 ' CE2' ' A' ' 62' ' ' TYR . 62.7 m -60.39 -44.24 95.84 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.004 -1.06 . . . . 0.0 109.972 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.712 ' CD1' HD12 ' A' ' 19' ' ' ILE . 3.3 mt -65.25 -40.06 93.51 Favored 'General case' 0 N--CA 1.506 2.327 0 C-N-CA 119.411 -0.916 . . . . 0.0 109.453 179.318 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 47.9 m -57.93 -35.51 71.19 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.25 -0.906 . . . . 0.0 110.1 179.285 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.59 -36.92 69.94 Favored 'General case' 0 N--CA 1.511 2.606 0 O-C-N 121.05 -1.031 . . . . 0.0 110.252 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.73 ' CD2' HD22 ' A' ' 55' ' ' LEU . 14.9 m-85 -58.57 -39.47 80.41 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.094 -1.004 . . . . 0.0 110.457 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -59.89 -38.74 83.09 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.073 -1.017 . . . . 0.0 110.662 -179.341 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.418 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.2 mp -66.7 -40.27 85.7 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.412 0 C-N-CA 119.196 -1.001 . . . . 0.0 109.241 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.6 tp60 -69.58 -46.5 66.21 Favored 'General case' 0 N--CA 1.506 2.342 0 C-N-CA 119.211 -0.996 . . . . 0.0 108.821 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.739 HD21 HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -64.21 -35.28 80.28 Favored 'General case' 0 N--CA 1.508 2.469 0 C-N-CA 119.283 -0.967 . . . . 0.0 108.923 178.359 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.31 -40.04 77.05 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 120.959 -1.088 . . . . 0.0 110.075 179.338 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -62.58 -50.24 72.08 Favored 'General case' 0 N--CA 1.507 2.392 0 C-N-CA 119.262 -0.975 . . . . 0.0 109.37 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.606 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -65.9 -41.5 91.4 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.38 -0.928 . . . . 0.0 109.088 179.002 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.441 ' CG ' HD23 ' A' ' 30' ' ' LEU . 10.1 mm-40 -63.18 -34.99 78.84 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.22 -0.925 . . . . 0.0 110.03 179.416 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.6 mtpt -84.1 -37.09 22.46 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.998 -1.064 . . . . 0.0 110.318 179.68 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 19.2 t70 . . . . . 0 N--CA 1.51 2.543 0 O-C-N 121.044 -1.035 . . . . 0.0 110.032 179.778 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.6 p . . . . . 0 N--CA 1.498 1.932 0 CA-C-O 120.586 0.232 . . . . 0.0 110.491 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -55.31 -37.19 67.04 Favored 'General case' 0 N--CA 1.511 2.6 0 O-C-N 121.153 -0.967 . . . . 0.0 110.172 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -59.05 -39.48 82.17 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.142 -0.974 . . . . 0.0 110.042 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -61.6 -41.23 97.15 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.119 -0.988 . . . . 0.0 109.888 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 49' ' ' LEU . 12.6 mt -59.46 -38.36 80.55 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.273 -0.892 . . . . 0.0 110.319 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.507 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.5 m0 -59.91 -36.79 77.74 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.165 -0.96 . . . . 0.0 110.174 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -60.36 -30.33 69.49 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.065 -1.022 . . . . 0.0 110.126 178.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.739 HG23 HD21 ' A' ' 30' ' ' LEU . 75.0 mt -72.33 -58.68 4.53 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.276 0 O-C-N 120.879 -1.138 . . . . 0.0 109.209 179.253 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 ptm -61.55 -29.55 70.08 Favored 'General case' 0 N--CA 1.508 2.465 0 C-N-CA 118.504 -1.278 . . . . 0.0 109.683 178.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 -68.85 -37.25 79.0 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.79 -1.194 . . . . 0.0 109.063 178.016 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.73 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.1 mt -53.02 -32.19 45.33 Favored 'General case' 0 N--CA 1.512 2.659 0 O-C-N 121.045 -1.035 . . . . 0.0 110.155 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.464 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 66.0 t60 -54.63 -38.06 66.4 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.062 -1.024 . . . . 0.0 110.072 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.45 ' CD2' HD21 ' A' ' 91' ' ' LEU . 5.5 m170 -61.35 -51.19 69.86 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.17 -0.956 . . . . 0.0 109.362 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -59.38 -33.98 71.87 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 119.474 -0.89 . . . . 0.0 109.668 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.461 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -68.18 -50.2 55.91 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.067 -1.021 . . . . 0.0 109.191 179.15 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 77.3 p -63.38 -38.44 91.16 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.093 -1.004 . . . . 0.0 109.154 178.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 10.4 ttm-85 -64.28 -39.86 94.79 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.165 -0.96 . . . . 0.0 109.184 178.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.782 ' CE2' HG21 ' A' ' 22' ' ' THR . 37.8 t80 -62.85 -51.26 67.73 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.113 -0.992 . . . . 0.0 109.292 179.367 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.803 HD12 ' HB2' ' A' ' 87' ' ' ALA . 77.5 mt -69.65 -38.99 77.65 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 O-C-N 121.257 -0.902 . . . . 0.0 109.179 179.312 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.41 ' HD2' HD13 ' A' ' 92' ' ' ILE . 11.8 t80 -65.48 -43.25 90.83 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.195 -0.941 . . . . 0.0 109.05 179.154 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.409 ' HA ' ' CD ' ' A' ' 69' ' ' LYS . 88.2 m -61.04 -41.26 96.25 Favored 'General case' 0 N--CA 1.503 2.186 0 C-N-CA 119.331 -0.948 . . . . 0.0 110.546 -179.501 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.582 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.22 -33.35 26.13 Favored 'General case' 0 N--CA 1.504 2.245 0 C-N-CA 118.926 -1.11 . . . . 0.0 112.52 -178.892 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.496 ' N ' HD12 ' A' ' 66' ' ' LEU . 52.0 t80 -86.33 -32.7 20.87 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 120.738 -1.226 . . . . 0.0 111.779 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -98.26 -15.74 19.69 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.752 -1.217 . . . . 0.0 112.759 -178.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.409 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 8.2 mtpt -124.88 -59.38 1.43 Allowed 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.394 -1.441 . . . . 0.0 110.778 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.404 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 4.5 ttp85 -62.43 -30.59 71.33 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.153 -0.967 . . . . 0.0 110.829 -179.558 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.4 tttp 57.68 42.49 23.72 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 120.816 -1.178 . . . . 0.0 110.073 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.82 36.3 3.71 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.404 -0.81 . . . . 0.0 109.82 179.336 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.761 HG13 HD23 ' A' ' 77' ' ' LEU . 14.2 tt -154.53 162.7 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.126 -0.984 . . . . 0.0 110.011 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 73.3 m -109.8 146.81 34.38 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.174 -0.954 . . . . 0.0 110.065 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -45.25 -32.45 1.94 Allowed 'General case' 0 N--CA 1.515 2.819 0 O-C-N 121.323 -0.861 . . . . 0.0 111.7 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -61.88 -50.63 71.45 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.956 -1.09 . . . . 0.0 109.374 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.761 HD23 HG13 ' A' ' 73' ' ' ILE . 30.6 tp -66.98 -43.75 82.21 Favored 'General case' 0 N--CA 1.505 2.296 0 C-N-CA 119.155 -1.018 . . . . 0.0 108.584 178.851 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.473 ' HA ' HD12 ' A' ' 81' ' ' LEU . 15.7 t80 -60.78 -38.38 85.07 Favored 'General case' 0 N--CA 1.506 2.344 0 C-N-CA 119.645 -0.822 . . . . 0.0 109.317 178.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.493 ' O ' HG22 ' A' ' 82' ' ' ILE . 20.1 t0 -74.63 -41.19 60.82 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.136 -0.977 . . . . 0.0 108.892 178.695 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.718 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 86.6 t90 -59.13 -39.14 81.41 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.184 -0.947 . . . . 0.0 109.259 178.861 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.473 HD12 ' HA ' ' A' ' 78' ' ' TYR . 14.8 mt -65.61 -54.75 23.4 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.211 -0.93 . . . . 0.0 109.223 179.072 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.578 HD12 ' HB3' ' A' ' 87' ' ' ALA . 0.7 OUTLIER -55.9 -27.63 22.94 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.423 0 O-C-N 121.123 -0.986 . . . . 0.0 110.701 -179.745 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.2 tttm -88.2 -19.46 26.86 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 120.899 -1.126 . . . . 0.0 111.628 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.446 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 77.0 mm-40 -102.77 23.74 11.65 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 120.623 -1.298 . . . . 0.0 111.843 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.41 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 15.6 tttt 76.34 69.57 0.07 Allowed 'General case' 0 N--CA 1.513 2.696 0 O-C-N 121.175 -0.953 . . . . 0.0 111.916 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.57 ' HE2' HD13 ' A' ' 23' ' ' LEU . 28.3 m-85 -132.04 -63.1 0.82 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.467 -0.771 . . . . 0.0 109.134 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.803 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -131.2 167.43 19.17 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.477 -0.764 . . . . 0.0 109.464 179.359 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.464 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 24.2 t70 -120.35 121.1 37.86 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.091 -1.006 . . . . 0.0 110.599 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 29.5 mtpt -67.75 -35.39 78.64 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 121.304 -0.873 . . . . 0.0 110.227 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.726 HD23 HD13 ' A' ' 106' ' ' LEU . 25.7 tp -58.56 -40.87 84.3 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.017 -1.052 . . . . 0.0 109.965 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.462 ' HA ' HD21 ' A' ' 106' ' ' LEU . 58.5 tp -70.58 -50.62 35.41 Favored 'General case' 0 N--CA 1.506 2.343 0 C-N-CA 119.185 -1.006 . . . . 0.0 108.652 179.145 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.41 HD13 ' HD2' ' A' ' 64' ' ' TYR . 63.2 mt -58.45 -34.83 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.457 0 C-N-CA 119.209 -0.996 . . . . 0.0 108.823 178.201 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.95 -39.51 87.29 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.049 -1.032 . . . . 0.0 109.135 178.371 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.424 ' HD2' ' CE1' ' A' ' 100' ' ' TYR . 4.9 mmtt -57.27 -44.66 84.17 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.098 -1.001 . . . . 0.0 109.174 179.176 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.3 m0 -63.41 -35.41 80.33 Favored 'General case' 0 N--CA 1.509 2.477 0 C-N-CA 119.562 -0.855 . . . . 0.0 110.1 179.399 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.01 -32.53 45.15 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.087 -1.008 . . . . 0.0 110.723 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.5 mmtt -53.69 -176.91 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.714 0 O-C-N 120.989 -1.069 . . . . 0.0 110.715 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.2 m -102.91 135.07 45.27 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.099 -1.001 . . . . 0.0 109.711 179.227 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.03 11.71 54.07 Favored Glycine 0 N--CA 1.494 2.524 0 C-N-CA 120.183 -1.008 . . . . 0.0 111.056 -179.391 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.585 ' HB3' HD23 ' A' ' 103' ' ' LEU . 50.4 m-85 -119.97 71.94 0.91 Allowed 'General case' 0 N--CA 1.492 1.641 0 CA-C-N 119.41 1.605 . . . . 0.0 109.823 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -97.37 -34.24 11.12 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.192 -0.942 . . . . 0.0 111.18 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.1 63.4 1.15 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.974 -1.079 . . . . 0.0 111.044 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.585 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.1 pp -111.57 152.98 26.95 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.0 -1.062 . . . . 0.0 109.67 179.182 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.429 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.8 p -113.17 -30.28 7.01 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.156 -0.965 . . . . 0.0 113.463 -179.138 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.634 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.9 m -143.47 -169.03 2.97 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 120.161 -1.587 . . . . 0.0 110.175 179.372 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.726 HD13 HD23 ' A' ' 90' ' ' LEU . 16.4 mt -95.39 -38.74 10.35 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.173 -0.954 . . . . 0.0 109.95 178.831 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 5.6 ttt85 -102.02 29.81 4.83 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.928 -1.108 . . . . 0.0 110.092 178.341 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.634 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.301 1.8 t -127.65 17.57 6.89 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.035 -1.041 . . . . 0.0 108.847 -179.564 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.461 HG23 ' C ' ' A' ' 108' ' ' CYS . 1.3 pt -158.36 38.66 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.277 0 O-C-N 120.982 -1.074 . . . . 0.0 110.216 -178.814 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.765 ' C ' HG23 ' A' ' 119' ' ' THR . 25.6 mt-30 . . . . . 0 N--CA 1.506 2.366 0 O-C-N 120.91 -1.119 . . . . 0.0 111.02 -178.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.765 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.4 m . . . . . 0 N--CA 1.494 1.754 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 48.7 t -94.37 154.21 17.59 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 119.401 -0.92 . . . . 0.0 108.804 178.391 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.953 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -74.66 -30.6 25.22 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.381 0 O-C-N 121.021 -1.05 . . . . 0.0 111.654 -178.706 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.493 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.7 p -59.46 -35.75 74.67 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 120.594 -1.316 . . . . 0.0 110.639 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.82 -31.1 64.38 Favored 'General case' 0 N--CA 1.512 2.655 0 O-C-N 120.95 -1.093 . . . . 0.0 109.998 178.679 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 60.7 t -82.61 124.54 77.45 Favored Pre-proline 0 N--CA 1.504 2.256 0 O-C-N 121.061 -1.024 . . . . 0.0 109.974 179.719 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -66.21 176.03 4.31 Favored 'Trans proline' 0 N--CA 1.489 1.242 0 O-C-N 123.172 1.09 . . . . 0.0 110.871 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.0 mmm-85 -75.15 -38.37 60.98 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.292 -0.88 . . . . 0.0 110.162 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.47 -40.01 77.63 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 121.042 -1.036 . . . . 0.0 109.994 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -68.38 -42.59 78.87 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.228 -0.92 . . . . 0.0 109.192 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.889 HD11 HD11 ' A' ' 121' ' ' ILE . 11.7 mt -65.1 -39.36 93.03 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.413 -0.915 . . . . 0.0 109.362 179.145 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -59.04 -37.96 78.19 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.116 -0.99 . . . . 0.0 110.061 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -58.34 -39.03 78.38 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 121.123 -0.986 . . . . 0.0 110.195 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -62.41 -46.93 86.35 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.268 -0.895 . . . . 0.0 109.724 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.532 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -59.21 -38.39 79.8 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.167 -0.958 . . . . 0.0 110.2 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 25.6 ttt85 -67.59 -38.97 84.79 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.19 -0.944 . . . . 0.0 110.107 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 16.9 mttp -72.01 -34.67 69.04 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.067 -1.02 . . . . 0.0 110.511 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -88.61 -19.67 25.96 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.044 -1.035 . . . . 0.0 111.626 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.38 33.36 9.45 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.532 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.6 t -133.07 -160.67 1.07 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.066 -1.256 . . . . 0.0 109.737 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -134.19 144.45 48.47 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.076 -1.015 . . . . 0.0 110.098 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.495 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.7 p -131.45 160.58 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.169 -0.957 . . . . 0.0 110.349 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 39.2 t -169.26 95.16 0.32 Allowed 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.219 -0.925 . . . . 0.0 110.928 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.953 ' CD1' HD12 ' A' ' 121' ' ' ILE . 72.9 t80 -99.25 159.88 14.68 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.273 -0.892 . . . . 0.0 110.767 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 10.1 m170 -138.43 -61.12 0.6 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -138.57 150.82 46.72 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.429 -0.794 . . . . 0.0 109.227 178.934 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 145' ' ' CYS . . . . . 0.429 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 30.6 p -93.6 154.12 18.02 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.015 -1.053 . . . . 0.0 110.941 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 19.7 m -73.55 -23.14 19.27 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.46 0 O-C-N 121.363 -0.835 . . . . 0.0 111.669 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 60.4 m170 -51.39 -62.06 1.85 Allowed 'General case' 0 N--CA 1.515 2.793 0 O-C-N 120.742 -1.224 . . . . 0.0 110.066 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.507 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 21.6 p -124.17 -163.8 1.19 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.265 -0.897 . . . . 0.0 110.385 179.543 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 149' ' ' GLY . . . . . 0.412 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.33 63.86 0.61 Allowed Glycine 0 N--CA 1.491 2.333 0 N-CA-C 107.997 -2.041 . . . . 0.0 107.997 178.333 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 34.4 t -101.09 142.41 32.59 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.289 -1.124 . . . . 0.0 109.687 -179.231 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -101.09 43.44 1.06 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.233 -0.917 . . . . 0.0 109.78 179.388 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 80.62 94.81 0.41 Allowed Glycine 0 N--CA 1.486 2.009 0 N-CA-C 109.87 -1.292 . . . . 0.0 109.87 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.8 p -107.85 123.95 49.36 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.272 -1.134 . . . . 0.0 110.205 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -143.1 141.66 31.3 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.081 -1.012 . . . . 0.0 110.089 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.497 1.897 0 O-C-N 121.167 -0.958 . . . . 0.0 109.617 179.544 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.698 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.506 2.365 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.26 162.12 42.51 Favored 'Trans proline' 0 C--N 1.317 -1.092 0 O-C-N 123.311 1.164 . . . . 0.0 110.794 -179.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -48.99 -31.77 8.02 Favored 'General case' 0 N--CA 1.514 2.758 0 O-C-N 121.474 -0.767 . . . . 0.0 111.339 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.53 -34.45 42.69 Favored Glycine 0 N--CA 1.5 2.909 0 O-C-N 120.987 -1.071 . . . . 0.0 110.431 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -54.65 -32.35 59.0 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 120.968 -1.313 . . . . 0.0 110.649 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -55.21 -38.95 69.09 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.012 -1.055 . . . . 0.0 110.194 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 29.5 mttt -58.2 -37.28 74.49 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.236 -0.915 . . . . 0.0 110.078 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.714 HG22 ' OH ' ' A' ' 62' ' ' TYR . 1.6 pt -114.62 34.61 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.2 -0.938 . . . . 0.0 110.323 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.439 ' NZ ' ' OG1' ' A' ' 24' ' ' THR . 0.0 OUTLIER -84.73 -43.04 0.7 Allowed Pre-proline 0 N--CA 1.51 2.534 0 O-C-N 120.974 -1.079 . . . . 0.0 113.331 -179.024 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.1 Cg_endo -75.6 -36.66 2.1 Favored 'Trans proline' 0 N--CA 1.487 1.092 0 O-C-N 122.566 0.772 . . . . 0.0 111.583 -178.207 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.577 HG21 ' CE2' ' A' ' 62' ' ' TYR . 75.2 m -60.4 -43.5 96.63 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.046 -1.034 . . . . 0.0 109.936 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.666 HD12 ' O ' ' A' ' 19' ' ' ILE . 3.3 mt -64.05 -39.38 93.96 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.233 -0.917 . . . . 0.0 109.571 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.439 ' OG1' ' NZ ' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -58.95 -37.0 75.74 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.062 -1.024 . . . . 0.0 110.15 179.595 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -57.38 -36.41 71.22 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.167 -0.958 . . . . 0.0 110.29 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.726 ' CD2' HD22 ' A' ' 55' ' ' LEU . 16.9 m-85 -57.43 -38.54 74.55 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.085 -1.009 . . . . 0.0 110.47 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -62.96 -22.48 66.84 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.168 -0.958 . . . . 0.0 111.854 -179.498 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.568 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.8 mp -81.26 -33.94 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.738 -1.226 . . . . 0.0 109.954 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -81.66 -34.59 30.68 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 120.949 -1.094 . . . . 0.0 109.438 178.665 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.755 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -75.83 -32.08 59.64 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.1 -1.0 . . . . 0.0 109.942 178.8 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.2 ptt85 -68.55 -34.84 76.54 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 120.874 -1.141 . . . . 0.0 109.998 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -68.15 -41.1 82.08 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.01 -1.056 . . . . 0.0 109.54 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.479 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -67.21 -43.35 82.29 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.269 -0.895 . . . . 0.0 109.325 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.6 mm100 -61.99 -38.79 89.92 Favored 'General case' 0 N--CA 1.506 2.373 0 C-N-CA 119.454 -0.898 . . . . 0.0 109.815 179.54 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 37.2 mmtm -62.41 -36.7 83.18 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.101 -1.0 . . . . 0.0 110.422 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.5 t70 . . . . . 0 N--CA 1.509 2.52 0 O-C-N 121.059 -1.026 . . . . 0.0 110.04 -179.891 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 18.7 m . . . . . 0 N--CA 1.499 1.984 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -57.74 -39.62 77.75 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.2 -0.937 . . . . 0.0 109.813 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -60.05 -38.55 83.11 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.15 -0.969 . . . . 0.0 109.917 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 34.2 tp60 -59.09 -42.54 90.7 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 121.068 -1.02 . . . . 0.0 109.895 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.46 HD13 ' HA ' ' A' ' 49' ' ' LEU . 4.2 mm? -58.96 -37.93 77.9 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.224 -0.923 . . . . 0.0 109.993 179.466 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.495 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 37.5 m0 -59.95 -36.16 76.48 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.198 -0.939 . . . . 0.0 109.435 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -64.74 -33.11 75.19 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 120.696 -1.252 . . . . 0.0 109.502 178.353 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.755 HG23 ' CG ' ' A' ' 30' ' ' LEU . 73.4 mt -71.24 -55.17 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.315 0 O-C-N 120.981 -1.074 . . . . 0.0 109.377 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.487 ' CE ' ' HB2' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -60.56 -32.22 71.3 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 118.687 -1.205 . . . . 0.0 109.5 179.015 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.18 -41.35 96.65 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 120.856 -1.153 . . . . 0.0 108.975 178.766 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.726 HD22 ' CD2' ' A' ' 26' ' ' PHE . 18.2 mt -54.27 -33.76 59.34 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.242 -0.911 . . . . 0.0 109.779 178.839 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.447 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 13.8 t60 -56.58 -40.62 75.53 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.105 -0.997 . . . . 0.0 109.545 179.238 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.489 ' CD2' HD21 ' A' ' 91' ' ' LEU . 7.5 m170 -61.13 -49.84 75.61 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.212 -0.93 . . . . 0.0 108.981 178.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -60.57 -38.46 84.66 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.289 -0.882 . . . . 0.0 109.302 179.055 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.456 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.71 -48.98 74.91 Favored 'General case' 0 N--CA 1.507 2.381 0 C-N-CA 119.33 -0.948 . . . . 0.0 109.015 179.187 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 76.8 p -66.71 -40.43 88.45 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.159 -0.963 . . . . 0.0 108.881 178.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 39.4 ttt85 -64.17 -37.16 86.46 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.115 -0.99 . . . . 0.0 109.502 178.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.714 ' OH ' HG22 ' A' ' 19' ' ' ILE . 40.7 t80 -60.98 -49.73 76.25 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.078 -1.014 . . . . 0.0 109.332 179.473 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.951 HD12 ' HB2' ' A' ' 87' ' ' ALA . 83.9 mt -75.87 -42.75 39.82 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.32 0 O-C-N 121.207 -0.933 . . . . 0.0 109.011 179.108 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.523 ' CE1' HG23 ' A' ' 92' ' ' ILE . 34.8 t80 -59.05 -26.73 64.85 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.384 -0.822 . . . . 0.0 110.352 178.732 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 67.1 m -87.28 -34.69 18.82 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.787 -1.195 . . . . 0.0 110.533 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.614 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -82.9 -34.17 26.71 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 120.77 -1.207 . . . . 0.0 112.151 -179.19 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.548 ' N ' HD12 ' A' ' 66' ' ' LEU . 54.2 t80 -86.54 -36.65 18.82 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 120.672 -1.267 . . . . 0.0 111.873 -179.395 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -95.83 -20.58 18.71 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.901 -1.124 . . . . 0.0 112.84 -178.255 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -119.34 -58.05 1.95 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 120.574 -1.329 . . . . 0.0 111.164 -179.6 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.423 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -64.77 -30.48 71.49 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.004 -1.06 . . . . 0.0 110.655 -179.841 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 58.74 44.26 17.42 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 120.852 -1.155 . . . . 0.0 110.047 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -115.91 37.61 3.59 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.416 -0.802 . . . . 0.0 109.836 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.785 HG13 HD23 ' A' ' 77' ' ' LEU . 14.2 tt -156.09 162.8 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.182 -0.949 . . . . 0.0 110.118 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.3 p -108.47 147.63 31.39 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.101 -0.999 . . . . 0.0 110.102 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.4 tttp -45.9 -32.67 2.79 Favored 'General case' 0 N--CA 1.516 2.861 0 O-C-N 121.381 -0.825 . . . . 0.0 111.574 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -61.75 -49.33 76.81 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.886 -1.134 . . . . 0.0 109.467 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.785 HD23 HG13 ' A' ' 73' ' ' ILE . 50.4 tp -67.42 -44.08 79.64 Favored 'General case' 0 N--CA 1.505 2.317 0 C-N-CA 119.212 -0.995 . . . . 0.0 108.606 178.838 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.474 ' HA ' HD12 ' A' ' 81' ' ' LEU . 21.8 t80 -60.98 -38.48 86.1 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.304 -0.872 . . . . 0.0 109.43 178.916 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -73.89 -42.3 60.9 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.083 -1.011 . . . . 0.0 108.942 178.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.698 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 81.6 t90 -58.3 -37.04 74.25 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.24 -0.913 . . . . 0.0 109.667 178.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.508 HD22 ' CD2' ' A' ' 86' ' ' TYR . 13.6 mt -68.96 -48.68 62.6 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.175 -0.953 . . . . 0.0 108.981 179.209 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.459 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 32.4 mm -57.1 -30.89 35.64 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.553 0 O-C-N 121.145 -0.972 . . . . 0.0 110.1 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -87.86 -22.24 24.55 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.896 -1.128 . . . . 0.0 111.804 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.444 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 72.9 mm-40 -100.42 21.17 13.57 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 120.696 -1.253 . . . . 0.0 111.998 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt 73.56 79.42 0.13 Allowed 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.021 -1.049 . . . . 0.0 111.472 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.641 ' HE2' HD13 ' A' ' 23' ' ' LEU . 31.5 m-85 -137.35 -64.92 0.55 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.554 -0.716 . . . . 0.0 109.669 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.951 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -115.47 173.08 6.71 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.425 -0.797 . . . . 0.0 109.212 179.359 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.447 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 3.5 t0 -116.95 104.13 10.97 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.072 -1.017 . . . . 0.0 110.403 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.77 -39.23 84.17 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.225 -0.922 . . . . 0.0 109.857 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 18.1 tp -60.92 -40.54 93.58 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.219 -0.925 . . . . 0.0 109.947 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.587 ' HA ' HD21 ' A' ' 106' ' ' LEU . 45.5 tp -70.65 -49.06 51.43 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.266 -0.973 . . . . 0.0 108.875 179.346 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.523 HG23 ' CE1' ' A' ' 64' ' ' TYR . 49.6 mt -62.29 -32.08 53.71 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.32 0 C-N-CA 119.287 -0.965 . . . . 0.0 108.917 178.34 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -71.76 -42.08 67.64 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.02 -1.05 . . . . 0.0 109.157 178.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.496 ' HD3' HD23 ' A' ' 106' ' ' LEU . 13.0 mttp -60.73 -40.1 91.13 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.073 -1.017 . . . . 0.0 110.07 179.346 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 3.4 m0 -66.03 -38.01 87.33 Favored 'General case' 0 N--CA 1.509 2.514 0 C-N-CA 119.188 -1.005 . . . . 0.0 109.967 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.19 -35.27 63.96 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.113 -0.992 . . . . 0.0 110.179 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 17.0 mmtt -53.31 -178.82 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.671 0 O-C-N 121.124 -0.985 . . . . 0.0 110.639 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 18.4 m -107.09 142.05 37.37 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.261 -0.899 . . . . 0.0 109.438 179.087 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 101.98 -25.39 28.02 Favored Glycine 0 N--CA 1.494 2.508 0 C-N-CA 119.793 -1.194 . . . . 0.0 110.32 -179.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -91.71 57.88 3.34 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 120.691 -1.476 . . . . 0.0 110.111 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -70.65 -38.3 73.82 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.07 -1.019 . . . . 0.0 109.934 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.26 87.88 2.81 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.177 -0.952 . . . . 0.0 110.153 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.962 HD13 HD13 ' A' ' 109' ' ' ILE . 15.8 tp -120.35 133.01 55.52 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.187 -0.946 . . . . 0.0 109.733 -179.842 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.446 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.1 p -106.21 -36.03 7.01 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.175 -0.953 . . . . 0.0 112.165 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.866 ' O ' HD11 ' A' ' 103' ' ' LEU . 7.1 m -140.17 -169.11 2.68 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.26 -1.525 . . . . 0.0 109.461 178.666 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.587 HD21 ' HA ' ' A' ' 91' ' ' LEU . 15.3 mt -98.45 -36.1 10.05 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.064 -1.022 . . . . 0.0 110.662 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 18.3 ttm-85 -103.57 35.25 2.66 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 120.903 -1.123 . . . . 0.0 109.06 177.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.68 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.306 1.7 t -129.12 18.91 5.97 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.273 -0.892 . . . . 0.0 109.011 -178.907 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.962 HD13 HD13 ' A' ' 103' ' ' LEU . 1.3 pt -158.14 38.31 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 O-C-N 120.929 -1.107 . . . . 0.0 110.288 -178.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.576 ' C ' HG23 ' A' ' 119' ' ' THR . 11.7 tm0? . . . . . 0 N--CA 1.509 2.525 0 O-C-N 120.878 -1.139 . . . . 0.0 110.79 -178.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.576 HG23 ' C ' ' A' ' 110' ' ' GLN . 2.8 m . . . . . 0 N--CA 1.495 1.821 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.447 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 48.9 t -102.4 154.98 18.56 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.241 -0.912 . . . . 0.0 109.74 179.273 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.802 HD12 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -73.39 -36.83 49.73 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.348 0 O-C-N 121.202 -0.936 . . . . 0.0 111.016 -179.422 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.44 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 6.5 p -53.35 -31.39 44.26 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 120.775 -1.203 . . . . 0.0 111.262 -178.726 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.73 -32.89 72.15 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 120.98 -1.075 . . . . 0.0 109.765 178.334 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 53.0 t -81.57 125.5 78.3 Favored Pre-proline 0 N--CA 1.505 2.319 0 O-C-N 121.032 -1.042 . . . . 0.0 110.075 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.522 ' O ' HD12 ' A' ' 129' ' ' LEU . 40.0 Cg_endo -67.18 175.9 5.24 Favored 'Trans proline' 0 N--CA 1.488 1.199 0 O-C-N 123.191 1.1 . . . . 0.0 110.639 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.11 -36.74 61.65 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.241 -0.912 . . . . 0.0 110.739 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.98 -41.65 83.41 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 120.946 -1.096 . . . . 0.0 110.024 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -68.16 -41.63 81.28 Favored 'General case' 0 N--CA 1.506 2.356 0 C-N-CA 119.317 -0.953 . . . . 0.0 109.221 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.523 HD11 HD11 ' A' ' 121' ' ' ILE . 2.5 mt -62.79 -39.52 94.51 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.236 -0.915 . . . . 0.0 109.669 179.235 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -59.24 -39.56 83.14 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.191 -0.943 . . . . 0.0 110.027 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -60.19 -39.26 85.89 Favored 'General case' 0 N--CA 1.508 2.46 0 C-N-CA 119.385 -0.926 . . . . 0.0 110.05 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -61.86 -46.09 90.92 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.231 -0.918 . . . . 0.0 109.812 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.487 ' HB1' ' HA ' ' A' ' 139' ' ' GLN . . . -61.53 -41.21 97.0 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.177 -0.952 . . . . 0.0 109.916 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 10.0 mmt-85 -65.57 -33.89 76.98 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.228 -0.92 . . . . 0.0 110.343 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 26.2 ttmt -76.82 -31.67 57.07 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.042 -1.036 . . . . 0.0 111.016 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 4.0 tppt? -99.93 23.38 9.87 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 120.945 -1.097 . . . . 0.0 111.762 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.89 46.74 49.11 Favored Glycine 0 N--CA 1.5 2.913 0 O-C-N 120.732 -1.23 . . . . 0.0 110.951 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.438 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 10.1 t -146.61 -163.54 1.77 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.065 -1.256 . . . . 0.0 110.295 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' GLN . . . . . 0.487 ' HA ' ' HB1' ' A' ' 133' ' ' ALA . 30.5 mt-30 -137.12 151.02 48.38 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.105 -0.997 . . . . 0.0 110.396 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.473 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.3 p -132.9 161.1 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.23 -0.919 . . . . 0.0 110.004 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 47.3 t -169.3 75.73 0.09 Allowed 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.172 -0.955 . . . . 0.0 111.211 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.802 ' CG ' HD12 ' A' ' 121' ' ' ILE . 36.8 t80 -91.86 161.62 14.77 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.263 -0.898 . . . . 0.0 109.975 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 3.3 m80 -139.54 -60.91 0.55 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.517 -0.739 . . . . 0.0 109.157 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.26 152.27 50.69 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 179.259 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 25.4 p -98.66 155.24 17.42 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.313 -0.867 . . . . 0.0 110.532 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.3 p -75.33 -23.31 16.92 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.572 0 O-C-N 121.271 -0.893 . . . . 0.0 112.045 -179.077 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 62.1 m170 -52.27 -44.54 65.02 Favored 'General case' 0 N--CA 1.516 2.867 0 O-C-N 120.667 -1.27 . . . . 0.0 109.592 179.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.495 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 29.3 p -140.15 -169.41 2.74 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.34 -0.85 . . . . 0.0 110.599 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 149' ' ' GLY . . . . . 0.446 ' CA ' ' CE3' ' A' ' 50' ' ' TRP . . . -98.98 56.93 0.93 Allowed Glycine 0 N--CA 1.489 2.169 0 N-CA-C 107.426 -2.27 . . . . 0.0 107.426 178.268 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 24.1 t -101.19 142.51 32.52 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.466 -1.02 . . . . 0.0 109.672 -178.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 2.4 ttp85 -97.4 53.02 1.13 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.258 -0.901 . . . . 0.0 109.379 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.42 97.55 0.03 OUTLIER Glycine 0 N--CA 1.488 2.139 0 N-CA-C 109.559 -1.417 . . . . 0.0 109.559 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 p -107.57 128.69 54.75 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.319 -1.106 . . . . 0.0 110.338 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -136.79 141.58 42.92 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.157 -0.964 . . . . 0.0 110.108 -179.593 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.498 1.927 0 O-C-N 121.211 -0.931 . . . . 0.0 109.672 179.521 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.733 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.503 2.198 0 CA-C-O 120.45 0.167 . . . . 0.0 110.69 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -73.75 162.71 38.93 Favored 'Trans proline' 0 C--N 1.318 -1.037 0 O-C-N 123.272 1.143 . . . . 0.0 110.52 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -48.94 -31.95 8.23 Favored 'General case' 0 N--CA 1.516 2.845 0 O-C-N 121.317 -0.864 . . . . 0.0 111.327 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.93 -34.46 51.77 Favored Glycine 0 N--CA 1.498 2.775 0 O-C-N 121.01 -1.056 . . . . 0.0 110.517 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -54.62 -31.8 57.83 Favored 'General case' 0 N--CA 1.511 2.621 0 O-C-N 120.924 -1.339 . . . . 0.0 110.821 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -54.24 -37.83 65.07 Favored 'General case' 0 N--CA 1.512 2.652 0 O-C-N 120.886 -1.134 . . . . 0.0 110.286 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 15.8 mttm -59.27 -37.62 78.07 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.254 -0.904 . . . . 0.0 110.139 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.868 HD12 HD11 ' A' ' 23' ' ' LEU . 1.7 pt -116.3 34.78 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 O-C-N 121.166 -0.959 . . . . 0.0 110.498 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.42 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.4 OUTLIER -85.1 -43.72 0.67 Allowed Pre-proline 0 N--CA 1.509 2.52 0 O-C-N 121.038 -1.039 . . . . 0.0 113.529 -178.911 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.42 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.1 Cg_endo -74.8 -34.14 4.32 Favored 'Trans proline' 0 N--CA 1.487 1.095 0 O-C-N 122.529 0.752 . . . . 0.0 111.96 -177.855 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.546 HG21 ' CE2' ' A' ' 62' ' ' TYR . 91.6 m -62.06 -47.78 83.16 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 120.909 -1.119 . . . . 0.0 109.792 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.868 HD11 HD12 ' A' ' 19' ' ' ILE . 7.7 mt -62.45 -39.53 93.68 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.27 -0.894 . . . . 0.0 109.519 179.357 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.7 m -57.1 -34.82 68.73 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.17 -0.956 . . . . 0.0 110.206 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -56.62 -37.13 70.27 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.094 -1.004 . . . . 0.0 110.266 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.606 ' CD2' HD22 ' A' ' 55' ' ' LEU . 20.2 m-85 -56.97 -37.4 71.54 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.141 -0.974 . . . . 0.0 110.254 179.576 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -56.45 -27.81 57.86 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.23 -0.919 . . . . 0.0 110.975 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.486 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.7 mp -77.75 -35.82 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.45 0 O-C-N 121.044 -1.035 . . . . 0.0 109.411 179.384 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -79.83 -40.03 29.41 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.006 -1.059 . . . . 0.0 108.603 178.408 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.057 HD11 HG23 ' A' ' 52' ' ' ILE . 7.0 tp -69.46 -34.04 73.81 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.238 -0.914 . . . . 0.0 110.364 179.066 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -71.41 -35.72 71.09 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 118.833 -1.147 . . . . 0.0 109.854 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -65.33 -39.95 93.05 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.106 -0.996 . . . . 0.0 109.645 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.438 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -72.76 -42.02 64.45 Favored 'General case' 0 N--CA 1.504 2.265 0 C-N-CA 119.167 -1.013 . . . . 0.0 109.031 179.01 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -62.92 -34.11 76.76 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.282 -0.887 . . . . 0.0 109.936 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 40.7 mmtt -84.4 -32.68 24.01 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.036 -1.04 . . . . 0.0 110.78 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.1 t70 . . . . . 0 N--CA 1.511 2.616 0 O-C-N 120.985 -1.072 . . . . 0.0 110.392 179.88 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.8 t . . . . . 0 N--CA 1.504 2.236 0 CA-C-O 120.432 0.158 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 50.0 m-20 -55.85 -38.99 70.83 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 120.982 -1.074 . . . . 0.0 110.122 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -62.36 -41.57 98.72 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.236 -0.915 . . . . 0.0 109.67 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 55.7 tp60 -61.98 -40.62 96.24 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.19 -0.944 . . . . 0.0 109.681 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.408 HD23 HD12 ' A' ' 52' ' ' ILE . 12.5 mt -58.68 -39.02 79.51 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.172 -0.955 . . . . 0.0 109.979 179.702 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.502 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 52.8 m0 -58.56 -36.84 74.55 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.153 -0.967 . . . . 0.0 109.826 179.398 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -60.71 -30.19 69.81 Favored 'General case' 0 N--CA 1.506 2.325 0 O-C-N 121.08 -1.013 . . . . 0.0 109.733 178.312 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 1.057 HG23 HD11 ' A' ' 30' ' ' LEU . 22.6 mt -71.36 -60.64 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.226 0 O-C-N 120.952 -1.092 . . . . 0.0 108.845 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.47 ' HE1' ' O ' ' A' ' 147' ' ' HIS . 0.9 OUTLIER -60.51 -28.69 68.58 Favored 'General case' 0 N--CA 1.51 2.537 0 C-N-CA 118.547 -1.261 . . . . 0.0 109.774 178.61 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -72.24 -39.22 68.62 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 120.875 -1.14 . . . . 0.0 108.89 178.028 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.606 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.0 mt -54.04 -33.71 58.06 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 121.105 -0.997 . . . . 0.0 110.269 178.84 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.44 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 12.9 t60 -57.03 -35.39 69.22 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.089 -1.007 . . . . 0.0 110.438 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.528 ' NE2' HD21 ' A' ' 91' ' ' LEU . 6.3 m170 -60.56 -50.65 72.69 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 120.981 -1.074 . . . . 0.0 109.603 179.314 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -58.72 -35.83 73.29 Favored 'General case' 0 N--CA 1.508 2.449 0 C-N-CA 119.501 -0.88 . . . . 0.0 109.596 179.167 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.449 ' CD ' ' CD1' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -68.27 -49.61 59.37 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.079 -1.013 . . . . 0.0 109.176 179.003 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.1 p -62.12 -38.46 89.02 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.201 -0.937 . . . . 0.0 109.356 179.04 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 37.5 ttt-85 -65.12 -38.22 89.97 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.092 -1.005 . . . . 0.0 109.384 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.582 ' OH ' HG22 ' A' ' 19' ' ' ILE . 34.1 t80 -59.78 -48.87 79.95 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.211 -0.93 . . . . 0.0 109.368 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.78 HD12 ' HB2' ' A' ' 87' ' ' ALA . 92.0 mt -76.27 -44.25 36.42 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.266 0 C-N-CA 119.505 -0.878 . . . . 0.0 108.869 179.121 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.516 ' CE1' HG23 ' A' ' 92' ' ' ILE . 40.9 t80 -58.92 -25.7 63.67 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.323 -0.86 . . . . 0.0 110.365 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.465 HG23 ' HD3' ' A' ' 69' ' ' LYS . 88.4 m -87.25 -36.09 18.13 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.756 -1.215 . . . . 0.0 110.373 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.564 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -82.92 -33.08 26.93 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 120.813 -1.179 . . . . 0.0 112.34 -179.267 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.518 ' N ' HD12 ' A' ' 66' ' ' LEU . 33.3 t80 -86.42 -34.61 20.1 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 120.707 -1.246 . . . . 0.0 111.922 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.402 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 14.4 m-85 -96.21 -22.02 17.52 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 120.903 -1.123 . . . . 0.0 112.986 -178.181 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.465 ' HD3' HG23 ' A' ' 65' ' ' THR . 8.5 mtpt -112.59 -58.13 2.19 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 120.527 -1.358 . . . . 0.0 110.979 -179.677 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.401 ' HB2' ' HA ' ' A' ' 66' ' ' LEU . 10.2 mmm-85 -71.7 -29.39 64.51 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.139 -0.975 . . . . 0.0 110.919 -179.571 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 58.83 43.91 17.61 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.815 -1.178 . . . . 0.0 109.953 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.01 35.08 3.52 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.302 -0.874 . . . . 0.0 109.807 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.778 HG13 HD23 ' A' ' 77' ' ' LEU . 13.4 tt -153.1 162.7 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.23 -0.919 . . . . 0.0 109.784 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.4 p -107.44 146.76 31.31 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.089 -1.007 . . . . 0.0 110.415 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -46.34 -32.31 3.09 Favored 'General case' 0 N--CA 1.516 2.869 0 O-C-N 121.307 -0.87 . . . . 0.0 111.469 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -62.14 -49.68 74.88 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 120.894 -1.129 . . . . 0.0 109.302 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.778 HD23 HG13 ' A' ' 73' ' ' ILE . 49.5 tp -67.28 -43.46 81.74 Favored 'General case' 0 N--CA 1.505 2.295 0 C-N-CA 119.185 -1.006 . . . . 0.0 108.552 178.811 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.416 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 17.5 t80 -61.64 -38.87 89.27 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.291 -0.88 . . . . 0.0 109.432 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -72.22 -42.41 65.77 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 120.998 -1.064 . . . . 0.0 108.991 178.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.733 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 84.2 t90 -57.94 -36.89 73.16 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.214 -0.929 . . . . 0.0 109.691 179.159 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.659 HD22 ' CD2' ' A' ' 86' ' ' TYR . 30.7 mt -68.75 -46.06 69.82 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.129 -0.982 . . . . 0.0 109.116 179.296 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.2 mm -58.46 -32.84 46.47 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.532 0 O-C-N 121.26 -0.9 . . . . 0.0 110.001 179.446 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.5 mmtp -89.16 -8.79 52.98 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 120.895 -1.128 . . . . 0.0 112.278 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.452 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 75.7 mm-40 -112.17 21.55 15.71 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 120.556 -1.34 . . . . 0.0 112.04 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt 74.05 77.9 0.12 Allowed 'General case' 0 N--CA 1.51 2.543 0 O-C-N 120.97 -1.081 . . . . 0.0 111.456 179.488 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.681 ' HE2' HD13 ' A' ' 23' ' ' LEU . 33.6 m-85 -137.06 -63.0 0.62 Allowed 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.558 -0.714 . . . . 0.0 109.49 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.78 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -126.38 175.97 7.47 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.403 -0.811 . . . . 0.0 109.44 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.44 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 19.1 t0 -116.24 105.5 12.64 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.114 -0.991 . . . . 0.0 110.505 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 13.1 mmmt -61.34 -39.74 91.69 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.228 -0.92 . . . . 0.0 109.655 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.773 HD23 HD13 ' A' ' 106' ' ' LEU . 26.9 tp -60.49 -42.41 96.28 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.104 -0.997 . . . . 0.0 109.658 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.776 ' HA ' HD21 ' A' ' 106' ' ' LEU . 43.4 tp -67.78 -49.36 62.82 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.291 -0.964 . . . . 0.0 109.119 179.332 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.516 HG23 ' CE1' ' A' ' 64' ' ' TYR . 34.3 mt -58.54 -29.88 39.97 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.48 0 C-N-CA 119.27 -0.972 . . . . 0.0 109.212 178.467 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.68 -46.2 66.62 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 120.911 -1.118 . . . . 0.0 109.328 178.737 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.514 ' HD3' HD23 ' A' ' 106' ' ' LEU . 6.4 mttp -58.16 -38.94 77.61 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.094 -1.004 . . . . 0.0 110.084 179.194 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.6 m0 -66.27 -39.98 89.81 Favored 'General case' 0 N--CA 1.508 2.467 0 C-N-CA 119.318 -0.953 . . . . 0.0 109.515 179.24 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.05 -33.65 70.49 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.282 -0.886 . . . . 0.0 110.358 179.468 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.6 mmtp -53.78 -177.17 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.699 0 O-C-N 121.037 -1.039 . . . . 0.0 110.651 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -106.34 133.22 51.37 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.183 -0.948 . . . . 0.0 109.797 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.95 3.1 56.0 Favored Glycine 0 N--CA 1.493 2.487 0 C-N-CA 120.06 -1.067 . . . . 0.0 111.31 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -108.62 48.48 0.86 Allowed 'General case' 0 N--CA 1.498 1.968 0 CA-C-N 119.645 1.723 . . . . 0.0 110.115 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -64.58 -39.51 93.87 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.213 -0.93 . . . . 0.0 109.911 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.78 104.26 11.78 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.153 -0.967 . . . . 0.0 109.979 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.906 HD13 HD13 ' A' ' 109' ' ' ILE . 8.9 tp -141.59 132.48 25.93 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.17 -0.956 . . . . 0.0 109.713 -179.537 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.444 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.4 p -108.4 -37.3 6.01 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.176 -0.953 . . . . 0.0 112.305 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.816 ' O ' HD11 ' A' ' 103' ' ' LEU . 7.6 m -140.76 -168.93 2.69 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 120.265 -1.522 . . . . 0.0 109.924 178.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.776 HD21 ' HA ' ' A' ' 91' ' ' LEU . 32.7 mt -97.69 -36.74 10.15 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.035 -1.04 . . . . 0.0 110.462 179.272 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 12.1 ttm-85 -103.11 32.72 3.6 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 120.92 -1.112 . . . . 0.0 109.473 178.072 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.657 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.309 1.7 t -128.98 16.47 6.24 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.207 -0.933 . . . . 0.0 109.219 -179.066 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.906 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -158.89 37.99 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 O-C-N 120.843 -1.161 . . . . 0.0 110.604 -178.732 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.575 ' O ' HG23 ' A' ' 119' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.099 0 O-C-N 120.708 -1.245 . . . . 0.0 111.79 -178.433 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.575 HG23 ' O ' ' A' ' 110' ' ' GLN . 2.5 m . . . . . 0 N--CA 1.493 1.711 0 N-CA-C 110.216 -0.291 . . . . 0.0 110.216 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 45.6 t -92.14 154.44 18.7 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.296 -0.878 . . . . 0.0 109.038 178.713 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.813 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -71.31 -36.33 61.17 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.42 0 O-C-N 121.101 -1.0 . . . . 0.0 110.882 -179.159 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.446 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.4 p -55.37 -34.35 64.23 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 120.828 -1.17 . . . . 0.0 110.869 -179.004 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.496 ' HG3' HG22 ' A' ' 109' ' ' ILE . 3.0 ttp85 -59.36 -35.55 74.1 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.006 -1.059 . . . . 0.0 109.65 178.399 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 55.6 t -78.91 125.03 84.67 Favored Pre-proline 0 N--CA 1.503 2.202 0 O-C-N 121.171 -0.956 . . . . 0.0 109.823 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.462 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.2 Cg_endo -65.03 174.92 4.26 Favored 'Trans proline' 0 N--CA 1.487 1.133 0 O-C-N 123.143 1.075 . . . . 0.0 110.734 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -75.05 -36.18 61.83 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.203 -0.936 . . . . 0.0 110.719 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.53 -40.9 79.79 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.005 -1.06 . . . . 0.0 109.985 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 7.7 tp60 -69.68 -41.32 75.63 Favored 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 119.341 -0.944 . . . . 0.0 109.274 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.573 HD11 HD11 ' A' ' 121' ' ' ILE . 3.1 mt -65.5 -38.77 90.67 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.204 -0.935 . . . . 0.0 109.554 179.122 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -61.25 -39.91 92.09 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.181 -0.949 . . . . 0.0 109.757 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -59.03 -37.13 76.25 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.179 -0.951 . . . . 0.0 110.326 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -61.4 -44.97 96.22 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.115 -0.991 . . . . 0.0 110.057 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.428 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -60.8 -41.68 96.13 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.172 -0.955 . . . . 0.0 109.914 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 11.0 mtt180 -59.46 -36.9 76.85 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.143 -0.973 . . . . 0.0 110.178 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 44.6 mttm -65.93 -33.77 76.59 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.075 -1.016 . . . . 0.0 110.81 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 35.6 mtmt -105.51 22.39 15.56 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 120.931 -1.106 . . . . 0.0 111.923 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.72 46.47 54.16 Favored Glycine 0 N--CA 1.499 2.89 0 O-C-N 120.608 -1.307 . . . . 0.0 110.799 179.184 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.428 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 9.4 t -138.84 -163.5 1.48 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.197 -1.178 . . . . 0.0 110.088 179.639 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -138.6 146.62 41.99 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.098 -1.001 . . . . 0.0 110.549 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.429 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.9 p -131.0 161.46 40.98 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.185 -0.947 . . . . 0.0 109.723 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 42.1 t -166.75 83.56 0.26 Allowed 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.128 -0.982 . . . . 0.0 111.305 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.792 ' CG ' HD12 ' A' ' 121' ' ' ILE . 38.9 t80 -95.0 161.75 14.01 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.295 -0.878 . . . . 0.0 110.049 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -140.67 -60.61 0.51 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.571 -0.705 . . . . 0.0 109.19 179.011 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.22 151.25 50.94 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.437 -0.789 . . . . 0.0 109.293 178.807 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 28.0 p -97.06 154.43 17.33 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.122 -0.986 . . . . 0.0 111.065 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 19.7 m -74.06 -23.35 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.433 0 O-C-N 121.395 -0.816 . . . . 0.0 111.676 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' HIS . . . . . 0.47 ' O ' ' HE1' ' A' ' 53' ' ' MET . 61.8 m170 -51.68 -52.01 51.44 Favored 'General case' 0 N--CA 1.515 2.779 0 O-C-N 120.717 -1.239 . . . . 0.0 109.967 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.502 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 26.4 p -133.58 -164.88 1.55 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.329 -0.857 . . . . 0.0 110.518 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.59 56.51 0.78 Allowed Glycine 0 N--CA 1.492 2.386 0 N-CA-C 107.925 -2.07 . . . . 0.0 107.925 178.32 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 18.3 t -101.39 144.07 30.65 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.33 -1.1 . . . . 0.0 109.912 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 7.6 ttm-85 -98.49 50.27 0.99 Allowed 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.3 -0.875 . . . . 0.0 109.531 179.285 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 69.73 98.82 0.04 OUTLIER Glycine 0 N--CA 1.488 2.106 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.0 p -111.13 128.32 55.85 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.237 -1.155 . . . . 0.0 110.229 179.658 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -144.95 137.31 26.07 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.075 -1.016 . . . . 0.0 110.2 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.502 2.156 0 O-C-N 121.208 -0.933 . . . . 0.0 110.559 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.693 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.499 1.987 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.435 ' HG2' HD13 ' A' ' 77' ' ' LEU . 44.2 Cg_endo -69.94 162.7 41.19 Favored 'Trans proline' 0 C--N 1.317 -1.125 0 O-C-N 123.315 1.166 . . . . 0.0 110.812 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -48.7 -31.83 7.46 Favored 'General case' 0 N--CA 1.514 2.758 0 O-C-N 121.451 -0.78 . . . . 0.0 111.339 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.67 -34.29 43.47 Favored Glycine 0 N--CA 1.499 2.861 0 O-C-N 120.941 -1.1 . . . . 0.0 110.609 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -55.6 -33.19 63.73 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 120.965 -1.315 . . . . 0.0 110.688 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -54.03 -37.65 64.33 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 121.04 -1.037 . . . . 0.0 110.187 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -58.9 -37.45 76.64 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.288 -0.882 . . . . 0.0 110.072 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.727 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.5 pt -116.43 34.5 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 O-C-N 121.118 -0.989 . . . . 0.0 110.554 179.689 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -82.89 -44.29 0.89 Allowed Pre-proline 0 N--CA 1.51 2.544 0 O-C-N 121.011 -1.055 . . . . 0.0 112.871 -179.252 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.4 Cg_endo -76.68 -36.12 1.74 Allowed 'Trans proline' 0 N--CA 1.486 1.087 0 O-C-N 122.642 0.811 . . . . 0.0 111.407 -178.464 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.87 HG21 ' CE2' ' A' ' 62' ' ' TYR . 87.3 m -58.71 -41.77 87.1 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 120.986 -1.071 . . . . 0.0 109.964 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.727 HD12 ' O ' ' A' ' 19' ' ' ILE . 2.3 mt -66.84 -40.97 88.14 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.263 -0.898 . . . . 0.0 109.397 179.481 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.6 m -59.42 -35.26 73.68 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.199 -0.938 . . . . 0.0 110.084 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -57.04 -36.94 71.07 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 121.036 -1.04 . . . . 0.0 110.266 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.597 ' CD2' HD22 ' A' ' 55' ' ' LEU . 12.5 m-85 -58.18 -37.95 75.74 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.136 -0.977 . . . . 0.0 110.497 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -60.74 -39.78 89.98 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.147 -0.971 . . . . 0.0 110.602 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.414 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.1 mp -65.83 -41.57 90.4 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 C-N-CA 119.23 -0.988 . . . . 0.0 109.039 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -67.78 -48.16 67.13 Favored 'General case' 0 N--CA 1.505 2.319 0 C-N-CA 119.224 -0.99 . . . . 0.0 108.643 178.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.702 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -62.93 -36.39 83.24 Favored 'General case' 0 N--CA 1.509 2.507 0 C-N-CA 119.35 -0.94 . . . . 0.0 108.936 178.356 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -57.31 -41.8 80.59 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.061 -1.025 . . . . 0.0 109.879 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -61.99 -45.28 94.33 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 119.393 -0.923 . . . . 0.0 109.862 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.548 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -68.72 -39.68 80.29 Favored 'General case' 0 N--CA 1.507 2.385 0 C-N-CA 119.343 -0.943 . . . . 0.0 109.652 179.479 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.519 ' HG3' HD23 ' A' ' 30' ' ' LEU . 56.6 mt-30 -68.93 -31.13 69.81 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.218 -0.926 . . . . 0.0 110.647 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.9 mtpt -98.02 -29.17 13.43 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.94 -1.1 . . . . 0.0 111.886 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 . . . . . 0 N--CA 1.511 2.59 0 O-C-N 120.757 -1.214 . . . . 0.0 110.344 -179.837 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.501 2.077 0 CA-C-O 120.608 0.242 . . . . 0.0 110.871 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -57.85 -40.31 79.84 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.098 -1.001 . . . . 0.0 110.151 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -59.94 -39.29 85.02 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.26 -0.9 . . . . 0.0 110.052 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -62.36 -45.94 90.93 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.174 -0.954 . . . . 0.0 109.736 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.449 HD23 ' HA ' ' A' ' 49' ' ' LEU . 23.9 mt -59.21 -36.74 75.94 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.177 -0.952 . . . . 0.0 110.32 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 47.7 m0 -58.63 -37.74 76.56 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 121.035 -1.04 . . . . 0.0 110.038 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -61.22 -32.86 72.64 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 119.148 -1.021 . . . . 0.0 109.701 178.333 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.702 HG23 ' CG ' ' A' ' 30' ' ' LEU . 74.1 mt -71.06 -59.65 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.283 0 O-C-N 121.092 -1.005 . . . . 0.0 108.883 179.101 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -61.1 -29.4 69.73 Favored 'General case' 0 N--CA 1.511 2.591 0 C-N-CA 118.544 -1.263 . . . . 0.0 109.754 178.57 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -69.48 -37.15 77.14 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.79 -1.194 . . . . 0.0 109.062 178.215 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.597 HD22 ' CD2' ' A' ' 26' ' ' PHE . 10.9 mt -53.31 -33.55 53.81 Favored 'General case' 0 N--CA 1.511 2.616 0 O-C-N 120.982 -1.074 . . . . 0.0 110.179 179.048 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.468 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 71.1 t60 -54.47 -38.28 66.22 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 120.965 -1.085 . . . . 0.0 110.059 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.448 ' CD2' HD21 ' A' ' 91' ' ' LEU . 6.6 m170 -61.09 -48.08 83.35 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.193 -0.942 . . . . 0.0 109.359 179.369 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -59.39 -36.57 76.06 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.279 -0.888 . . . . 0.0 109.676 179.021 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.417 ' HD2' ' CD2' ' A' ' 26' ' ' PHE . 8.0 mtp85 -63.59 -49.58 72.79 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.125 -0.984 . . . . 0.0 109.477 179.384 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 93.8 p -63.83 -40.74 97.34 Favored 'General case' 0 N--CA 1.504 2.269 0 C-N-CA 119.301 -0.96 . . . . 0.0 109.118 179.18 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.9 ttt85 -62.14 -38.85 90.55 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.192 -0.943 . . . . 0.0 109.405 179.018 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.87 ' CE2' HG21 ' A' ' 22' ' ' THR . 39.1 t80 -62.94 -51.7 65.88 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.081 -1.012 . . . . 0.0 109.345 179.515 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.588 HD12 ' HB2' ' A' ' 87' ' ' ALA . 92.7 mt -69.81 -37.97 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.365 0 C-N-CA 119.321 -0.952 . . . . 0.0 109.332 179.386 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.44 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 7.1 t80 -66.1 -42.65 89.0 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.127 -0.983 . . . . 0.0 109.018 178.897 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 92.9 m -60.78 -40.88 94.21 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.19 -0.944 . . . . 0.0 110.384 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.594 HD12 ' N ' ' A' ' 67' ' ' TYR . 3.7 pp -83.14 -35.34 25.64 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.818 -1.176 . . . . 0.0 112.422 -178.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.594 ' N ' HD12 ' A' ' 66' ' ' LEU . 30.6 t80 -86.48 -33.02 20.49 Favored 'General case' 0 N--CA 1.513 2.712 0 O-C-N 120.589 -1.319 . . . . 0.0 112.054 -179.308 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.44 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 7.0 m-85 -98.41 -6.29 30.88 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 120.802 -1.186 . . . . 0.0 113.138 -178.444 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 15.0 mtpt -129.8 -58.09 1.1 Allowed 'General case' 0 N--CA 1.502 2.17 0 O-C-N 120.366 -1.459 . . . . 0.0 110.534 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.3 mtt85 -72.01 -28.95 63.72 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.145 -0.972 . . . . 0.0 110.83 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.7 tttp 58.58 43.62 18.89 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.771 -1.205 . . . . 0.0 110.034 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -109.85 34.23 3.96 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.363 -0.836 . . . . 0.0 109.915 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.67 HG13 HD23 ' A' ' 77' ' ' LEU . 13.4 tt -151.07 162.65 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 O-C-N 121.202 -0.936 . . . . 0.0 109.657 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.8 t -107.92 144.3 35.36 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.128 -0.983 . . . . 0.0 110.34 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 50.6 tttt -45.08 -32.48 1.76 Allowed 'General case' 0 N--CA 1.515 2.785 0 O-C-N 121.328 -0.857 . . . . 0.0 111.732 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.42 -49.65 76.02 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 120.915 -1.115 . . . . 0.0 109.321 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.67 HD23 HG13 ' A' ' 73' ' ' ILE . 33.6 tp -67.09 -46.93 72.75 Favored 'General case' 0 N--CA 1.505 2.276 0 C-N-CA 119.077 -1.049 . . . . 0.0 108.45 178.763 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.806 ' HA ' HD12 ' A' ' 81' ' ' LEU . 19.2 t80 -58.15 -38.64 76.98 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.294 -0.879 . . . . 0.0 109.395 178.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -71.7 -42.97 66.73 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.035 -1.041 . . . . 0.0 108.433 178.548 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.693 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 73.4 t90 -56.33 -37.76 70.4 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.265 -0.897 . . . . 0.0 109.561 178.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.806 HD12 ' HA ' ' A' ' 78' ' ' TYR . 8.0 mt -66.56 -50.39 63.28 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.206 -0.934 . . . . 0.0 109.153 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 36.9 mm -57.91 -33.18 45.24 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.545 0 O-C-N 121.178 -0.951 . . . . 0.0 110.181 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -89.18 -6.07 57.21 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.894 -1.129 . . . . 0.0 112.416 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.455 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 17.3 mm-40 -115.01 22.61 13.24 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.395 -1.441 . . . . 0.0 112.016 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt 75.08 72.82 0.1 Allowed 'General case' 0 N--CA 1.511 2.623 0 O-C-N 121.104 -0.997 . . . . 0.0 111.679 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.656 ' HE2' HD13 ' A' ' 23' ' ' LEU . 31.5 m-85 -133.37 -62.35 0.79 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.432 -0.793 . . . . 0.0 109.333 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.588 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -132.24 167.26 20.13 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.467 -0.771 . . . . 0.0 109.593 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.468 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.5 t0 -109.77 107.24 17.16 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.155 -0.965 . . . . 0.0 110.237 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 12.4 mmtt -58.17 -38.15 76.08 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.263 -0.898 . . . . 0.0 110.035 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.465 HD23 HD13 ' A' ' 106' ' ' LEU . 13.6 tp -58.82 -38.43 78.62 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.213 -0.929 . . . . 0.0 110.161 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.448 HD21 ' CD2' ' A' ' 57' ' ' HIS . 57.6 tp -71.23 -45.35 63.49 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.133 -0.979 . . . . 0.0 108.835 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.439 HG23 ' CE2' ' A' ' 64' ' ' TYR . 24.9 mt -59.63 -37.78 72.38 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 C-N-CA 119.396 -0.921 . . . . 0.0 108.531 178.208 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.73 -38.99 87.78 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.176 -0.953 . . . . 0.0 109.112 178.453 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.444 ' HB3' HD22 ' A' ' 103' ' ' LEU . 9.8 mmtm -57.75 -41.25 81.5 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.001 -1.062 . . . . 0.0 109.755 179.329 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.3 m0 -68.1 -35.36 78.03 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.259 -0.901 . . . . 0.0 110.337 179.58 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 10.1 mtp85 -83.36 -31.41 26.77 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.072 -1.018 . . . . 0.0 110.888 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.3 mmtt -51.63 177.15 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.739 0 O-C-N 120.865 -1.147 . . . . 0.0 110.759 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.58 140.67 37.23 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.202 -0.936 . . . . 0.0 109.48 179.194 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 101.07 -23.52 35.23 Favored Glycine 0 N--CA 1.493 2.474 0 C-N-CA 119.814 -1.184 . . . . 0.0 110.407 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.632 ' HB3' HD23 ' A' ' 103' ' ' LEU . 63.5 m-85 -92.04 58.11 3.27 Favored 'General case' 0 N--CA 1.504 2.246 0 CA-C-N 119.098 1.449 . . . . 0.0 110.056 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -66.92 -32.83 74.35 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.138 -0.976 . . . . 0.0 110.522 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt -132.9 102.07 5.49 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.002 -1.061 . . . . 0.0 110.506 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.632 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.9 pp -140.62 155.0 46.67 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.083 -1.011 . . . . 0.0 110.551 179.609 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.429 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.5 p -118.95 -35.61 3.61 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.29 -0.881 . . . . 0.0 113.222 -179.71 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.697 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.4 m -142.91 -170.72 3.3 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.253 -1.529 . . . . 0.0 110.384 179.588 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.465 HD13 HD23 ' A' ' 90' ' ' LEU . 24.3 mt -98.35 -35.91 10.15 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.28 -0.887 . . . . 0.0 110.333 178.718 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 1.1 ttt-85 -103.47 35.18 2.67 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.816 -1.177 . . . . 0.0 109.538 178.403 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.697 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.279 1.7 t -126.85 -59.75 1.25 Allowed 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 105.65 -1.982 . . . . 0.0 105.65 -179.631 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.752 ' O ' HG21 ' A' ' 119' ' ' THR . 15.1 pt -68.95 -26.01 31.45 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.546 0 O-C-N 120.902 -1.124 . . . . 0.0 110.854 176.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.415 ' N ' HG13 ' A' ' 109' ' ' ILE . 44.3 tt0 . . . . . 0 N--CA 1.494 1.735 0 O-C-N 120.972 -1.08 . . . . 0.0 110.138 -179.214 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.752 HG21 ' O ' ' A' ' 109' ' ' ILE . 1.7 m . . . . . 0 N--CA 1.495 1.788 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 34.0 t -53.41 153.94 3.73 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 120.928 -1.108 . . . . 0.0 109.801 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.79 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -73.77 -35.26 43.01 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.444 0 O-C-N 121.08 -1.012 . . . . 0.0 111.161 -178.948 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.484 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 12.1 p -54.52 -33.53 60.16 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 120.735 -1.228 . . . . 0.0 111.208 -178.827 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -34.16 70.1 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.907 -1.121 . . . . 0.0 109.635 178.439 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.58 HG12 ' HG ' ' A' ' 129' ' ' LEU . 53.0 t -81.65 124.66 79.62 Favored Pre-proline 0 N--CA 1.505 2.282 0 O-C-N 121.123 -0.985 . . . . 0.0 109.779 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.465 ' HD3' ' HB1' ' A' ' 154' ' ' ALA . 39.2 Cg_endo -66.25 178.82 2.28 Favored 'Trans proline' 0 N--CA 1.489 1.234 0 O-C-N 123.194 1.102 . . . . 0.0 110.637 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 6.6 tpt180 -75.04 -38.41 61.44 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.197 -0.939 . . . . 0.0 110.427 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.26 -43.32 92.45 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.074 -1.016 . . . . 0.0 109.809 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.8 tm0? -67.31 -41.17 85.81 Favored 'General case' 0 N--CA 1.505 2.296 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.239 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.639 HD11 HD11 ' A' ' 121' ' ' ILE . 74.6 mt -63.96 -39.94 95.3 Favored 'General case' 0 N--CA 1.506 2.369 0 C-N-CA 119.493 -0.883 . . . . 0.0 109.491 179.233 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -59.2 -38.3 79.52 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.119 -0.988 . . . . 0.0 109.966 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -57.52 -36.48 71.63 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.107 -0.995 . . . . 0.0 110.397 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -63.07 -48.94 76.47 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.205 -0.934 . . . . 0.0 109.833 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.62 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -59.08 -38.43 79.44 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.09 -1.007 . . . . 0.0 109.834 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -59.74 -38.58 82.12 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.146 -0.971 . . . . 0.0 110.207 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 58.7 mttt -87.13 -42.14 13.25 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.071 -1.018 . . . . 0.0 109.96 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 21.6 mmtt -63.03 -25.82 68.56 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.27 -0.894 . . . . 0.0 111.178 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.75 33.51 9.07 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.62 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 7.8 t -145.99 -160.84 1.2 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.084 -1.245 . . . . 0.0 109.91 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -130.89 143.85 51.03 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.079 -1.013 . . . . 0.0 109.967 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 12.3 p -124.85 160.28 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.206 -0.934 . . . . 0.0 110.722 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 43.8 t -165.5 87.97 0.41 Allowed 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.365 -0.834 . . . . 0.0 110.6 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.767 ' CG ' HD12 ' A' ' 121' ' ' ILE . 60.5 t80 -100.41 161.1 13.82 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.23 -0.919 . . . . 0.0 110.999 -179.19 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -139.29 -60.96 0.56 Allowed 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -134.68 150.52 50.64 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.359 -0.838 . . . . 0.0 108.952 178.671 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' CYS . . . . . 0.437 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.5 p -90.79 152.71 20.68 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.056 -1.027 . . . . 0.0 111.237 -179.528 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.8 m -70.9 -26.5 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 C-N-CA 119.736 -0.786 . . . . 0.0 111.298 -179.658 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 61.7 m170 -50.38 -58.83 4.8 Favored 'General case' 0 N--CA 1.515 2.818 0 O-C-N 120.9 -1.125 . . . . 0.0 110.221 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 22.9 p -128.3 -166.73 1.67 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.248 -0.908 . . . . 0.0 110.451 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -99.95 60.92 0.71 Allowed Glycine 0 N--CA 1.493 2.44 0 N-CA-C 108.076 -2.01 . . . . 0.0 108.076 178.557 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 17.4 t -98.72 145.44 26.9 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.315 -1.109 . . . . 0.0 109.902 -179.279 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 32.4 mtt-85 -98.62 49.93 0.98 Allowed 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.236 -0.915 . . . . 0.0 109.444 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 68.18 97.39 0.04 OUTLIER Glycine 0 N--CA 1.488 2.141 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 22.4 p -109.94 129.08 55.71 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.163 -1.198 . . . . 0.0 110.508 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 154' ' ' ALA . . . . . 0.465 ' HB1' ' HD3' ' A' ' 125' ' ' PRO . . . -151.0 140.17 21.2 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.187 -0.946 . . . . 0.0 110.179 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.493 1.706 0 O-C-N 121.211 -0.931 . . . . 0.0 110.277 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.749 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.503 2.201 0 CA-C-O 120.432 0.158 . . . . 0.0 110.721 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -72.6 165.21 33.38 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 O-C-N 123.287 1.151 . . . . 0.0 110.612 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -48.47 -32.02 7.21 Favored 'General case' 0 N--CA 1.515 2.776 0 O-C-N 121.481 -0.762 . . . . 0.0 111.391 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.83 -34.84 51.82 Favored Glycine 0 N--CA 1.498 2.795 0 N-CA-C 110.449 -1.061 . . . . 0.0 110.449 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.489 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 28.9 t80 -54.77 -32.74 60.42 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 120.919 -1.341 . . . . 0.0 110.673 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -53.94 -37.66 64.12 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 121.015 -1.053 . . . . 0.0 110.276 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.0 mmpt? -58.31 -36.13 72.88 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.203 -0.935 . . . . 0.0 110.275 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.678 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.7 pt -117.06 36.26 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.181 -0.95 . . . . 0.0 110.547 179.733 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.422 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.5 OUTLIER -83.22 -44.68 0.85 Allowed Pre-proline 0 N--CA 1.509 2.514 0 O-C-N 121.075 -1.016 . . . . 0.0 113.065 -179.178 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.422 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.1 Cg_endo -75.64 -35.87 2.48 Favored 'Trans proline' 0 N--CA 1.485 1.027 0 O-C-N 122.655 0.819 . . . . 0.0 111.757 -178.138 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.784 HG21 ' CE2' ' A' ' 62' ' ' TYR . 60.7 m -60.35 -43.64 96.31 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 120.933 -1.104 . . . . 0.0 110.014 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.728 HD13 ' HE2' ' A' ' 86' ' ' TYR . 4.2 mt -65.49 -41.03 93.73 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 119.45 -0.9 . . . . 0.0 109.419 179.488 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -57.56 -34.15 68.88 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.164 -0.96 . . . . 0.0 110.192 179.243 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -57.0 -37.21 71.34 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.106 -0.996 . . . . 0.0 110.316 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.595 ' CD2' HD22 ' A' ' 55' ' ' LEU . 13.3 m-85 -58.76 -38.69 79.03 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.136 -0.977 . . . . 0.0 110.476 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -59.56 -39.7 84.92 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.164 -0.96 . . . . 0.0 110.437 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.412 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.0 mp -64.99 -40.22 88.35 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 C-N-CA 119.227 -0.989 . . . . 0.0 108.958 179.549 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -69.01 -50.41 49.1 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.122 -0.986 . . . . 0.0 108.887 178.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.756 HD11 HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -60.94 -35.54 77.0 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.119 -0.988 . . . . 0.0 109.278 178.535 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.44 -39.36 70.2 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 121.087 -1.008 . . . . 0.0 109.911 179.495 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.41 -41.75 88.8 Favored 'General case' 0 N--CA 1.507 2.376 0 C-N-CA 119.206 -0.998 . . . . 0.0 109.395 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.48 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -70.84 -41.92 70.85 Favored 'General case' 0 N--CA 1.504 2.229 0 C-N-CA 119.228 -0.989 . . . . 0.0 109.073 179.068 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -60.4 -34.44 73.92 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.285 -0.885 . . . . 0.0 109.963 179.34 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.8 mmmt -80.08 -29.69 39.16 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.0 -1.062 . . . . 0.0 110.965 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.513 2.721 0 O-C-N 120.808 -1.183 . . . . 0.0 110.266 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.499 1.99 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.551 ' ND2' ' CZ2' ' A' ' 50' ' ' TRP . 2.9 t30 -62.69 -39.65 94.65 Favored 'General case' 0 N--CA 1.506 2.345 0 C-N-CA 119.446 -0.902 . . . . 0.0 109.338 179.173 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -65.75 -40.15 91.79 Favored 'General case' 0 N--CA 1.507 2.39 0 C-N-CA 119.473 -0.891 . . . . 0.0 109.566 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.411 ' CG ' ' HA ' ' A' ' 33' ' ' ALA . 49.4 tp60 -63.31 -40.86 98.51 Favored 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 119.413 -0.915 . . . . 0.0 109.664 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.556 HD23 HD12 ' A' ' 52' ' ' ILE . 12.4 mt -59.54 -39.28 83.46 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.13 -0.981 . . . . 0.0 109.72 179.532 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.551 ' CZ2' ' ND2' ' A' ' 46' ' ' ASN . 54.1 m0 -58.01 -36.23 72.39 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.202 -0.936 . . . . 0.0 109.842 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -62.41 -29.89 70.82 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.054 -1.028 . . . . 0.0 109.672 178.263 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.756 HG23 HD11 ' A' ' 30' ' ' LEU . 46.4 mt -70.55 -59.07 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 120.953 -1.092 . . . . 0.0 109.089 179.425 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.3 ptm -60.37 -29.82 69.17 Favored 'General case' 0 N--CA 1.51 2.546 0 C-N-CA 118.46 -1.296 . . . . 0.0 109.754 178.628 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -68.01 -37.41 81.4 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 120.885 -1.134 . . . . 0.0 109.263 178.187 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.755 HD12 HD12 ' A' ' 30' ' ' LEU . 11.9 mt -53.05 -32.19 45.54 Favored 'General case' 0 N--CA 1.513 2.688 0 O-C-N 120.962 -1.086 . . . . 0.0 110.304 179.055 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.443 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 5.0 t60 -56.1 -36.77 68.55 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.057 -1.027 . . . . 0.0 110.113 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.482 ' NE2' HD21 ' A' ' 91' ' ' LEU . 5.5 m170 -60.48 -49.49 77.34 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.1 -1.0 . . . . 0.0 109.508 179.243 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -58.24 -37.42 74.87 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.3 -0.875 . . . . 0.0 109.679 179.329 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.426 HH12 HD13 ' A' ' 30' ' ' LEU . 7.3 mtt180 -63.07 -48.77 77.23 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.172 -0.955 . . . . 0.0 109.482 179.247 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.7 p -60.74 -40.37 92.14 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.172 -0.955 . . . . 0.0 109.564 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.407 ' O ' ' OG1' ' A' ' 65' ' ' THR . 4.1 tpt85 -62.6 -40.99 98.68 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 119.343 -0.943 . . . . 0.0 109.319 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.784 ' CE2' HG21 ' A' ' 22' ' ' THR . 45.3 t80 -62.95 -50.23 71.63 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.276 -0.89 . . . . 0.0 109.512 179.473 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.833 HD12 ' HB2' ' A' ' 87' ' ' ALA . 79.7 mt -70.28 -36.78 68.78 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 C-N-CA 119.3 -0.96 . . . . 0.0 109.453 179.425 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.447 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 9.5 t80 -67.8 -42.12 82.09 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.068 -1.02 . . . . 0.0 108.891 178.942 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.407 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 90.1 m -60.92 -40.83 94.68 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.175 -0.953 . . . . 0.0 110.097 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.626 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.8 pp -83.2 -36.49 24.62 Favored 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 118.99 -1.084 . . . . 0.0 112.465 -179.126 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.612 ' N ' HD12 ' A' ' 66' ' ' LEU . 50.0 t80 -86.65 -35.12 19.54 Favored 'General case' 0 N--CA 1.513 2.693 0 O-C-N 120.63 -1.294 . . . . 0.0 111.858 -179.54 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.447 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 6.6 m-85 -98.32 -3.42 37.21 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.903 -1.123 . . . . 0.0 113.25 -178.5 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.87 -58.93 0.61 Allowed 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.374 -1.454 . . . . 0.0 110.749 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.413 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -62.57 -29.44 70.59 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.063 -1.023 . . . . 0.0 110.654 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.1 tttt 59.87 44.41 13.75 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.768 -1.207 . . . . 0.0 109.985 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -117.38 37.61 3.83 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.342 -0.849 . . . . 0.0 109.888 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.762 HG13 HD23 ' A' ' 77' ' ' LEU . 14.9 tt -157.35 162.69 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.227 -0.921 . . . . 0.0 110.411 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.8 p -110.31 149.0 30.82 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.119 -0.988 . . . . 0.0 110.104 179.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.3 tttt -46.34 -31.92 2.87 Favored 'General case' 0 N--CA 1.515 2.791 0 O-C-N 121.269 -0.895 . . . . 0.0 111.722 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -62.86 -51.91 65.17 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 120.964 -1.085 . . . . 0.0 109.423 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.762 HD23 HG13 ' A' ' 73' ' ' ILE . 31.4 tp -65.04 -43.02 93.72 Favored 'General case' 0 N--CA 1.507 2.38 0 C-N-CA 119.145 -1.022 . . . . 0.0 108.816 178.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.639 ' HA ' HD12 ' A' ' 81' ' ' LEU . 16.9 t80 -62.53 -40.48 96.94 Favored 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 119.53 -0.868 . . . . 0.0 109.235 179.182 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -70.25 -42.05 72.7 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.168 -0.957 . . . . 0.0 108.849 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.749 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 81.1 t90 -57.06 -35.51 69.43 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.262 -0.899 . . . . 0.0 109.876 179.062 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.639 HD12 ' HA ' ' A' ' 78' ' ' TYR . 12.4 mt -69.9 -48.23 59.44 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.079 -1.013 . . . . 0.0 108.971 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.9 mm -57.47 -31.66 39.45 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.609 0 O-C-N 121.312 -0.868 . . . . 0.0 110.053 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 6.9 tttp -89.28 -15.87 32.52 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.938 -1.101 . . . . 0.0 112.136 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.444 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 18.9 mm-40 -106.33 22.26 16.06 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 120.529 -1.357 . . . . 0.0 112.098 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 19.4 tptt 74.24 75.77 0.12 Allowed 'General case' 0 N--CA 1.512 2.667 0 O-C-N 121.038 -1.039 . . . . 0.0 111.742 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.728 ' HE2' HD13 ' A' ' 23' ' ' LEU . 33.0 m-85 -135.42 -63.04 0.69 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.558 -0.714 . . . . 0.0 109.306 179.62 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.833 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -125.48 -172.99 2.72 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.485 -0.76 . . . . 0.0 109.198 179.165 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.443 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 8.4 t0 -131.24 102.91 6.19 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.057 -1.027 . . . . 0.0 110.524 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -59.41 -39.18 82.62 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.195 -0.941 . . . . 0.0 109.799 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 19.7 tp -59.5 -40.26 86.49 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.127 -0.983 . . . . 0.0 109.772 179.653 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.636 HD11 HD11 ' A' ' 103' ' ' LEU . 59.5 tp -71.05 -46.77 61.38 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.173 -0.954 . . . . 0.0 108.552 179.001 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 62.8 mt -60.24 -33.52 53.93 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.344 0 C-N-CA 119.406 -0.918 . . . . 0.0 109.047 178.356 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.67 -46.36 72.56 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.043 -1.035 . . . . 0.0 109.292 178.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.49 ' HD3' HD23 ' A' ' 106' ' ' LEU . 12.2 mttp -57.48 -40.81 79.39 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.092 -1.005 . . . . 0.0 110.146 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 3.0 m0 -60.77 -26.85 67.55 Favored 'General case' 0 N--CA 1.508 2.468 0 C-N-CA 119.188 -1.005 . . . . 0.0 110.668 179.104 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.56 -35.8 22.55 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 120.796 -1.19 . . . . 0.0 110.448 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -52.23 178.86 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.76 0 O-C-N 121.022 -1.049 . . . . 0.0 110.764 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -103.4 138.2 40.47 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.259 -0.9 . . . . 0.0 109.22 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 102.85 -27.49 19.98 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 109.948 -1.261 . . . . 0.0 109.948 -178.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.6 ' HB3' HD23 ' A' ' 103' ' ' LEU . 73.3 m-85 -92.32 58.78 3.31 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.885 -1.362 . . . . 0.0 109.808 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -85.56 -35.0 21.34 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.068 -1.02 . . . . 0.0 110.475 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.412 ' HB2' ' OG ' ' A' ' 155' ' ' SER . 0.0 OUTLIER -117.49 62.34 0.74 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.987 -1.071 . . . . 0.0 110.586 -179.827 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.636 HD11 HD11 ' A' ' 91' ' ' LEU . 0.9 OUTLIER -107.29 152.33 24.27 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.003 -1.06 . . . . 0.0 109.847 179.506 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.446 ' N ' HD12 ' A' ' 103' ' ' LEU . 26.8 p -113.75 -29.33 7.13 Favored 'General case' 0 N--CA 1.501 2.121 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -179.15 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.659 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.8 m -143.87 -168.12 2.77 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 120.109 -1.619 . . . . 0.0 110.019 179.315 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.512 HD21 ' HA ' ' A' ' 91' ' ' LEU . 16.7 mt -96.35 -38.87 9.89 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.218 -0.926 . . . . 0.0 110.128 179.02 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -102.1 30.3 4.56 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 120.999 -1.063 . . . . 0.0 109.866 178.239 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.659 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.7 t -127.37 17.18 7.08 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.043 -1.035 . . . . 0.0 108.833 -179.545 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.469 HG23 ' O ' ' A' ' 108' ' ' CYS . 1.1 pt -158.99 38.91 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 O-C-N 120.957 -1.09 . . . . 0.0 110.24 -178.768 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.752 ' C ' HG23 ' A' ' 119' ' ' THR . 7.3 tt0 . . . . . 0 N--CA 1.503 2.22 0 O-C-N 120.868 -1.145 . . . . 0.0 111.201 -178.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.752 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.1 m . . . . . 0 N--CA 1.494 1.741 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.438 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 49.6 t -103.87 154.93 19.05 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.26 -0.9 . . . . 0.0 109.207 178.865 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.967 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -75.34 -30.7 22.89 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 O-C-N 121.158 -0.964 . . . . 0.0 111.62 -179.033 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.484 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.3 p -58.58 -35.72 72.85 Favored 'General case' 0 N--CA 1.511 2.608 0 O-C-N 120.705 -1.247 . . . . 0.0 110.765 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.06 -33.24 64.81 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 120.937 -1.102 . . . . 0.0 109.964 178.75 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 58.3 t -81.29 124.28 80.78 Favored Pre-proline 0 N--CA 1.504 2.228 0 O-C-N 121.16 -0.963 . . . . 0.0 109.863 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -66.73 173.48 7.95 Favored 'Trans proline' 0 N--CA 1.488 1.163 0 O-C-N 123.187 1.098 . . . . 0.0 110.874 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.9 tpp85 -75.19 -37.66 61.1 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.292 -0.88 . . . . 0.0 110.421 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.89 -40.96 81.57 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.004 -1.06 . . . . 0.0 110.039 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -69.41 -41.8 75.91 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 119.312 -0.955 . . . . 0.0 109.249 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.604 ' O ' HG11 ' A' ' 140' ' ' VAL . 21.1 mt -65.39 -38.6 90.49 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.215 -0.928 . . . . 0.0 109.558 179.083 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -60.99 -39.88 91.34 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.132 -0.98 . . . . 0.0 109.877 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -60.37 -39.62 87.86 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.147 -0.97 . . . . 0.0 110.082 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -60.85 -41.01 95.0 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.244 -0.91 . . . . 0.0 109.941 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.3 -41.88 94.35 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.15 -0.969 . . . . 0.0 110.06 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 20.8 ttt85 -58.97 -38.44 79.09 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.088 -1.007 . . . . 0.0 109.908 179.68 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -57.87 -35.99 71.73 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.12 -0.987 . . . . 0.0 110.549 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -106.55 18.5 21.84 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.022 -1.049 . . . . 0.0 111.987 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 56.2 44.61 88.94 Favored Glycine 0 N--CA 1.497 2.729 0 O-C-N 120.612 -1.305 . . . . 0.0 110.327 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.7 t -133.75 -163.31 1.34 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.188 -1.184 . . . . 0.0 109.948 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 10.2 mp0 -139.64 144.43 37.66 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.155 -0.965 . . . . 0.0 110.344 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.604 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.6 p -132.1 161.4 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.284 -0.885 . . . . 0.0 110.018 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 38.4 t -166.78 100.07 0.56 Allowed 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.231 -0.918 . . . . 0.0 111.104 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.967 ' CD1' HD12 ' A' ' 121' ' ' ILE . 77.1 t80 -102.58 160.08 14.88 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.336 -0.852 . . . . 0.0 110.639 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 68.4 m80 -137.83 -61.63 0.62 Allowed 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 178.691 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.56 150.75 44.07 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.536 -0.727 . . . . 0.0 109.278 178.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 145' ' ' CYS . . . . . 0.422 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.4 p -93.56 154.82 17.66 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.016 -1.053 . . . . 0.0 110.986 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.7 p -73.62 -25.14 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.569 0 O-C-N 121.334 -0.854 . . . . 0.0 111.598 -179.463 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 62.0 m170 -49.44 -59.06 4.07 Favored 'General case' 0 N--CA 1.517 2.879 0 O-C-N 120.873 -1.142 . . . . 0.0 110.167 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.509 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.9 p -127.65 -164.39 1.36 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.192 -0.942 . . . . 0.0 110.369 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 149' ' ' GLY . . . . . 0.426 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.93 63.38 0.56 Allowed Glycine 0 N--CA 1.492 2.381 0 N-CA-C 107.936 -2.066 . . . . 0.0 107.936 178.422 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 32.8 t -101.83 142.18 33.54 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.332 -1.099 . . . . 0.0 109.797 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 9.3 ttt85 -100.0 46.32 0.96 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.262 -0.899 . . . . 0.0 109.638 179.261 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 76.38 96.16 0.17 Allowed Glycine 0 N--CA 1.486 2.011 0 N-CA-C 109.883 -1.287 . . . . 0.0 109.883 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.4 p -108.25 126.01 52.33 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.333 -1.098 . . . . 0.0 110.161 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -146.65 148.93 32.57 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.153 -0.967 . . . . 0.0 110.308 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 155' ' ' SER . . . . . 0.412 ' OG ' ' HB2' ' A' ' 102' ' ' LYS . 1.5 m . . . . . 0 N--CA 1.496 1.842 0 O-C-N 121.291 -0.88 . . . . 0.0 110.695 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.724 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.504 2.233 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.407 ' HG2' HD13 ' A' ' 77' ' ' LEU . 44.1 Cg_endo -70.14 162.83 40.82 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.411 1.216 . . . . 0.0 110.919 -179.527 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -47.62 -32.34 5.45 Favored 'General case' 0 N--CA 1.515 2.796 0 O-C-N 121.431 -0.793 . . . . 0.0 111.596 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.99 -34.73 39.11 Favored Glycine 0 N--CA 1.5 2.918 0 O-C-N 121.039 -1.038 . . . . 0.0 110.514 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.7 t80 -55.84 -32.29 63.47 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.061 -1.258 . . . . 0.0 110.695 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -54.32 -38.65 66.24 Favored 'General case' 0 N--CA 1.513 2.71 0 O-C-N 120.913 -1.117 . . . . 0.0 110.147 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.22 -36.14 72.73 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.209 -0.932 . . . . 0.0 110.164 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.641 ' O ' HD12 ' A' ' 23' ' ' LEU . 3.0 pt -115.34 36.12 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 O-C-N 121.204 -0.935 . . . . 0.0 110.373 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.434 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.3 OUTLIER -84.06 -43.41 0.77 Allowed Pre-proline 0 N--CA 1.509 2.519 0 O-C-N 121.073 -1.017 . . . . 0.0 113.217 -179.187 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.434 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.2 Cg_endo -75.58 -36.39 2.25 Favored 'Trans proline' 0 N--CA 1.486 1.083 0 O-C-N 122.62 0.8 . . . . 0.0 111.634 -178.243 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.872 HG21 ' CE2' ' A' ' 62' ' ' TYR . 85.5 m -61.54 -46.65 89.04 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 120.938 -1.101 . . . . 0.0 109.756 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.692 HD13 ' HE2' ' A' ' 86' ' ' TYR . 4.9 mt -61.81 -39.22 90.99 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.48 -0.888 . . . . 0.0 109.632 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.421 ' O ' HD12 ' A' ' 28' ' ' ILE . 6.5 m -57.2 -35.7 69.95 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.137 -0.977 . . . . 0.0 110.295 179.555 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -57.63 -37.95 74.18 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.068 -1.02 . . . . 0.0 110.248 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.608 ' CD2' HD22 ' A' ' 55' ' ' LEU . 14.2 m-85 -59.0 -38.53 79.43 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.126 -0.984 . . . . 0.0 110.391 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -58.31 -39.36 79.17 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.175 -0.953 . . . . 0.0 110.309 -179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.437 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.4 mp -67.97 -41.19 84.41 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.279 0 C-N-CA 119.225 -0.99 . . . . 0.0 108.734 179.284 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.424 ' HB3' HD11 ' A' ' 55' ' ' LEU . 0.5 OUTLIER -66.74 -49.03 67.3 Favored 'General case' 0 N--CA 1.506 2.329 0 C-N-CA 119.177 -1.009 . . . . 0.0 108.341 178.565 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.085 HD11 HG23 ' A' ' 52' ' ' ILE . 4.3 tp -63.1 -36.21 82.82 Favored 'General case' 0 N--CA 1.508 2.434 0 C-N-CA 119.39 -0.924 . . . . 0.0 108.921 178.289 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.7 -38.03 74.51 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.117 -0.989 . . . . 0.0 110.298 179.618 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -64.56 -50.55 66.85 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.094 -1.004 . . . . 0.0 109.728 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.482 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -70.78 -36.57 73.12 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 119.202 -0.999 . . . . 0.0 109.48 179.051 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -72.2 -30.83 65.33 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.127 -0.983 . . . . 0.0 110.281 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.8 mmtt -95.11 -32.72 12.96 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 120.952 -1.093 . . . . 0.0 111.12 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.405 ' CG ' ' NE2' ' A' ' 48' ' ' GLN . 8.6 t0 . . . . . 0 N--CA 1.508 2.439 0 O-C-N 121.02 -1.05 . . . . 0.0 109.994 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.496 1.831 0 N-CA-C 110.07 -0.345 . . . . 0.0 110.07 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.406 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 15.4 m120 -58.4 -41.79 85.71 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.235 -0.916 . . . . 0.0 109.624 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -62.25 -37.4 85.29 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.297 -0.877 . . . . 0.0 109.988 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.405 ' NE2' ' CG ' ' A' ' 36' ' ' ASP . 2.0 tt0 -66.04 -43.2 88.21 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.12 -0.988 . . . . 0.0 109.558 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.422 HD23 ' HA ' ' A' ' 49' ' ' LEU . 43.6 mt -64.47 -34.01 77.21 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.258 -0.901 . . . . 0.0 110.321 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.498 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 46.9 m0 -57.76 -40.73 80.45 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 120.929 -1.107 . . . . 0.0 109.724 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -59.73 -35.05 73.77 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.359 -0.937 . . . . 0.0 109.957 179.049 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 1.085 HG23 HD11 ' A' ' 30' ' ' LEU . 18.3 mt -72.04 -57.24 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.161 0 O-C-N 121.046 -1.034 . . . . 0.0 109.121 179.229 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 ptm -61.58 -26.9 68.26 Favored 'General case' 0 N--CA 1.507 2.421 0 C-N-CA 118.53 -1.268 . . . . 0.0 110.06 178.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -73.49 -39.78 64.6 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 120.723 -1.235 . . . . 0.0 108.708 177.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.608 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.0 mt -53.38 -30.5 40.16 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.087 -1.008 . . . . 0.0 110.303 178.776 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.48 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 15.9 t60 -57.73 -39.92 78.42 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.943 -1.098 . . . . 0.0 110.111 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.413 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 6.8 m170 -60.51 -46.95 88.25 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.172 -0.955 . . . . 0.0 109.442 179.23 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -61.17 -37.38 82.72 Favored 'General case' 0 N--CA 1.505 2.3 0 C-N-CA 119.463 -0.895 . . . . 0.0 109.57 179.157 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.447 ' HD3' ' CD1' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -67.16 -48.35 68.25 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.097 -1.002 . . . . 0.0 109.31 179.176 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.2 p -61.68 -38.46 87.87 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.185 -0.947 . . . . 0.0 109.383 179.191 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -37.71 88.5 Favored 'General case' 0 N--CA 1.507 2.401 0 C-N-CA 119.261 -0.975 . . . . 0.0 109.464 179.176 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.872 ' CE2' HG21 ' A' ' 22' ' ' THR . 42.2 t80 -61.1 -48.69 80.49 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.118 -0.989 . . . . 0.0 109.454 179.528 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.515 HD12 ' HB2' ' A' ' 87' ' ' ALA . 84.0 mt -76.25 -43.25 37.21 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 O-C-N 121.189 -0.944 . . . . 0.0 108.854 179.09 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.437 ' CE1' HG23 ' A' ' 92' ' ' ILE . 40.7 t80 -59.75 -24.94 64.46 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.408 -0.808 . . . . 0.0 110.39 178.723 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.417 HG23 ' HD3' ' A' ' 69' ' ' LYS . 85.5 m -88.35 -34.99 17.42 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.692 -1.255 . . . . 0.0 110.441 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.566 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.6 pp -82.88 -32.95 27.11 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 120.806 -1.184 . . . . 0.0 112.025 -179.185 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.506 ' N ' HD12 ' A' ' 66' ' ' LEU . 33.3 t80 -86.45 -37.16 18.59 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 120.714 -1.241 . . . . 0.0 111.835 -179.317 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.404 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 16.8 m-85 -93.22 -19.58 21.29 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 120.897 -1.127 . . . . 0.0 113.086 -178.116 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.417 ' HD3' HG23 ' A' ' 65' ' ' THR . 15.5 mtpt -116.54 -58.6 2.07 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.518 -1.364 . . . . 0.0 110.97 -179.543 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.406 ' HB2' ' HA ' ' A' ' 66' ' ' LEU . 0.8 OUTLIER -68.67 -29.21 67.63 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.082 -1.011 . . . . 0.0 110.873 -179.54 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.6 tttt 58.53 42.84 20.22 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.796 -1.19 . . . . 0.0 109.957 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.72 34.32 4.05 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.447 -0.783 . . . . 0.0 109.949 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.781 HG13 HD23 ' A' ' 77' ' ' LEU . 14.1 tt -153.41 162.41 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.156 -0.965 . . . . 0.0 109.728 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 49.7 m -107.93 148.35 29.76 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.056 -1.027 . . . . 0.0 110.406 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.0 ttmm -46.81 -32.34 3.63 Favored 'General case' 0 N--CA 1.514 2.763 0 O-C-N 121.262 -0.898 . . . . 0.0 111.417 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -62.27 -51.15 68.86 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 120.976 -1.078 . . . . 0.0 109.29 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.781 HD23 HG13 ' A' ' 73' ' ' ILE . 35.0 tp -65.94 -43.84 86.85 Favored 'General case' 0 N--CA 1.506 2.351 0 C-N-CA 119.202 -0.999 . . . . 0.0 108.528 178.868 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.418 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 19.3 t80 -60.73 -39.94 90.53 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.279 -0.888 . . . . 0.0 109.335 179.1 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -71.62 -42.22 67.91 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.11 -0.994 . . . . 0.0 108.823 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.724 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 81.7 t90 -56.76 -36.99 70.44 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 121.301 -0.874 . . . . 0.0 109.687 179.008 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.701 HD22 ' CD2' ' A' ' 86' ' ' TYR . 51.9 mt -68.85 -47.28 66.36 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.22 -0.925 . . . . 0.0 109.122 179.156 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 37.0 mm -57.77 -33.3 45.02 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.535 0 O-C-N 121.258 -0.901 . . . . 0.0 110.032 179.461 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.6 tmtt? -89.32 -11.77 42.47 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.965 -1.084 . . . . 0.0 112.48 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.449 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 71.5 mm-40 -108.52 22.68 15.6 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 120.475 -1.39 . . . . 0.0 112.206 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 15.8 tttt 74.96 73.99 0.1 Allowed 'General case' 0 N--CA 1.512 2.672 0 O-C-N 121.102 -0.998 . . . . 0.0 111.799 179.113 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.701 ' CD2' HD22 ' A' ' 81' ' ' LEU . 34.1 m-85 -134.54 -62.51 0.74 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.449 -0.782 . . . . 0.0 109.196 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.515 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -132.59 160.85 35.42 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.402 -0.811 . . . . 0.0 109.257 179.038 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.48 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.4 t70 -105.65 119.1 38.27 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.047 -1.033 . . . . 0.0 110.421 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.1 mmtt -60.87 -38.08 84.36 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 119.478 -0.889 . . . . 0.0 109.825 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.467 HD12 ' HA ' ' A' ' 90' ' ' LEU . 8.3 tp -60.29 -37.93 82.02 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.096 -1.003 . . . . 0.0 109.707 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.684 HD12 ' CZ3' ' A' ' 95' ' ' TRP . 0.2 OUTLIER -65.81 -55.82 15.15 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.096 -1.003 . . . . 0.0 108.895 179.21 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.437 HG23 ' CE1' ' A' ' 64' ' ' TYR . 39.6 mt -61.75 -36.02 71.11 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.475 0 C-N-CA 119.342 -0.943 . . . . 0.0 108.888 178.759 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.92 -39.95 91.02 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.09 -1.006 . . . . 0.0 109.354 178.85 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.427 ' HD2' ' CE1' ' A' ' 100' ' ' TYR . 10.8 mmtm -58.68 -44.25 90.2 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 121.154 -0.966 . . . . 0.0 109.501 179.233 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.684 ' CZ3' HD12 ' A' ' 91' ' ' LEU . 2.6 m0 -62.58 -34.97 78.04 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.192 -0.942 . . . . 0.0 110.153 179.378 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.41 ' NH1' ' OH ' ' A' ' 64' ' ' TYR . 0.3 OUTLIER -81.25 -31.9 33.54 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.02 -1.05 . . . . 0.0 110.79 179.757 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 23.6 mmtt -53.91 -176.73 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.711 0 O-C-N 120.899 -1.126 . . . . 0.0 110.582 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -103.38 134.52 46.62 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.241 -0.912 . . . . 0.0 109.808 179.201 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.42 14.2 45.36 Favored Glycine 0 N--CA 1.493 2.494 0 C-N-CA 120.2 -1.0 . . . . 0.0 110.863 -179.437 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.526 ' HB3' HD23 ' A' ' 103' ' ' LEU . 51.3 m-85 -123.03 72.49 1.1 Allowed 'General case' 0 N--CA 1.493 1.676 0 CA-C-N 119.43 1.615 . . . . 0.0 109.983 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.12 -36.46 12.65 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.159 -0.963 . . . . 0.0 110.468 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.77 77.21 1.74 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.006 -1.059 . . . . 0.0 110.565 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.526 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.0 OUTLIER -120.85 150.54 40.88 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.036 -1.04 . . . . 0.0 110.059 179.632 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.413 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.7 p -111.91 -32.59 6.55 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.173 -0.954 . . . . 0.0 112.98 -179.341 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.628 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.0 m -142.05 -168.5 2.71 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.204 -1.56 . . . . 0.0 110.156 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 62.1 mt -96.73 -38.46 9.9 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.252 -0.905 . . . . 0.0 110.122 178.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 22.9 ttt-85 -101.27 28.9 5.05 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 120.952 -1.093 . . . . 0.0 109.943 178.044 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.628 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.308 1.8 t -127.05 17.29 7.24 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.065 -1.022 . . . . 0.0 108.623 -179.801 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.47 HG23 ' C ' ' A' ' 108' ' ' CYS . 2.0 pt -156.35 34.38 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.062 0 O-C-N 120.806 -1.184 . . . . 0.0 111.05 -178.302 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.587 ' C ' HG23 ' A' ' 119' ' ' THR . 1.6 mt-30 . . . . . 0 N--CA 1.499 2.021 0 O-C-N 120.711 -1.243 . . . . 0.0 111.147 -178.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.587 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.2 OUTLIER . . . . . 0 N--CA 1.501 2.113 0 CA-C-O 120.716 0.293 . . . . 0.0 110.373 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 42.7 t -86.9 153.58 21.5 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.12 -0.988 . . . . 0.0 108.661 178.765 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.948 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -72.5 -30.89 35.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.378 0 O-C-N 121.079 -1.013 . . . . 0.0 111.627 -178.695 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.49 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.8 p -60.0 -35.73 75.67 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 120.593 -1.317 . . . . 0.0 110.396 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 7.0 ttt-85 -57.2 -32.85 66.91 Favored 'General case' 0 N--CA 1.512 2.626 0 O-C-N 121.077 -1.014 . . . . 0.0 109.925 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 61.9 t -79.99 124.4 83.07 Favored Pre-proline 0 N--CA 1.506 2.333 0 O-C-N 121.056 -1.028 . . . . 0.0 109.913 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -67.56 -179.73 2.12 Favored 'Trans proline' 0 N--CA 1.488 1.153 0 O-C-N 123.112 1.059 . . . . 0.0 110.87 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.19 -37.85 61.02 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.22 -0.925 . . . . 0.0 110.419 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.97 -40.83 81.57 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.025 -1.047 . . . . 0.0 110.092 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 22.7 tp60 -69.19 -41.54 77.01 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.339 -0.944 . . . . 0.0 109.238 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.608 HD11 HD11 ' A' ' 121' ' ' ILE . 9.4 mt -66.01 -38.73 89.19 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 121.21 -0.931 . . . . 0.0 109.517 179.023 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -60.61 -38.81 85.93 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.184 -0.947 . . . . 0.0 109.907 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -58.76 -37.9 77.27 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.141 -0.974 . . . . 0.0 110.382 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -64.35 -40.47 95.93 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.094 -1.004 . . . . 0.0 110.098 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.404 ' HA ' HG23 ' A' ' 138' ' ' THR . . . -66.48 -41.33 89.13 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.067 -1.021 . . . . 0.0 109.675 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 11.3 mmp_? -63.89 -34.81 78.8 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.227 -0.921 . . . . 0.0 110.254 179.488 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 9.9 mmmt -74.41 -31.81 62.46 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 120.958 -1.089 . . . . 0.0 110.956 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 29.2 mttm -99.76 22.28 11.25 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 120.882 -1.136 . . . . 0.0 111.804 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.0 46.42 55.71 Favored Glycine 0 N--CA 1.499 2.884 0 O-C-N 120.607 -1.308 . . . . 0.0 110.743 179.23 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.404 HG23 ' HA ' ' A' ' 133' ' ' ALA . 9.7 t -145.68 -163.79 1.8 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.145 -1.209 . . . . 0.0 110.32 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 12.6 mt-30 -131.85 171.44 13.54 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.132 -0.98 . . . . 0.0 110.213 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.7 p -159.18 160.96 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.209 -0.932 . . . . 0.0 110.859 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 30.3 t -168.63 96.87 0.39 Allowed 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.319 -0.863 . . . . 0.0 110.924 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.948 ' CD1' HD12 ' A' ' 121' ' ' ILE . 73.4 t80 -97.16 159.6 14.82 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.202 -0.936 . . . . 0.0 110.518 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 17.7 m170 -138.3 -61.24 0.6 Allowed 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 178.774 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -139.48 151.13 45.94 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.526 -0.734 . . . . 0.0 109.264 178.914 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 145' ' ' CYS . . . . . 0.416 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.0 p -92.52 155.71 17.63 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.065 -1.022 . . . . 0.0 111.024 -179.751 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.4 p -74.78 -23.09 17.51 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.435 -0.79 . . . . 0.0 111.7 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 61.4 m170 -51.72 -57.24 9.8 Favored 'General case' 0 N--CA 1.514 2.751 0 O-C-N 120.81 -1.181 . . . . 0.0 110.002 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.498 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.2 p -128.91 -164.15 1.36 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.281 -0.887 . . . . 0.0 110.385 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -102.11 62.43 0.51 Allowed Glycine 0 N--CA 1.493 2.459 0 N-CA-C 107.81 -2.116 . . . . 0.0 107.81 178.225 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 21.6 t -99.54 146.01 26.88 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.32 -1.106 . . . . 0.0 109.792 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 11.1 mtt85 -100.92 44.14 1.03 Allowed 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.219 -0.926 . . . . 0.0 109.689 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 76.67 97.18 0.17 Allowed Glycine 0 N--CA 1.486 2.033 0 N-CA-C 109.846 -1.302 . . . . 0.0 109.846 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.4 p -110.39 125.78 53.58 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.344 -1.092 . . . . 0.0 110.202 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -142.16 137.34 30.8 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.13 -0.981 . . . . 0.0 109.949 -179.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.497 1.889 0 O-C-N 121.137 -0.977 . . . . 0.0 109.689 179.612 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.758 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.503 2.222 0 CA-C-O 120.459 0.171 . . . . 0.0 110.636 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.12 163.95 37.15 Favored 'Trans proline' 0 C--N 1.318 -1.059 0 O-C-N 123.307 1.162 . . . . 0.0 110.652 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -48.46 -32.23 7.48 Favored 'General case' 0 N--CA 1.515 2.801 0 O-C-N 121.483 -0.761 . . . . 0.0 111.375 -179.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.86 -34.12 50.84 Favored Glycine 0 N--CA 1.498 2.779 0 O-C-N 121.018 -1.051 . . . . 0.0 110.502 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.43 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 28.6 t80 -54.63 -32.55 59.16 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 120.999 -1.295 . . . . 0.0 110.76 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 -54.18 -37.9 65.0 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 121.006 -1.059 . . . . 0.0 110.18 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.0 mptt -58.63 -36.52 74.21 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.179 -0.951 . . . . 0.0 110.25 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.718 ' O ' HD12 ' A' ' 23' ' ' LEU . 3.3 pt -117.06 35.69 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.152 -0.968 . . . . 0.0 110.514 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.421 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 6.6 tmtt? -84.64 -43.21 0.71 Allowed Pre-proline 0 N--CA 1.508 2.451 0 O-C-N 121.093 -1.004 . . . . 0.0 113.265 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.421 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.8 Cg_endo -76.44 -38.01 1.17 Allowed 'Trans proline' 0 N--CA 1.487 1.134 0 O-C-N 122.603 0.791 . . . . 0.0 111.582 -178.335 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.781 HG21 ' CE2' ' A' ' 62' ' ' TYR . 86.0 m -59.73 -43.18 94.3 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 120.86 -1.15 . . . . 0.0 109.992 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.718 HD12 ' O ' ' A' ' 19' ' ' ILE . 1.6 mt -63.12 -37.98 89.35 Favored 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 119.487 -0.885 . . . . 0.0 109.772 179.432 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.439 ' O ' HD12 ' A' ' 28' ' ' ILE . 0.6 OUTLIER -57.6 -36.63 72.01 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.091 -1.005 . . . . 0.0 110.394 179.652 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -57.26 -37.38 72.25 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.091 -1.005 . . . . 0.0 110.256 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.752 ' CD2' HD22 ' A' ' 55' ' ' LEU . 13.3 m-85 -58.42 -38.98 78.54 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.091 -1.006 . . . . 0.0 110.556 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -60.84 -38.91 87.11 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.233 -0.917 . . . . 0.0 110.864 -179.07 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.439 HD12 ' O ' ' A' ' 24' ' ' THR . 3.2 mp -65.71 -39.23 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.415 0 C-N-CA 119.119 -1.032 . . . . 0.0 109.591 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.8 tt0 -72.16 -46.0 58.19 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.034 -1.041 . . . . 0.0 108.831 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.698 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -65.29 -33.76 76.75 Favored 'General case' 0 N--CA 1.508 2.44 0 C-N-CA 119.27 -0.972 . . . . 0.0 108.902 178.231 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -57.17 -39.51 75.46 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 120.994 -1.066 . . . . 0.0 110.011 179.349 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.83 -49.86 73.25 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.25 -0.98 . . . . 0.0 109.605 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.601 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -69.33 -39.39 78.23 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.18 -0.95 . . . . 0.0 109.352 179.202 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.642 ' HG3' HD23 ' A' ' 30' ' ' LEU . 10.8 mm-40 -69.73 -30.8 68.5 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.231 -0.918 . . . . 0.0 110.446 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -94.79 -31.24 13.84 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.85 -1.156 . . . . 0.0 111.261 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 . . . . . 0 N--CA 1.511 2.602 0 O-C-N 120.873 -1.142 . . . . 0.0 110.282 179.936 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.495 1.777 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -55.47 -38.41 69.06 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.202 -0.936 . . . . 0.0 109.821 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -58.0 -34.67 70.25 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.229 -0.919 . . . . 0.0 110.166 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -57.46 -41.02 79.77 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 120.948 -1.095 . . . . 0.0 109.953 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 93.4 mt -64.71 -38.62 91.6 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.254 -0.904 . . . . 0.0 109.885 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.502 ' O ' ' HE3' ' A' ' 53' ' ' MET . 39.9 m0 -58.18 -32.13 67.95 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.151 -0.968 . . . . 0.0 109.865 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -69.37 -33.33 72.9 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.643 -1.286 . . . . 0.0 109.624 178.656 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.698 HG23 ' CG ' ' A' ' 30' ' ' LEU . 68.4 mt -72.54 -51.1 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.298 0 O-C-N 120.904 -1.122 . . . . 0.0 109.39 179.305 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.502 ' HE3' ' O ' ' A' ' 50' ' ' TRP . 0.0 OUTLIER -61.02 -33.31 73.07 Favored 'General case' 0 N--CA 1.508 2.464 0 C-N-CA 118.799 -1.16 . . . . 0.0 109.648 179.07 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -62.48 -38.16 88.78 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.93 -1.106 . . . . 0.0 109.608 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.752 HD22 ' CD2' ' A' ' 26' ' ' PHE . 19.6 mt -53.79 -35.16 61.06 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.113 -0.992 . . . . 0.0 110.017 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.466 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 38.5 t60 -56.19 -38.81 71.47 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 120.98 -1.075 . . . . 0.0 109.881 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.428 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 10.4 m170 -61.42 -50.39 73.0 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.224 -0.923 . . . . 0.0 109.051 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.8 tt0 -60.93 -38.7 86.72 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 119.468 -0.893 . . . . 0.0 109.271 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.415 ' HG3' ' CE2' ' A' ' 26' ' ' PHE . 5.2 mtt180 -62.23 -48.06 81.65 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.164 -0.96 . . . . 0.0 109.33 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 94.6 p -65.44 -39.09 91.65 Favored 'General case' 0 N--CA 1.503 2.204 0 C-N-CA 119.306 -0.958 . . . . 0.0 109.159 179.107 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 34.9 ttt85 -65.52 -39.82 92.24 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.111 -0.993 . . . . 0.0 109.134 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.781 ' CE2' HG21 ' A' ' 22' ' ' THR . 28.4 t80 -62.46 -50.41 71.59 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.119 -0.988 . . . . 0.0 109.344 179.373 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.563 HD12 ' HB2' ' A' ' 87' ' ' ALA . 91.6 mt -71.8 -39.49 68.15 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 O-C-N 121.221 -0.924 . . . . 0.0 109.255 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.454 ' HD2' HD13 ' A' ' 92' ' ' ILE . 13.5 t80 -65.15 -42.58 93.63 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.214 -0.929 . . . . 0.0 109.036 179.216 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 95.6 m -61.67 -41.45 97.57 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.134 -0.979 . . . . 0.0 110.389 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.554 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.17 -32.28 26.69 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 120.874 -1.141 . . . . 0.0 112.391 -178.872 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.451 ' N ' HD12 ' A' ' 66' ' ' LEU . 40.3 t80 -86.27 -32.24 21.22 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 120.755 -1.216 . . . . 0.0 111.714 -179.469 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -98.01 -19.42 18.02 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 120.806 -1.184 . . . . 0.0 112.487 -178.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.4 mttm -119.4 -58.5 1.91 Allowed 'General case' 0 N--CA 1.503 2.207 0 O-C-N 120.509 -1.369 . . . . 0.0 110.621 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 23.9 ttt-85 -65.14 -31.26 72.37 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.112 -0.992 . . . . 0.0 110.878 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.1 tptt 57.44 42.18 25.01 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.897 -1.127 . . . . 0.0 110.036 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.88 35.02 3.68 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.356 -0.84 . . . . 0.0 109.817 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.785 HG13 HD23 ' A' ' 77' ' ' LEU . 13.8 tt -154.14 162.53 2.0 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.235 -0.915 . . . . 0.0 109.84 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.1 t -108.85 147.44 32.11 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.13 -0.981 . . . . 0.0 110.299 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.7 ttmt -45.79 -31.96 2.31 Favored 'General case' 0 N--CA 1.516 2.837 0 O-C-N 121.289 -0.882 . . . . 0.0 111.604 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -62.35 -51.23 68.46 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 120.956 -1.09 . . . . 0.0 109.234 179.526 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.785 HD23 HG13 ' A' ' 73' ' ' ILE . 46.5 tp -66.25 -42.96 87.83 Favored 'General case' 0 N--CA 1.506 2.334 0 C-N-CA 119.274 -0.971 . . . . 0.0 108.52 178.683 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.547 ' HA ' HD12 ' A' ' 81' ' ' LEU . 17.0 t80 -61.41 -39.71 91.75 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 121.341 -0.849 . . . . 0.0 109.3 179.229 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -71.42 -42.45 68.27 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.059 -1.026 . . . . 0.0 108.724 178.732 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.758 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 80.9 t90 -56.34 -36.42 68.74 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.307 -0.871 . . . . 0.0 109.725 178.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.547 HD12 ' HA ' ' A' ' 78' ' ' TYR . 18.3 mt -69.04 -49.95 53.0 Favored 'General case' 0 N--CA 1.505 2.299 0 C-N-CA 119.393 -0.923 . . . . 0.0 108.916 179.029 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.1 mm -56.59 -32.86 38.28 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.584 0 O-C-N 121.202 -0.937 . . . . 0.0 109.954 179.393 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.9 mtpp -89.34 -14.89 34.64 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 120.877 -1.139 . . . . 0.0 112.208 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.441 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 5.6 mm-40 -105.73 22.36 15.68 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.593 -1.317 . . . . 0.0 112.069 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt 75.43 71.59 0.09 Allowed 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.041 -1.037 . . . . 0.0 111.916 179.242 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.636 ' HE2' HD13 ' A' ' 23' ' ' LEU . 32.6 m-85 -133.63 -62.77 0.77 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.488 -0.757 . . . . 0.0 108.977 179.272 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.563 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -134.03 163.02 30.48 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.451 -0.781 . . . . 0.0 109.202 179.215 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.466 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 16.4 t0 -112.19 111.53 22.49 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.088 -1.008 . . . . 0.0 110.482 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 28.0 mttt -57.94 -37.0 73.33 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.245 -0.909 . . . . 0.0 110.114 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.443 HD23 HD13 ' A' ' 106' ' ' LEU . 18.2 tp -57.88 -37.46 73.99 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.091 -1.006 . . . . 0.0 110.192 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.546 ' HA ' HD21 ' A' ' 106' ' ' LEU . 64.2 tp -72.79 -47.62 45.05 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.052 -1.03 . . . . 0.0 108.512 179.065 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.454 HD13 ' HD2' ' A' ' 64' ' ' TYR . 54.5 mt -60.55 -36.55 70.74 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.38 0 O-C-N 121.184 -0.947 . . . . 0.0 108.641 178.291 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.74 -39.27 84.23 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.086 -1.009 . . . . 0.0 109.275 178.572 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.408 ' HB3' ' CD2' ' A' ' 103' ' ' LEU . 8.7 mmtt -58.24 -42.65 86.82 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.062 -1.024 . . . . 0.0 109.434 179.344 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 6.9 m0 -68.29 -38.64 81.87 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.28 -0.888 . . . . 0.0 109.875 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.78 -31.94 67.13 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.225 -0.922 . . . . 0.0 110.476 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.0 mmtm -54.37 -176.56 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.671 0 O-C-N 120.927 -1.108 . . . . 0.0 110.498 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -104.76 134.24 48.24 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.184 -0.947 . . . . 0.0 109.823 179.274 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.69 10.19 55.64 Favored Glycine 0 N--CA 1.493 2.458 0 C-N-CA 120.19 -1.005 . . . . 0.0 111.129 -179.448 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -114.13 68.72 0.7 Allowed 'General case' 0 N--CA 1.495 1.808 0 CA-C-N 119.485 1.643 . . . . 0.0 110.044 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -90.22 -38.61 13.33 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.15 -0.969 . . . . 0.0 109.963 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.37 84.25 1.94 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.159 -0.963 . . . . 0.0 109.728 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.949 HD13 HD13 ' A' ' 109' ' ' ILE . 9.0 tp -125.86 137.13 53.73 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.373 -0.829 . . . . 0.0 109.881 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.428 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.6 p -111.37 -38.97 4.82 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.211 -0.931 . . . . 0.0 112.434 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.83 ' O ' HD11 ' A' ' 103' ' ' LEU . 5.9 m -138.75 -168.16 2.35 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 120.213 -1.554 . . . . 0.0 109.678 179.04 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.546 HD21 ' HA ' ' A' ' 91' ' ' LEU . 13.3 mt -97.99 -38.12 9.51 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 120.973 -1.079 . . . . 0.0 110.541 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 11.8 tpt85 -101.97 32.2 3.56 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 120.991 -1.068 . . . . 0.0 109.498 178.092 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.667 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.306 1.7 t -127.05 15.31 7.34 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.19 -0.944 . . . . 0.0 109.216 -179.289 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.949 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -158.26 36.91 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.333 0 O-C-N 120.842 -1.161 . . . . 0.0 110.658 -178.494 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.586 ' O ' HG23 ' A' ' 119' ' ' THR . 5.6 mm-40 . . . . . 0 N--CA 1.499 2.009 0 O-C-N 120.748 -1.22 . . . . 0.0 111.68 -178.381 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.586 HG23 ' O ' ' A' ' 110' ' ' GLN . 5.4 m . . . . . 0 N--CA 1.495 1.788 0 N-CA-C 110.316 -0.253 . . . . 0.0 110.316 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.441 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 45.8 t -82.44 154.02 25.37 Favored 'General case' 0 N--CA 1.5 2.067 0 C-N-CA 119.374 -0.93 . . . . 0.0 109.084 178.749 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.787 HD12 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -72.75 -37.16 54.68 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 O-C-N 121.082 -1.011 . . . . 0.0 110.796 -179.389 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.437 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 4.5 p -54.18 -32.74 56.36 Favored 'General case' 0 N--CA 1.512 2.671 0 O-C-N 120.727 -1.233 . . . . 0.0 111.021 -179.08 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.488 ' HG3' HG22 ' A' ' 109' ' ' ILE . 7.3 ttp85 -57.93 -34.06 69.46 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 120.909 -1.12 . . . . 0.0 109.641 178.35 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 62.0 t -81.42 125.09 79.68 Favored Pre-proline 0 N--CA 1.504 2.229 0 O-C-N 121.137 -0.977 . . . . 0.0 109.725 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.518 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.4 Cg_endo -65.77 172.87 7.61 Favored 'Trans proline' 0 N--CA 1.488 1.16 0 O-C-N 123.142 1.075 . . . . 0.0 110.772 179.604 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 2.0 tpt180 -75.07 -36.42 61.78 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.188 -0.945 . . . . 0.0 110.901 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.88 -44.01 91.06 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 120.943 -1.098 . . . . 0.0 109.985 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -65.27 -40.71 94.26 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.191 -0.943 . . . . 0.0 109.385 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.518 HD12 ' O ' ' A' ' 125' ' ' PRO . 1.4 mt -61.82 -40.85 96.7 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.199 -0.938 . . . . 0.0 109.757 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -58.18 -39.93 80.16 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.158 -0.964 . . . . 0.0 109.988 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -60.36 -36.8 78.86 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.19 -0.943 . . . . 0.0 110.056 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -62.75 -47.15 84.79 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.158 -0.964 . . . . 0.0 109.946 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.443 ' HA ' HG23 ' A' ' 138' ' ' THR . . . -63.29 -41.19 98.96 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.14 -0.975 . . . . 0.0 109.788 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 6.8 ttt85 -65.06 -32.59 74.38 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.226 -0.921 . . . . 0.0 110.378 179.672 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 31.7 mttt -81.78 -29.79 32.59 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 120.86 -1.15 . . . . 0.0 111.077 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 36.3 mttt -98.71 24.35 7.66 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 120.82 -1.175 . . . . 0.0 111.712 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.15 46.94 42.56 Favored Glycine 0 N--CA 1.5 2.951 0 O-C-N 120.772 -1.205 . . . . 0.0 111.119 179.223 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.443 HG23 ' HA ' ' A' ' 133' ' ' ALA . 9.3 t -148.35 -164.76 2.09 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.114 -1.227 . . . . 0.0 110.422 179.813 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 139' ' ' GLN . . . . . 0.408 ' HA ' ' HB1' ' A' ' 133' ' ' ALA . 58.6 mt-30 -132.65 159.57 39.22 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.185 -0.947 . . . . 0.0 110.283 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.8 p -147.34 161.01 8.3 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.227 -0.921 . . . . 0.0 110.24 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 25.5 t -170.57 83.51 0.1 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.188 -0.945 . . . . 0.0 111.167 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.787 ' CG ' HD12 ' A' ' 121' ' ' ILE . 52.0 t80 -95.02 159.07 15.19 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.139 -0.976 . . . . 0.0 110.263 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -135.81 -60.37 0.74 Allowed 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -138.71 151.9 47.54 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.401 -0.812 . . . . 0.0 109.518 179.118 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 26.5 p -93.6 156.1 16.92 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.157 -0.964 . . . . 0.0 110.891 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.8 p -74.55 -25.09 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 121.314 -0.866 . . . . 0.0 111.637 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 62.8 m170 -50.88 -45.84 60.17 Favored 'General case' 0 N--CA 1.517 2.883 0 O-C-N 120.756 -1.215 . . . . 0.0 109.457 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.501 ' HB2' ' CE ' ' A' ' 53' ' ' MET . 29.1 p -143.43 177.52 8.39 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.348 -0.845 . . . . 0.0 110.537 179.507 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 149' ' ' GLY . . . . . 0.447 ' CA ' ' CE3' ' A' ' 50' ' ' TRP . . . -87.77 64.26 3.71 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 107.957 -2.057 . . . . 0.0 107.957 178.114 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 28.1 t -106.18 139.29 40.92 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.306 -1.114 . . . . 0.0 109.694 -179.093 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 31.1 mtt-85 -92.31 56.63 2.83 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.163 -0.961 . . . . 0.0 109.776 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 61.15 96.13 0.01 OUTLIER Glycine 0 N--CA 1.488 2.149 0 N-CA-C 109.764 -1.335 . . . . 0.0 109.764 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.8 p -105.13 129.21 53.58 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.288 -1.124 . . . . 0.0 110.4 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 154' ' ' ALA . . . . . 0.47 ' HB1' ' HD3' ' A' ' 125' ' ' PRO . . . -143.7 138.34 28.82 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.15 -0.968 . . . . 0.0 109.926 -179.81 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.5 2.062 0 O-C-N 121.158 -0.964 . . . . 0.0 110.484 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.721 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.505 2.294 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.78 162.8 41.34 Favored 'Trans proline' 0 C--N 1.315 -1.185 0 O-C-N 123.34 1.179 . . . . 0.0 110.759 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -48.61 -31.87 7.31 Favored 'General case' 0 N--CA 1.514 2.772 0 O-C-N 121.444 -0.785 . . . . 0.0 111.408 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.78 -34.19 36.44 Favored Glycine 0 N--CA 1.5 2.947 0 O-C-N 120.871 -1.143 . . . . 0.0 110.569 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -55.16 -33.4 62.92 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 120.978 -1.307 . . . . 0.0 110.568 179.803 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -54.12 -37.12 63.99 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.064 -1.022 . . . . 0.0 110.227 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.9 mmtt -57.81 -35.63 71.1 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.155 -0.966 . . . . 0.0 110.27 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.868 HD12 HD11 ' A' ' 23' ' ' LEU . 3.7 pt -116.23 36.68 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.138 -0.976 . . . . 0.0 110.454 179.587 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.431 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.2 OUTLIER -84.68 -43.49 0.7 Allowed Pre-proline 0 N--CA 1.508 2.442 0 O-C-N 121.038 -1.039 . . . . 0.0 113.392 -179.21 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.2 Cg_endo -76.13 -38.33 1.19 Allowed 'Trans proline' 0 N--CA 1.488 1.149 0 O-C-N 122.51 0.742 . . . . 0.0 111.922 -178.037 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.675 HG21 ' CE2' ' A' ' 62' ' ' TYR . 85.0 m -59.56 -42.95 93.61 Favored 'General case' 0 N--CA 1.512 2.654 0 O-C-N 120.925 -1.11 . . . . 0.0 109.952 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.868 HD11 HD12 ' A' ' 19' ' ' ILE . 45.2 mt -65.55 -38.75 90.52 Favored 'General case' 0 N--CA 1.506 2.347 0 C-N-CA 119.404 -0.919 . . . . 0.0 109.31 179.296 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.0 m -57.7 -34.93 69.97 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.143 -0.973 . . . . 0.0 110.227 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -56.16 -36.87 68.81 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 121.015 -1.053 . . . . 0.0 110.235 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.624 ' CD1' HD22 ' A' ' 55' ' ' LEU . 15.4 m-85 -55.89 -36.79 68.02 Favored 'General case' 0 N--CA 1.511 2.621 0 O-C-N 121.108 -0.995 . . . . 0.0 110.256 179.606 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -57.13 -27.74 62.09 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.184 -0.947 . . . . 0.0 111.001 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.477 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.7 mp -76.67 -37.37 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 O-C-N 121.001 -1.062 . . . . 0.0 109.403 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.454 ' CG ' HD11 ' A' ' 55' ' ' LEU . 34.9 tp60 -79.24 -39.55 32.82 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 120.945 -1.097 . . . . 0.0 108.746 178.46 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.072 HD11 HG23 ' A' ' 52' ' ' ILE . 7.2 tp -70.21 -34.0 72.38 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.491 -0.884 . . . . 0.0 110.399 179.084 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.7 ptm85 -71.85 -36.14 70.07 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 120.824 -1.173 . . . . 0.0 109.746 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.14 -39.49 94.84 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.06 -1.025 . . . . 0.0 109.662 179.434 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.462 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -74.81 -40.98 60.79 Favored 'General case' 0 N--CA 1.505 2.287 0 C-N-CA 119.162 -1.015 . . . . 0.0 109.15 179.026 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -67.75 -29.97 69.32 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 119.531 -0.868 . . . . 0.0 110.423 179.357 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -87.08 -32.82 19.73 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.777 -1.202 . . . . 0.0 110.89 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.4 t70 . . . . . 0 N--CA 1.512 2.635 0 O-C-N 120.923 -1.111 . . . . 0.0 110.386 -179.943 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 N--CA 1.502 2.134 0 CA-C-O 120.608 0.242 . . . . 0.0 110.579 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.405 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 31.1 m-80 -58.82 -40.12 83.21 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.171 -0.956 . . . . 0.0 109.977 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.426 ' HA ' ' CE3' ' A' ' 50' ' ' TRP . 20.7 mt-10 -60.12 -43.53 95.55 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.132 -0.98 . . . . 0.0 109.813 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.404 ' CG ' ' HA ' ' A' ' 33' ' ' ALA . 41.4 tp60 -62.89 -45.02 94.49 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.233 -0.917 . . . . 0.0 109.538 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.442 HD23 HD12 ' A' ' 52' ' ' ILE . 43.8 mt -59.29 -33.81 71.54 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.279 -0.888 . . . . 0.0 110.372 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.501 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 48.3 m0 -57.78 -40.55 80.07 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 120.834 -1.166 . . . . 0.0 109.581 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -62.41 -32.8 73.68 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 119.183 -1.007 . . . . 0.0 109.423 178.314 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 1.072 HG23 HD11 ' A' ' 30' ' ' LEU . 21.4 mt -71.04 -58.31 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.198 0 O-C-N 121.001 -1.062 . . . . 0.0 109.007 179.161 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 ptm -62.36 -29.11 70.23 Favored 'General case' 0 N--CA 1.508 2.448 0 C-N-CA 118.555 -1.258 . . . . 0.0 109.752 178.691 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -70.59 -38.75 74.08 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 120.859 -1.15 . . . . 0.0 109.124 178.233 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.624 HD22 ' CD1' ' A' ' 26' ' ' PHE . 11.0 mt -54.15 -32.87 56.47 Favored 'General case' 0 N--CA 1.513 2.696 0 O-C-N 121.054 -1.029 . . . . 0.0 110.214 178.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.44 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 6.7 t60 -55.94 -36.73 68.08 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.065 -1.022 . . . . 0.0 110.173 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.435 ' NE2' HD21 ' A' ' 91' ' ' LEU . 6.8 m170 -59.04 -47.32 85.65 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 121.023 -1.048 . . . . 0.0 109.544 179.352 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -59.73 -37.18 78.21 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.529 -0.868 . . . . 0.0 109.801 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.438 ' HG2' ' CE1' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -62.66 -48.29 79.99 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.096 -1.003 . . . . 0.0 109.447 179.421 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 26.6 p -62.99 -41.66 99.63 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.103 -0.998 . . . . 0.0 109.301 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.9 ttt85 -62.22 -40.27 95.57 Favored 'General case' 0 N--CA 1.505 2.314 0 C-N-CA 119.381 -0.928 . . . . 0.0 109.291 179.121 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.675 ' CE2' HG21 ' A' ' 22' ' ' THR . 43.5 t80 -63.3 -51.49 65.86 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.117 -0.989 . . . . 0.0 109.446 179.438 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.998 HD12 ' HB2' ' A' ' 87' ' ' ALA . 71.6 mt -68.99 -36.41 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.384 0 C-N-CA 119.303 -0.959 . . . . 0.0 109.422 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.45 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 10.3 t80 -67.54 -41.81 83.68 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.044 -1.035 . . . . 0.0 108.97 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 91.5 m -60.75 -40.97 94.45 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.071 -1.018 . . . . 0.0 110.143 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.632 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.8 pp -83.26 -36.36 24.61 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 120.966 -1.084 . . . . 0.0 112.411 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.607 ' N ' HD12 ' A' ' 66' ' ' LEU . 55.3 t80 -86.63 -35.26 19.49 Favored 'General case' 0 N--CA 1.512 2.641 0 O-C-N 120.608 -1.308 . . . . 0.0 111.826 -179.419 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.45 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 6.9 m-85 -98.36 -3.4 37.11 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 120.904 -1.123 . . . . 0.0 113.219 -178.458 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.79 -58.73 0.61 Allowed 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.352 -1.468 . . . . 0.0 110.8 179.437 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.412 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 11.7 tpt85 -62.52 -29.55 70.64 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 121.03 -1.043 . . . . 0.0 110.696 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 ttmm 59.72 44.26 14.4 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.819 -1.175 . . . . 0.0 110.021 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -118.2 37.73 3.92 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.389 -0.819 . . . . 0.0 109.87 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.72 HG13 HD23 ' A' ' 77' ' ' LEU . 14.8 tt -156.46 162.74 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.198 -0.939 . . . . 0.0 110.154 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 63.3 m -110.18 147.39 33.83 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.204 -0.935 . . . . 0.0 110.153 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.4 tttt -46.02 -32.21 2.69 Favored 'General case' 0 N--CA 1.516 2.864 0 O-C-N 121.328 -0.858 . . . . 0.0 111.606 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -62.11 -49.82 74.38 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.037 -1.039 . . . . 0.0 109.511 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.72 HD23 HG13 ' A' ' 73' ' ' ILE . 27.8 tp -67.39 -43.73 80.61 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 119.161 -1.016 . . . . 0.0 108.712 178.847 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.487 ' HA ' HD12 ' A' ' 81' ' ' LEU . 18.2 t80 -61.9 -38.13 87.21 Favored 'General case' 0 N--CA 1.506 2.327 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.325 179.135 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -73.73 -42.51 61.05 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.123 -0.986 . . . . 0.0 108.802 178.778 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.721 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 85.8 t90 -57.52 -37.01 72.32 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.31 -0.869 . . . . 0.0 109.712 178.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.541 HD22 ' CD2' ' A' ' 86' ' ' TYR . 14.6 mt -69.23 -48.57 61.6 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.21 -0.932 . . . . 0.0 108.897 179.089 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.497 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 32.4 mm -56.72 -31.74 35.95 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.614 0 O-C-N 121.124 -0.985 . . . . 0.0 109.911 179.239 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.7 mttt -86.67 -22.62 25.99 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 120.918 -1.114 . . . . 0.0 111.611 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.449 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 76.3 mm-40 -99.18 20.49 13.4 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 120.756 -1.215 . . . . 0.0 112.015 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.401 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 0.3 OUTLIER 74.03 77.22 0.12 Allowed 'General case' 0 N--CA 1.511 2.599 0 O-C-N 121.01 -1.056 . . . . 0.0 111.484 179.257 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.602 ' HE2' HD13 ' A' ' 23' ' ' LEU . 30.3 m-85 -135.69 -65.04 0.61 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.539 -0.726 . . . . 0.0 109.642 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.998 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -118.03 174.53 6.15 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.276 -0.89 . . . . 0.0 109.653 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.44 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 12.6 t0 -114.42 102.77 10.4 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.261 -0.899 . . . . 0.0 109.962 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.494 ' HG3' HD12 ' A' ' 82' ' ' ILE . 16.7 mttt -66.8 -40.21 88.02 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.303 -0.873 . . . . 0.0 109.886 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.759 HD23 HD13 ' A' ' 106' ' ' LEU . 60.7 tp -61.85 -40.3 94.85 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.188 -0.945 . . . . 0.0 109.735 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.657 ' N ' HD11 ' A' ' 106' ' ' LEU . 59.6 tp -71.93 -43.44 65.28 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.097 -1.002 . . . . 0.0 108.674 179.229 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 54.2 mt -58.36 -35.75 55.31 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.479 0 O-C-N 121.206 -0.934 . . . . 0.0 108.702 178.328 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.85 -39.52 83.8 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.17 -0.956 . . . . 0.0 109.091 178.342 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.432 ' CD ' ' CZ ' ' A' ' 100' ' ' TYR . 8.1 mmtm -57.17 -42.57 81.36 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.031 -1.043 . . . . 0.0 109.484 179.186 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.41 ' CZ3' ' HG ' ' A' ' 91' ' ' LEU . 2.7 m0 -65.36 -35.79 82.04 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.342 -0.849 . . . . 0.0 110.053 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.23 -31.78 38.49 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.125 -0.985 . . . . 0.0 110.655 179.408 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 20.4 mmtm -53.64 -176.86 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.706 0 O-C-N 120.996 -1.065 . . . . 0.0 110.745 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -104.62 135.46 45.99 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.211 -0.931 . . . . 0.0 109.765 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.04 11.94 53.52 Favored Glycine 0 N--CA 1.492 2.428 0 C-N-CA 120.262 -0.971 . . . . 0.0 110.993 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.563 ' HB3' HD23 ' A' ' 103' ' ' LEU . 48.4 m-85 -119.95 72.15 0.92 Allowed 'General case' 0 N--CA 1.492 1.664 0 CA-C-N 119.435 1.617 . . . . 0.0 109.973 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -93.69 -35.82 12.63 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.094 -1.004 . . . . 0.0 110.491 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -123.86 80.14 1.78 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.979 -1.075 . . . . 0.0 110.662 -179.7 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.563 HD23 ' HB3' ' A' ' 100' ' ' TYR . 2.8 pp -124.55 146.38 49.04 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.107 -0.996 . . . . 0.0 110.033 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.426 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.6 p -109.94 -30.87 7.61 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.154 -0.966 . . . . 0.0 112.967 -179.349 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.705 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.4 m -145.15 -169.79 3.28 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 120.194 -1.566 . . . . 0.0 110.098 179.39 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.759 HD13 HD23 ' A' ' 90' ' ' LEU . 16.7 mt -99.76 -35.99 9.61 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.295 -0.878 . . . . 0.0 110.227 178.518 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 3.3 ttt85 -103.06 33.69 3.17 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.869 -1.145 . . . . 0.0 109.653 178.207 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.705 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.276 1.6 t -124.82 -60.75 1.35 Allowed 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 105.18 -2.155 . . . . 0.0 105.18 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.718 ' O ' HG21 ' A' ' 119' ' ' THR . 4.2 pt -69.01 -21.95 25.9 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.671 0 O-C-N 120.879 -1.138 . . . . 0.0 110.784 176.47 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 . . . . . 0 N--CA 1.492 1.655 0 O-C-N 120.837 -1.164 . . . . 0.0 109.756 -179.628 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.718 HG21 ' O ' ' A' ' 109' ' ' ILE . 0.4 OUTLIER . . . . . 0 N--CA 1.5 2.036 0 CA-C-O 120.495 0.188 . . . . 0.0 110.548 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 34.2 t -59.35 154.97 15.59 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.137 -0.977 . . . . 0.0 109.485 179.485 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.956 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -76.84 -30.11 18.2 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.384 0 O-C-N 121.066 -1.021 . . . . 0.0 111.63 -179.013 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.48 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.7 p -58.67 -35.81 73.17 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 120.684 -1.26 . . . . 0.0 110.861 -178.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.18 -30.3 64.4 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 120.914 -1.116 . . . . 0.0 110.196 178.79 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.6 t -83.55 122.66 76.9 Favored Pre-proline 0 N--CA 1.505 2.303 0 O-C-N 120.976 -1.078 . . . . 0.0 110.217 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -66.08 179.2 2.0 Favored 'Trans proline' 0 N--CA 1.49 1.277 0 O-C-N 123.175 1.092 . . . . 0.0 110.94 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.26 -37.68 60.84 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.256 -0.902 . . . . 0.0 110.511 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.29 -40.62 78.19 Favored 'General case' 0 N--CA 1.511 2.622 0 O-C-N 121.047 -1.033 . . . . 0.0 110.057 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -70.41 -41.7 72.62 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 119.346 -0.941 . . . . 0.0 109.113 179.147 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.546 ' O ' HG11 ' A' ' 140' ' ' VAL . 4.3 mt -66.02 -38.77 89.27 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 121.288 -0.882 . . . . 0.0 109.402 178.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -59.95 -38.11 81.51 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.113 -0.992 . . . . 0.0 109.958 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -58.58 -37.75 76.46 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.064 -1.022 . . . . 0.0 110.379 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -63.84 -45.72 88.3 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.139 -0.976 . . . . 0.0 109.807 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.421 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -61.68 -40.97 96.84 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.169 -0.957 . . . . 0.0 109.776 179.805 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 34.7 mtt-85 -59.88 -36.12 76.25 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.245 -0.909 . . . . 0.0 110.121 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 20.7 mttm -70.54 -32.91 70.54 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.042 -1.036 . . . . 0.0 110.879 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 2.1 ttmm -100.59 22.01 12.48 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 120.97 -1.081 . . . . 0.0 111.713 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.18 45.98 57.04 Favored Glycine 0 N--CA 1.499 2.87 0 O-C-N 120.592 -1.318 . . . . 0.0 110.688 179.338 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.421 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.3 t -143.04 -165.46 2.07 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.186 -1.185 . . . . 0.0 110.164 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -134.35 149.48 50.85 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.147 -0.971 . . . . 0.0 110.302 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.546 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.7 p -130.98 161.34 41.17 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 121.241 -0.912 . . . . 0.0 109.954 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 30.3 t -166.17 100.2 0.63 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.187 -0.946 . . . . 0.0 111.19 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.956 ' CD1' HD12 ' A' ' 121' ' ' ILE . 74.3 t80 -101.31 160.54 14.32 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.311 -0.868 . . . . 0.0 110.371 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -138.44 -60.88 0.6 Allowed 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.899 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.05 149.25 41.43 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.392 -0.817 . . . . 0.0 109.419 179.122 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 145' ' ' CYS . . . . . 0.453 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.7 p -91.65 157.96 16.67 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 120.992 -1.067 . . . . 0.0 110.765 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 12.5 p -78.42 -23.06 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 O-C-N 121.29 -0.881 . . . . 0.0 111.906 -179.311 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 62.8 m170 -51.77 -57.92 7.88 Favored 'General case' 0 N--CA 1.515 2.825 0 O-C-N 120.725 -1.234 . . . . 0.0 109.956 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.501 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 24.2 p -126.78 -165.49 1.46 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.296 -0.878 . . . . 0.0 110.387 179.634 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 149' ' ' GLY . . . . . 0.416 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.42 65.07 0.58 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 107.891 -2.084 . . . . 0.0 107.891 178.313 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 33.6 t -101.72 141.76 34.09 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.344 -1.092 . . . . 0.0 109.813 -179.082 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 66.0 mtm-85 -100.38 43.56 1.05 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.18 -0.95 . . . . 0.0 109.772 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 80.61 95.55 0.39 Allowed Glycine 0 N--CA 1.486 2.002 0 N-CA-C 109.99 -1.244 . . . . 0.0 109.99 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.6 p -109.31 126.97 53.93 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.202 -1.176 . . . . 0.0 110.136 179.427 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -154.32 147.6 24.88 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.118 -0.989 . . . . 0.0 110.415 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.501 2.101 0 O-C-N 121.228 -0.92 . . . . 0.0 110.542 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.685 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.499 1.988 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.435 ' HG2' HD13 ' A' ' 77' ' ' LEU . 43.7 Cg_endo -69.72 162.76 40.82 Favored 'Trans proline' 0 C--N 1.314 -1.238 0 O-C-N 123.435 1.229 . . . . 0.0 110.84 -179.66 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -48.61 -31.43 6.63 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.417 -0.802 . . . . 0.0 111.532 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.41 -35.73 36.54 Favored Glycine 0 N--CA 1.499 2.881 0 O-C-N 120.958 -1.089 . . . . 0.0 110.6 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.427 ' CE2' ' HG2' ' A' ' 20' ' ' LYS . 22.7 t80 -56.98 -33.48 67.14 Favored 'General case' 0 N--CA 1.511 2.617 0 O-C-N 121.034 -1.274 . . . . 0.0 110.579 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -53.78 -38.71 64.76 Favored 'General case' 0 N--CA 1.512 2.647 0 O-C-N 120.991 -1.068 . . . . 0.0 110.166 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 79.6 mttt -60.73 -36.59 79.25 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.366 -0.833 . . . . 0.0 110.081 179.48 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.694 HD12 HD11 ' A' ' 23' ' ' LEU . 1.8 pt -114.32 33.49 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 O-C-N 121.247 -0.908 . . . . 0.0 110.757 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.427 ' HG2' ' CE2' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -83.99 -45.54 0.76 Allowed Pre-proline 0 N--CA 1.51 2.525 0 O-C-N 121.056 -1.027 . . . . 0.0 112.872 -179.279 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.412 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.3 Cg_endo -76.78 -36.45 1.55 Allowed 'Trans proline' 0 N--CA 1.485 1.017 0 O-C-N 122.688 0.836 . . . . 0.0 111.46 -178.383 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.789 HG21 ' CE2' ' A' ' 62' ' ' TYR . 87.1 m -59.08 -42.64 90.89 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 120.935 -1.103 . . . . 0.0 109.893 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.694 HD11 HD12 ' A' ' 19' ' ' ILE . 93.6 mt -66.11 -39.95 90.33 Favored 'General case' 0 N--CA 1.505 2.302 0 C-N-CA 119.442 -0.903 . . . . 0.0 109.468 179.314 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.9 m -57.95 -34.5 69.97 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.167 -0.958 . . . . 0.0 110.072 179.116 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -55.84 -35.14 66.07 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 121.018 -1.051 . . . . 0.0 110.332 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.724 ' CD2' HD22 ' A' ' 55' ' ' LEU . 15.0 m-85 -57.67 -39.45 77.12 Favored 'General case' 0 N--CA 1.51 2.526 0 O-C-N 121.006 -1.059 . . . . 0.0 110.486 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -59.99 -34.36 73.21 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.238 -0.914 . . . . 0.0 111.022 -179.425 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.4 mp -71.43 -39.62 71.53 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.369 0 O-C-N 121.017 -1.052 . . . . 0.0 109.265 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 -70.52 -43.77 68.94 Favored 'General case' 0 N--CA 1.507 2.378 0 C-N-CA 119.199 -1.0 . . . . 0.0 108.725 178.784 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.707 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -66.35 -34.92 79.06 Favored 'General case' 0 N--CA 1.506 2.357 0 C-N-CA 119.366 -0.933 . . . . 0.0 108.974 178.286 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -57.62 -40.61 79.53 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.102 -0.999 . . . . 0.0 109.962 179.392 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.95 -46.37 88.06 Favored 'General case' 0 N--CA 1.506 2.371 0 C-N-CA 119.301 -0.96 . . . . 0.0 109.829 -179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.549 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -67.89 -40.43 83.51 Favored 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 119.237 -0.985 . . . . 0.0 109.215 179.081 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -59.62 -35.06 73.62 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.249 -0.907 . . . . 0.0 110.346 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 46.4 mmtt -95.29 -38.49 10.51 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 120.992 -1.067 . . . . 0.0 110.641 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.6 t70 . . . . . 0 N--CA 1.509 2.524 0 O-C-N 121.059 -1.025 . . . . 0.0 110.099 179.892 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.423 ' OG ' ' N ' ' A' ' 46' ' ' ASN . 5.7 p . . . . . 0 N--CA 1.498 1.925 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.423 ' N ' ' OG ' ' A' ' 45' ' ' SER . 3.1 m120 -57.09 -38.55 73.51 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.256 -0.902 . . . . 0.0 109.967 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.421 ' HA ' ' CE3' ' A' ' 50' ' ' TRP . 20.0 mt-10 -63.24 -41.09 99.04 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.155 -0.966 . . . . 0.0 109.797 179.586 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.0 tp60 -61.87 -39.99 93.83 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.141 -0.974 . . . . 0.0 109.782 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.675 HD23 HD12 ' A' ' 52' ' ' ILE . 12.5 mt -62.66 -36.87 84.24 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.188 -0.945 . . . . 0.0 110.283 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.514 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.9 m0 -54.41 -39.57 67.43 Favored 'General case' 0 N--CA 1.512 2.639 0 O-C-N 120.909 -1.119 . . . . 0.0 109.724 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -63.45 -38.08 89.77 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.258 -0.901 . . . . 0.0 109.635 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.707 HG23 ' CG ' ' A' ' 30' ' ' LEU . 78.8 mt -64.86 -44.96 96.23 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.394 0 O-C-N 121.135 -0.978 . . . . 0.0 109.173 179.632 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.463 ' CE ' ' HB3' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -68.17 -30.55 69.69 Favored 'General case' 0 N--CA 1.501 2.101 0 C-N-CA 118.889 -1.124 . . . . 0.0 109.743 178.999 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.446 ' N ' ' HG3' ' A' ' 53' ' ' MET . 48.1 mt-30 -67.39 -37.4 83.08 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.898 -1.126 . . . . 0.0 109.111 178.653 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.724 HD22 ' CD2' ' A' ' 26' ' ' PHE . 13.6 mt -52.35 -32.33 37.76 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.115 -0.99 . . . . 0.0 109.917 178.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.453 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 13.3 t60 -56.92 -40.27 76.01 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.023 -1.048 . . . . 0.0 109.389 179.024 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.423 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 8.0 m170 -60.44 -49.16 78.67 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.154 -0.966 . . . . 0.0 109.137 178.583 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -59.59 -39.45 84.19 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.343 -0.848 . . . . 0.0 109.365 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.426 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -62.42 -48.13 81.06 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.138 -0.976 . . . . 0.0 108.928 178.955 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 12.6 p -66.81 -40.57 88.09 Favored 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 119.384 -0.926 . . . . 0.0 108.699 178.656 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.8 ttt85 -63.01 -37.52 87.53 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.13 -0.981 . . . . 0.0 109.413 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.789 ' CE2' HG21 ' A' ' 22' ' ' THR . 44.5 t80 -61.1 -50.83 71.67 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.124 -0.985 . . . . 0.0 109.293 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.675 HD12 ' HB2' ' A' ' 87' ' ' ALA . 88.6 mt -73.33 -42.01 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.344 0 C-N-CA 119.37 -0.932 . . . . 0.0 108.855 179.06 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.507 ' CE1' HG23 ' A' ' 92' ' ' ILE . 47.7 t80 -57.85 -32.56 67.76 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.331 -0.855 . . . . 0.0 110.235 178.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 61.9 m -80.78 -36.97 31.08 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 120.881 -1.137 . . . . 0.0 110.59 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.622 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -82.93 -32.05 27.4 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 120.954 -1.092 . . . . 0.0 112.25 -179.173 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.503 ' HD1' HG23 ' A' ' 73' ' ' ILE . 90.3 t80 -86.47 -36.16 19.21 Favored 'General case' 0 N--CA 1.512 2.655 0 O-C-N 120.658 -1.277 . . . . 0.0 111.731 -179.37 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -98.56 -20.6 16.95 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 120.896 -1.128 . . . . 0.0 112.951 -178.278 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -119.27 -56.45 2.07 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 120.48 -1.387 . . . . 0.0 111.637 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.425 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 8.4 ttt-85 -66.76 -29.72 69.76 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.056 -1.027 . . . . 0.0 110.805 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 59.5 44.6 14.6 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.822 -1.174 . . . . 0.0 110.042 -179.61 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.52 37.17 3.3 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.336 -0.853 . . . . 0.0 109.523 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.774 HG13 HD23 ' A' ' 77' ' ' LEU . 13.6 tt -160.43 162.69 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 121.243 -0.911 . . . . 0.0 110.139 -179.583 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.8 p -108.26 148.83 29.43 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.135 -0.978 . . . . 0.0 110.024 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.8 tttt -46.71 -32.2 3.43 Favored 'General case' 0 N--CA 1.515 2.799 0 O-C-N 121.271 -0.893 . . . . 0.0 111.556 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -61.69 -50.32 72.94 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.917 -1.114 . . . . 0.0 109.337 179.542 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.774 HD23 HG13 ' A' ' 73' ' ' ILE . 34.8 tp -67.33 -42.16 84.04 Favored 'General case' 0 N--CA 1.504 2.235 0 C-N-CA 119.118 -1.033 . . . . 0.0 108.657 178.875 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.643 ' HA ' HD12 ' A' ' 81' ' ' LEU . 19.1 t80 -61.6 -39.71 92.19 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.227 -0.921 . . . . 0.0 109.194 178.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -70.36 -42.44 71.8 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.142 -0.974 . . . . 0.0 108.728 178.661 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.685 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 68.3 t90 -56.95 -35.16 68.79 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.215 -0.928 . . . . 0.0 109.859 178.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.643 HD12 ' HA ' ' A' ' 78' ' ' TYR . 13.2 mt -70.37 -49.82 45.24 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.077 -1.015 . . . . 0.0 108.902 179.116 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 36.1 mm -58.37 -32.52 45.36 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.567 0 O-C-N 121.26 -0.9 . . . . 0.0 110.032 179.457 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.9 mttm -89.27 -15.74 32.81 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 120.894 -1.128 . . . . 0.0 112.108 -179.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.426 ' HB2' ' CE1' ' A' ' 86' ' ' TYR . 26.3 mm-40 -105.36 20.64 18.54 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 120.581 -1.324 . . . . 0.0 112.063 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt 73.85 77.36 0.13 Allowed 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.05 -1.031 . . . . 0.0 111.578 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.466 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 28.6 m-85 -135.01 -63.45 0.69 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.531 -0.73 . . . . 0.0 109.711 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.675 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -120.23 -174.48 2.79 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.377 -0.827 . . . . 0.0 109.894 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.453 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.7 t0 -124.04 112.78 17.56 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.134 -0.979 . . . . 0.0 110.435 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -63.74 -40.74 97.46 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.117 -0.989 . . . . 0.0 109.395 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.488 ' HB3' HD13 ' A' ' 106' ' ' LEU . 13.0 tp -59.59 -40.64 88.11 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.126 -0.984 . . . . 0.0 109.596 179.5 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.688 HD12 ' CZ3' ' A' ' 95' ' ' TRP . 0.2 OUTLIER -65.22 -53.24 47.57 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.188 -0.945 . . . . 0.0 109.012 179.368 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.507 HG23 ' CE1' ' A' ' 64' ' ' TYR . 55.8 mt -62.32 -34.71 65.64 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.313 0 O-C-N 121.228 -0.92 . . . . 0.0 109.127 178.733 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.93 -40.07 91.08 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.052 -1.03 . . . . 0.0 109.9 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.652 ' HB3' HD22 ' A' ' 103' ' ' LEU . 9.4 mttp -64.98 -42.53 94.47 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.026 -1.047 . . . . 0.0 110.267 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.688 ' CZ3' HD12 ' A' ' 91' ' ' LEU . 3.1 m0 -62.15 -33.5 74.62 Favored 'General case' 0 N--CA 1.51 2.553 0 C-N-CA 118.983 -1.087 . . . . 0.0 110.107 178.901 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.12 -35.3 36.97 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 120.963 -1.086 . . . . 0.0 110.452 179.596 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.6 mmtp -53.13 -179.31 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.652 0 O-C-N 121.009 -1.057 . . . . 0.0 110.718 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.1 m -106.6 140.46 39.44 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.289 -0.882 . . . . 0.0 109.544 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 101.23 -24.53 31.5 Favored Glycine 0 N--CA 1.492 2.408 0 C-N-CA 119.834 -1.174 . . . . 0.0 110.45 -179.235 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.59 ' HB3' HD23 ' A' ' 103' ' ' LEU . 63.4 m-85 -91.95 58.56 3.41 Favored 'General case' 0 N--CA 1.503 2.224 0 CA-C-N 119.083 1.441 . . . . 0.0 110.047 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -71.18 -37.46 72.16 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.018 -1.051 . . . . 0.0 110.208 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.62 84.86 2.33 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.046 -1.034 . . . . 0.0 110.617 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.84 ' HB2' HD13 ' A' ' 109' ' ' ILE . 2.3 pp -120.54 140.83 50.9 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.086 -1.009 . . . . 0.0 110.303 179.583 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.423 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.5 p -108.03 -28.82 9.33 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.235 -0.916 . . . . 0.0 112.598 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.715 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 10.6 m -146.68 -169.83 3.37 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 120.366 -1.459 . . . . 0.0 110.005 179.314 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.661 HD21 ' HA ' ' A' ' 91' ' ' LEU . 93.9 mt -100.09 -35.1 9.8 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.211 -0.931 . . . . 0.0 110.583 178.861 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.92 36.67 2.37 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.757 -1.215 . . . . 0.0 109.187 178.203 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.715 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.284 1.6 t -127.72 -59.01 1.22 Allowed 'General case' 0 N--CA 1.498 1.946 0 N-CA-C 105.788 -1.931 . . . . 0.0 105.788 -179.411 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.84 HD13 ' HB2' ' A' ' 103' ' ' LEU . 18.8 pt -69.15 -26.22 31.49 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.617 0 O-C-N 121.001 -1.062 . . . . 0.0 110.741 177.034 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.414 ' N ' HG13 ' A' ' 109' ' ' ILE . 47.2 tt0 . . . . . 0 N--CA 1.493 1.683 0 O-C-N 120.865 -1.147 . . . . 0.0 110.175 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.759 HG21 ' O ' ' A' ' 109' ' ' ILE . 0.9 OUTLIER . . . . . 0 N--CA 1.495 1.789 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 35.1 t -55.48 153.68 7.28 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.047 -1.033 . . . . 0.0 110.047 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.801 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -74.22 -36.17 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.469 0 O-C-N 121.144 -0.973 . . . . 0.0 111.279 -179.07 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.483 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 10.7 p -52.72 -30.72 33.93 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.75 -1.219 . . . . 0.0 111.723 -178.345 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 1.5 ttt85 -61.61 -37.01 82.35 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 120.873 -1.142 . . . . 0.0 109.531 178.584 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 50.5 t -76.12 124.16 88.24 Favored Pre-proline 0 N--CA 1.505 2.286 0 O-C-N 121.109 -0.994 . . . . 0.0 110.031 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -66.09 172.83 8.07 Favored 'Trans proline' 0 N--CA 1.488 1.201 0 O-C-N 123.241 1.127 . . . . 0.0 110.707 179.426 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 27.1 mmm-85 -75.04 -36.2 61.88 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 121.19 -0.944 . . . . 0.0 110.675 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.05 -40.8 77.53 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 120.974 -1.079 . . . . 0.0 110.123 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -68.69 -41.6 78.93 Favored 'General case' 0 N--CA 1.506 2.348 0 C-N-CA 119.349 -0.94 . . . . 0.0 109.276 179.338 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.612 HD11 HD11 ' A' ' 121' ' ' ILE . 1.6 mt -64.53 -39.39 93.69 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.263 -0.898 . . . . 0.0 109.501 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -59.0 -37.82 77.75 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.181 -0.949 . . . . 0.0 110.13 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -58.15 -37.15 74.09 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.046 -1.034 . . . . 0.0 110.454 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.16 -47.67 81.69 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.237 -0.915 . . . . 0.0 109.892 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.582 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -61.2 -39.86 91.78 Favored 'General case' 0 N--CA 1.508 2.456 0 C-N-CA 119.33 -0.948 . . . . 0.0 109.787 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -37.33 79.63 Favored 'General case' 0 N--CA 1.512 2.631 0 O-C-N 121.174 -0.954 . . . . 0.0 110.149 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 13.5 mmtm -87.06 -38.86 16.14 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.084 -1.01 . . . . 0.0 110.261 179.748 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' LYS . . . . . 0.451 ' HB3' HG22 ' A' ' 138' ' ' THR . 0.1 OUTLIER -70.28 -26.71 63.93 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.14 -0.975 . . . . 0.0 111.158 179.668 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 91.69 32.28 8.73 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 110.006 -1.238 . . . . 0.0 110.006 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.582 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.6 t -139.96 -159.67 0.98 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.981 -1.305 . . . . 0.0 109.725 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -134.41 134.73 41.98 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.045 -1.034 . . . . 0.0 110.228 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 13.2 p -120.42 160.55 20.92 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.258 -0.902 . . . . 0.0 110.116 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 35.6 t -168.92 80.51 0.13 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.165 -0.959 . . . . 0.0 111.327 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.777 ' CG ' HD12 ' A' ' 121' ' ' ILE . 40.1 t80 -87.72 160.34 18.13 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.163 -0.961 . . . . 0.0 109.679 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -136.77 -61.26 0.68 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.515 -0.741 . . . . 0.0 109.092 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -135.57 153.25 51.75 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.435 -0.79 . . . . 0.0 109.504 179.184 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 145' ' ' CYS . . . . . 0.405 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.0 p -95.3 155.76 16.6 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.137 -0.977 . . . . 0.0 110.92 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.6 m -73.96 -25.85 20.66 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.522 0 O-C-N 121.271 -0.893 . . . . 0.0 111.814 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 61.5 m170 -51.64 -48.0 63.52 Favored 'General case' 0 N--CA 1.515 2.815 0 O-C-N 120.835 -1.166 . . . . 0.0 110.04 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.514 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 30.9 p -137.85 -168.87 2.43 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.161 -0.962 . . . . 0.0 111.01 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -98.85 57.41 0.93 Allowed Glycine 0 N--CA 1.492 2.429 0 N-CA-C 107.633 -2.187 . . . . 0.0 107.633 178.509 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 19.8 t -97.51 141.2 30.85 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.421 -1.046 . . . . 0.0 109.744 -179.112 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.21 51.74 1.11 Allowed 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.312 -0.868 . . . . 0.0 109.506 179.356 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 68.77 98.16 0.04 OUTLIER Glycine 0 N--CA 1.488 2.1 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.8 p -109.6 129.42 55.59 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.213 -1.169 . . . . 0.0 110.332 179.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -145.51 147.65 32.36 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.18 -0.95 . . . . 0.0 110.212 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.498 1.968 0 O-C-N 121.206 -0.933 . . . . 0.0 110.735 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.75 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.501 2.124 0 CA-C-O 120.461 0.172 . . . . 0.0 110.573 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -71.15 163.46 39.12 Favored 'Trans proline' 0 C--N 1.317 -1.113 0 O-C-N 123.309 1.162 . . . . 0.0 110.734 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -48.18 -32.51 7.14 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 121.479 -0.763 . . . . 0.0 111.358 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -54.37 -34.16 54.02 Favored Glycine 0 N--CA 1.497 2.744 0 O-C-N 120.984 -1.072 . . . . 0.0 110.431 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.471 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 27.5 t80 -54.46 -31.88 56.51 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.985 -1.303 . . . . 0.0 110.843 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.17 -37.73 64.78 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.02 -1.05 . . . . 0.0 110.272 179.77 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.7 mmmm -58.02 -35.78 71.76 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.232 -0.917 . . . . 0.0 110.342 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.818 HD12 HD11 ' A' ' 23' ' ' LEU . 2.8 pt -117.97 36.37 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.047 0 O-C-N 121.208 -0.933 . . . . 0.0 110.473 179.733 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.436 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -83.84 -43.64 0.79 Allowed Pre-proline 0 N--CA 1.508 2.448 0 O-C-N 120.998 -1.064 . . . . 0.0 113.132 -179.165 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.436 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.7 Cg_endo -76.66 -35.97 1.81 Allowed 'Trans proline' 0 N--CA 1.486 1.043 0 O-C-N 122.584 0.781 . . . . 0.0 111.869 -178.263 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.817 HG21 ' CE2' ' A' ' 62' ' ' TYR . 61.8 m -61.48 -47.16 86.92 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 120.893 -1.129 . . . . 0.0 110.015 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.818 HD11 HD12 ' A' ' 19' ' ' ILE . 10.9 mt -61.19 -38.07 85.21 Favored 'General case' 0 N--CA 1.509 2.487 0 C-N-CA 119.476 -0.89 . . . . 0.0 109.701 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.7 m -56.88 -35.43 68.93 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.07 -1.018 . . . . 0.0 110.278 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -56.82 -37.64 71.51 Favored 'General case' 0 N--CA 1.512 2.653 0 O-C-N 121.125 -0.985 . . . . 0.0 110.192 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.733 ' CD2' HD22 ' A' ' 55' ' ' LEU . 21.7 m-85 -58.92 -40.28 84.11 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.134 -0.979 . . . . 0.0 110.17 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -60.86 -23.16 64.94 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.269 -0.895 . . . . 0.0 111.471 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.554 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.7 mp -81.14 -34.59 13.65 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.313 0 O-C-N 120.829 -1.169 . . . . 0.0 109.719 179.428 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 57.5 tp60 -81.24 -37.03 29.23 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.898 -1.127 . . . . 0.0 109.211 178.448 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.734 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -73.43 -32.43 64.38 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.115 -0.991 . . . . 0.0 110.12 178.887 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.7 ptm180 -69.92 -36.7 75.57 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 120.842 -1.161 . . . . 0.0 109.742 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -64.82 -39.78 94.14 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.081 -1.012 . . . . 0.0 109.504 179.375 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.575 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -68.97 -41.7 77.56 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.15 -0.969 . . . . 0.0 109.369 179.18 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 9.2 mm-40 -61.64 -34.34 75.52 Favored 'General case' 0 N--CA 1.506 2.343 0 C-N-CA 119.568 -0.853 . . . . 0.0 110.449 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.2 mttt -94.02 -36.16 12.27 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 120.991 -1.068 . . . . 0.0 110.921 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.0 t70 . . . . . 0 N--CA 1.51 2.56 0 O-C-N 121.031 -1.043 . . . . 0.0 110.238 179.988 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.499 2.023 0 CA-C-O 120.601 0.239 . . . . 0.0 110.576 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.5 m-80 -57.55 -39.0 75.69 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.12 -0.988 . . . . 0.0 110.186 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -64.63 -44.24 91.14 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.141 -0.974 . . . . 0.0 109.61 179.713 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.8 tp60 -64.17 -41.41 97.15 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.224 -0.923 . . . . 0.0 109.481 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.628 HD23 HD12 ' A' ' 52' ' ' ILE . 12.9 mt -61.08 -36.94 81.0 Favored 'General case' 0 N--CA 1.507 2.412 0 C-N-CA 119.487 -0.885 . . . . 0.0 110.044 179.69 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.504 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 53.6 m0 -58.51 -38.43 77.67 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 120.993 -1.067 . . . . 0.0 110.105 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -62.17 -30.13 70.84 Favored 'General case' 0 N--CA 1.505 2.315 0 C-N-CA 119.147 -1.021 . . . . 0.0 109.802 178.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.734 HG23 ' CG ' ' A' ' 30' ' ' LEU . 77.6 mt -71.21 -57.58 7.24 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.288 0 O-C-N 120.886 -1.134 . . . . 0.0 109.284 179.41 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 ptm -62.44 -30.0 70.91 Favored 'General case' 0 N--CA 1.508 2.466 0 C-N-CA 118.621 -1.232 . . . . 0.0 109.77 179.016 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -67.34 -38.34 84.7 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 120.808 -1.182 . . . . 0.0 109.116 178.148 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.733 HD22 ' CD2' ' A' ' 26' ' ' PHE . 10.9 mt -53.13 -31.02 40.14 Favored 'General case' 0 N--CA 1.511 2.608 0 O-C-N 121.028 -1.045 . . . . 0.0 110.248 179.002 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.467 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 5.3 t60 -56.48 -38.35 71.61 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.007 -1.058 . . . . 0.0 109.965 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.503 ' CD2' HD21 ' A' ' 91' ' ' LEU . 5.4 m170 -60.38 -50.59 73.0 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.122 -0.986 . . . . 0.0 109.284 179.034 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.6 tp60 -59.38 -34.83 72.9 Favored 'General case' 0 N--CA 1.507 2.394 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.402 178.782 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.442 ' HD3' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -66.52 -52.04 50.2 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.145 -0.972 . . . . 0.0 109.175 178.912 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.0 p -63.01 -38.37 90.91 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.208 -0.932 . . . . 0.0 109.2 179.005 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.426 ' O ' ' OG1' ' A' ' 65' ' ' THR . 1.5 ttt85 -64.59 -40.46 95.56 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.134 -0.979 . . . . 0.0 109.046 178.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.817 ' CE2' HG21 ' A' ' 22' ' ' THR . 38.6 t80 -62.19 -51.28 68.44 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.194 -0.941 . . . . 0.0 109.284 179.307 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.804 HD12 ' HB2' ' A' ' 87' ' ' ALA . 78.8 mt -69.41 -39.27 78.56 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.439 0 C-N-CA 119.453 -0.899 . . . . 0.0 109.247 179.304 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.409 ' HD2' HD13 ' A' ' 92' ' ' ILE . 12.6 t80 -65.12 -43.12 93.03 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.249 -0.907 . . . . 0.0 109.162 179.198 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.426 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 88.4 m -60.88 -41.8 96.69 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.083 -1.01 . . . . 0.0 110.468 -179.53 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.572 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.35 -32.59 26.17 Favored 'General case' 0 N--CA 1.503 2.207 0 C-N-CA 118.887 -1.125 . . . . 0.0 112.541 -178.906 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.455 ' N ' HD12 ' A' ' 66' ' ' LEU . 46.7 t80 -86.38 -32.24 21.06 Favored 'General case' 0 N--CA 1.512 2.666 0 O-C-N 120.605 -1.31 . . . . 0.0 111.851 -179.536 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.407 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 7.8 m-85 -98.27 -19.09 18.02 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 120.814 -1.179 . . . . 0.0 112.622 -178.87 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.404 ' HD3' ' HA ' ' A' ' 65' ' ' THR . 7.8 mtpt -121.18 -58.41 1.79 Allowed 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.501 -1.375 . . . . 0.0 110.916 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.411 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 6.9 ttm180 -64.71 -31.13 72.21 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.19 -0.944 . . . . 0.0 110.774 -179.504 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 57.93 43.16 21.82 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.814 -1.179 . . . . 0.0 110.019 -179.607 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.64 35.78 3.71 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.443 -0.785 . . . . 0.0 109.824 179.276 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.802 HG13 HD23 ' A' ' 77' ' ' LEU . 13.9 tt -154.52 162.67 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.26 -0.9 . . . . 0.0 109.98 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 4.6 t -109.31 146.46 34.29 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.128 -0.982 . . . . 0.0 110.192 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -45.03 -32.69 1.78 Allowed 'General case' 0 N--CA 1.516 2.851 0 O-C-N 121.316 -0.865 . . . . 0.0 111.728 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -61.53 -50.92 70.72 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 120.841 -1.162 . . . . 0.0 109.227 179.384 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.802 HD23 HG13 ' A' ' 73' ' ' ILE . 40.4 tp -66.8 -43.64 83.35 Favored 'General case' 0 N--CA 1.505 2.309 0 C-N-CA 119.252 -0.979 . . . . 0.0 108.46 178.628 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.433 ' HA ' HD12 ' A' ' 81' ' ' LEU . 16.9 t80 -60.38 -38.0 82.54 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.349 -0.844 . . . . 0.0 109.465 179.038 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.501 ' O ' HG22 ' A' ' 82' ' ' ILE . 34.8 t70 -74.8 -41.91 59.08 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.028 -1.045 . . . . 0.0 108.891 178.908 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.75 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 88.6 t90 -58.99 -38.92 80.29 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.168 -0.958 . . . . 0.0 109.245 178.786 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.468 HD23 ' CE2' ' A' ' 86' ' ' TYR . 13.9 mt -65.58 -54.88 21.74 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.226 -0.921 . . . . 0.0 109.244 179.056 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.632 HD12 ' HB3' ' A' ' 87' ' ' ALA . 0.8 OUTLIER -55.81 -27.43 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.512 0 O-C-N 121.077 -1.014 . . . . 0.0 110.751 -179.856 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.6 ttpm? -87.77 -21.99 24.81 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 120.943 -1.098 . . . . 0.0 111.582 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.446 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 27.4 mm-40 -99.87 23.44 9.73 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.684 -1.26 . . . . 0.0 111.866 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.412 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 7.8 ttpt 75.99 72.49 0.08 Allowed 'General case' 0 N--CA 1.512 2.64 0 O-C-N 121.177 -0.952 . . . . 0.0 111.743 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.751 ' HE2' HD13 ' A' ' 23' ' ' LEU . 32.0 m-85 -134.54 -62.55 0.74 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.516 -0.74 . . . . 0.0 109.218 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.804 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -129.67 -179.7 5.33 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.424 -0.798 . . . . 0.0 109.6 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.467 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 7.3 t0 -131.09 127.82 38.95 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.075 -1.016 . . . . 0.0 110.627 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 8.9 mttp -75.09 -37.44 61.54 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.242 -0.911 . . . . 0.0 109.835 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.444 HD12 ' HA ' ' A' ' 90' ' ' LEU . 13.8 tp -60.27 -42.33 95.18 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.079 -1.013 . . . . 0.0 109.932 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.503 HD21 ' CD2' ' A' ' 57' ' ' HIS . 53.6 tp -69.02 -50.05 52.2 Favored 'General case' 0 N--CA 1.505 2.277 0 C-N-CA 119.151 -1.02 . . . . 0.0 108.849 179.24 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.459 HG22 ' HD2' ' A' ' 96' ' ' ARG . 60.7 mt -59.37 -36.56 64.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.426 0 C-N-CA 119.142 -1.023 . . . . 0.0 108.693 178.282 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.88 -39.32 90.58 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.145 -0.972 . . . . 0.0 109.068 178.354 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.419 ' HD2' ' CE1' ' A' ' 100' ' ' TYR . 9.8 mmtm -57.1 -45.3 83.49 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.105 -0.997 . . . . 0.0 109.268 179.142 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.7 m0 -62.62 -36.68 83.57 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.402 -0.811 . . . . 0.0 110.003 179.427 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.459 ' HD2' HG22 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -75.59 -33.4 60.58 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.063 -1.023 . . . . 0.0 110.649 179.736 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.6 mmtt -53.65 -176.99 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.743 0 O-C-N 121.032 -1.042 . . . . 0.0 110.613 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 31.2 m -103.14 133.52 48.11 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.26 -0.9 . . . . 0.0 109.748 179.202 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.84 11.29 53.71 Favored Glycine 0 N--CA 1.494 2.52 0 C-N-CA 120.233 -0.984 . . . . 0.0 111.043 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.559 ' HB3' HD23 ' A' ' 103' ' ' LEU . 53.6 m-85 -118.71 71.02 0.83 Allowed 'General case' 0 N--CA 1.494 1.731 0 CA-C-N 119.463 1.631 . . . . 0.0 109.68 179.6 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -98.23 -33.87 10.94 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.065 -1.022 . . . . 0.0 111.336 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.58 60.59 1.08 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.99 -1.069 . . . . 0.0 111.088 -179.321 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.559 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.4 pp -108.91 151.76 25.84 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.906 -1.121 . . . . 0.0 109.618 179.082 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.427 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.5 p -112.72 -28.1 7.91 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.173 -0.954 . . . . 0.0 113.521 -178.881 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.638 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.7 m -144.05 -168.5 2.88 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 120.094 -1.629 . . . . 0.0 109.955 179.217 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' A' ' 106' ' ' LEU . 12.5 mt -95.62 -38.76 10.24 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.219 -0.926 . . . . 0.0 109.884 178.86 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 32.6 ttm-85 -102.22 29.63 5.01 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.032 -1.042 . . . . 0.0 110.129 178.229 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.638 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.8 t -127.67 17.23 6.91 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.053 -1.03 . . . . 0.0 108.935 -179.533 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.498 HG22 ' HG3' ' A' ' 123' ' ' ARG . 1.1 pt -158.07 38.68 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.264 0 O-C-N 120.863 -1.148 . . . . 0.0 110.179 -178.795 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.762 ' C ' HG23 ' A' ' 119' ' ' THR . 7.8 mt-30 . . . . . 0 N--CA 1.506 2.347 0 O-C-N 120.884 -1.135 . . . . 0.0 110.829 -178.756 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.762 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.5 m . . . . . 0 N--CA 1.494 1.754 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.423 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 48.8 t -94.48 154.17 17.55 Favored 'General case' 0 N--CA 1.495 1.807 0 C-N-CA 119.505 -0.878 . . . . 0.0 108.853 178.522 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.962 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -74.9 -31.2 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.445 0 O-C-N 121.051 -1.03 . . . . 0.0 111.606 -178.803 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.483 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.2 p -59.12 -35.73 73.97 Favored 'General case' 0 N--CA 1.512 2.625 0 O-C-N 120.663 -1.273 . . . . 0.0 110.594 -179.203 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.498 ' HG3' HG22 ' A' ' 109' ' ' ILE . 13.4 ttt-85 -57.31 -33.34 67.58 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.997 -1.065 . . . . 0.0 109.979 178.883 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.3 t -79.58 123.97 83.95 Favored Pre-proline 0 N--CA 1.506 2.372 0 O-C-N 121.092 -1.005 . . . . 0.0 110.117 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -67.01 178.72 2.72 Favored 'Trans proline' 0 N--CA 1.489 1.212 0 O-C-N 123.164 1.086 . . . . 0.0 110.801 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 25.1 mmm-85 -75.14 -37.39 61.4 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.238 -0.914 . . . . 0.0 110.422 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.36 -40.91 79.07 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.048 -1.033 . . . . 0.0 110.062 -179.798 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -69.64 -41.95 74.9 Favored 'General case' 0 N--CA 1.504 2.267 0 C-N-CA 119.31 -0.956 . . . . 0.0 109.193 179.285 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.61 ' O ' HG11 ' A' ' 140' ' ' VAL . 5.5 mt -66.56 -39.1 88.36 Favored 'General case' 0 N--CA 1.504 2.269 0 C-N-CA 119.41 -0.916 . . . . 0.0 109.422 178.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -60.86 -38.54 85.94 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.168 -0.957 . . . . 0.0 109.936 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -59.64 -38.98 82.85 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.163 -0.96 . . . . 0.0 110.203 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -61.54 -46.46 89.85 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.126 -0.984 . . . . 0.0 109.722 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.458 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -62.12 -43.88 97.86 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.209 -0.932 . . . . 0.0 109.651 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.29 -32.65 70.24 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.171 -0.955 . . . . 0.0 110.358 179.533 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 40.4 mttt -80.72 -30.03 36.3 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.988 -1.07 . . . . 0.0 111.136 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 46.5 mttt -99.05 25.04 7.09 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 120.817 -1.177 . . . . 0.0 111.593 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.16 46.97 50.78 Favored Glycine 0 N--CA 1.5 2.951 0 O-C-N 120.702 -1.249 . . . . 0.0 110.82 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.458 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.6 t -149.54 -165.65 2.34 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.114 -1.227 . . . . 0.0 110.604 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -133.64 153.38 51.72 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.179 -0.951 . . . . 0.0 110.396 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.61 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.8 p -133.21 161.57 41.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 121.215 -0.928 . . . . 0.0 110.161 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 34.3 t -167.43 99.1 0.5 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.195 -0.94 . . . . 0.0 111.149 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.962 ' CD1' HD12 ' A' ' 121' ' ' ILE . 81.5 t80 -103.49 160.06 15.05 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.184 -0.947 . . . . 0.0 110.67 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 6.5 m80 -138.23 -60.3 0.62 Allowed 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.834 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -143.97 148.69 35.67 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.446 -0.784 . . . . 0.0 109.184 178.792 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 145' ' ' CYS . . . . . 0.408 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.8 p -90.21 154.35 19.81 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.997 -1.064 . . . . 0.0 111.131 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.7 p -73.01 -24.71 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.457 0 C-N-CA 119.788 -0.765 . . . . 0.0 111.474 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 61.5 m170 -49.9 -60.54 2.82 Favored 'General case' 0 N--CA 1.516 2.871 0 O-C-N 120.933 -1.104 . . . . 0.0 110.047 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.504 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.7 p -126.41 -164.7 1.36 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.313 -0.867 . . . . 0.0 110.291 179.262 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 149' ' ' GLY . . . . . 0.431 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -101.34 65.72 0.49 Allowed Glycine 0 N--CA 1.493 2.481 0 N-CA-C 107.831 -2.108 . . . . 0.0 107.831 178.296 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 31.8 t -103.64 142.78 33.72 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.397 -1.06 . . . . 0.0 109.965 -178.898 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 26.4 mtt-85 -98.55 49.04 0.98 Allowed 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.247 -0.908 . . . . 0.0 109.42 179.002 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 71.56 99.01 0.06 OUTLIER Glycine 0 N--CA 1.486 2.007 0 N-CA-C 109.749 -1.34 . . . . 0.0 109.749 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 p -110.63 126.02 54.04 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.31 -1.112 . . . . 0.0 110.335 179.711 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -146.3 146.42 30.7 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.087 -1.008 . . . . 0.0 110.141 -179.397 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.5 2.04 0 O-C-N 121.171 -0.955 . . . . 0.0 110.506 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.753 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.502 2.158 0 CA-C-O 120.343 0.116 . . . . 0.0 110.704 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -73.97 162.5 38.98 Favored 'Trans proline' 0 C--N 1.318 -1.038 0 O-C-N 123.152 1.08 . . . . 0.0 110.599 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -49.26 -31.68 9.34 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 121.351 -0.843 . . . . 0.0 111.329 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.04 -33.95 45.55 Favored Glycine 0 N--CA 1.498 2.808 0 O-C-N 120.961 -1.087 . . . . 0.0 110.695 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -54.65 -32.92 59.92 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 120.862 -1.375 . . . . 0.0 110.734 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -54.33 -38.16 65.69 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 121.083 -1.011 . . . . 0.0 110.256 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -58.15 -35.07 70.99 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.294 -0.879 . . . . 0.0 110.341 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.649 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.7 pt -117.62 35.71 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.157 -0.965 . . . . 0.0 110.604 179.793 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.427 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -83.36 -43.73 0.84 Allowed Pre-proline 0 N--CA 1.509 2.492 0 O-C-N 121.037 -1.039 . . . . 0.0 113.186 -179.286 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.9 Cg_endo -75.48 -36.9 2.03 Favored 'Trans proline' 0 N--CA 1.486 1.087 0 O-C-N 122.656 0.819 . . . . 0.0 111.666 -178.151 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.805 HG21 ' CE2' ' A' ' 62' ' ' TYR . 69.9 m -61.04 -44.91 96.69 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 121.036 -1.04 . . . . 0.0 109.879 -179.763 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.649 HD12 ' O ' ' A' ' 19' ' ' ILE . 2.5 mt -62.77 -38.31 90.12 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.428 -0.909 . . . . 0.0 109.676 179.461 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.8 m -56.85 -35.04 68.4 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.096 -1.002 . . . . 0.0 110.371 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -56.9 -38.68 73.17 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.054 -1.029 . . . . 0.0 110.001 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.746 ' CD2' HD22 ' A' ' 55' ' ' LEU . 22.3 m-85 -59.05 -40.08 84.02 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.228 -0.92 . . . . 0.0 110.028 179.678 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -61.05 -22.59 64.72 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.266 -0.896 . . . . 0.0 111.501 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.537 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.9 mp -80.84 -36.1 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.465 0 O-C-N 120.836 -1.165 . . . . 0.0 109.571 179.566 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.511 ' HG2' HD11 ' A' ' 55' ' ' LEU . 23.7 tt0 -80.77 -37.11 30.92 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.028 -1.045 . . . . 0.0 108.9 178.378 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.736 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.4 OUTLIER -72.21 -33.51 67.67 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.18 -0.95 . . . . 0.0 110.135 178.896 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.0 ptm180 -70.71 -37.3 73.52 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.884 -1.135 . . . . 0.0 109.791 179.473 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.1 -39.14 92.74 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.04 -1.038 . . . . 0.0 109.54 179.199 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.529 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -66.65 -40.77 88.82 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.218 -0.927 . . . . 0.0 109.516 179.344 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -59.14 -35.77 74.07 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.213 -0.93 . . . . 0.0 110.475 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.9 mttt -94.96 -36.17 11.69 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 121.068 -1.02 . . . . 0.0 110.925 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 . . . . . 0 N--CA 1.51 2.532 0 O-C-N 121.007 -1.058 . . . . 0.0 110.379 179.982 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.502 2.174 0 CA-C-O 120.625 0.25 . . . . 0.0 110.655 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -57.35 -36.54 71.32 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.112 -0.993 . . . . 0.0 110.34 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.423 ' HA ' ' CE3' ' A' ' 50' ' ' TRP . 16.9 mt-10 -58.11 -39.77 79.51 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.137 -0.977 . . . . 0.0 110.201 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 43.4 tp60 -63.22 -43.05 99.21 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.385 -0.926 . . . . 0.0 109.643 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.643 HD23 HD12 ' A' ' 52' ' ' ILE . 12.5 mt -58.76 -37.78 77.02 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.109 -0.995 . . . . 0.0 110.166 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.499 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.8 m0 -59.81 -37.54 79.44 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.17 -0.956 . . . . 0.0 109.955 179.76 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -60.65 -29.77 69.48 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.012 -1.055 . . . . 0.0 109.705 178.331 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.736 HG23 ' CG ' ' A' ' 30' ' ' LEU . 77.2 mt -70.63 -60.42 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.289 0 O-C-N 121.024 -1.048 . . . . 0.0 108.918 179.157 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.6 ptm -61.24 -29.94 70.14 Favored 'General case' 0 N--CA 1.509 2.478 0 C-N-CA 118.691 -1.204 . . . . 0.0 109.778 178.721 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -68.06 -37.6 81.49 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.909 -1.12 . . . . 0.0 109.208 178.264 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.746 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.4 mt -53.22 -33.26 52.1 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.959 -1.088 . . . . 0.0 110.211 179.069 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.459 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 8.2 t60 -55.12 -36.79 66.1 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.057 -1.027 . . . . 0.0 110.178 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.562 ' CD2' HD21 ' A' ' 91' ' ' LEU . 5.8 m170 -59.86 -49.62 77.0 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.086 -1.008 . . . . 0.0 109.365 179.167 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 -61.06 -37.7 83.57 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.324 -0.95 . . . . 0.0 109.17 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.443 ' HD2' ' CD2' ' A' ' 26' ' ' PHE . 6.9 mtp85 -62.23 -49.16 76.83 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.213 -0.929 . . . . 0.0 109.167 178.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 87.5 p -63.34 -39.02 93.39 Favored 'General case' 0 N--CA 1.504 2.233 0 C-N-CA 119.415 -0.914 . . . . 0.0 109.257 179.198 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 33.6 ttp85 -64.67 -40.49 95.51 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.145 -0.972 . . . . 0.0 109.117 178.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.805 ' CE2' HG21 ' A' ' 22' ' ' THR . 38.0 t80 -63.05 -50.88 68.88 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.192 -0.942 . . . . 0.0 109.319 179.295 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.594 HD12 ' HB2' ' A' ' 87' ' ' ALA . 84.0 mt -69.65 -38.16 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.436 0 C-N-CA 119.386 -0.926 . . . . 0.0 109.341 179.27 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.461 ' HD2' HD13 ' A' ' 92' ' ' ILE . 12.4 t80 -66.42 -42.83 87.18 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.103 -0.998 . . . . 0.0 108.989 179.018 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.402 ' HA ' ' CD ' ' A' ' 69' ' ' LYS . 91.2 m -60.83 -40.64 93.55 Favored 'General case' 0 N--CA 1.502 2.173 0 C-N-CA 119.335 -0.946 . . . . 0.0 110.482 -179.625 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.575 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.22 -34.55 25.85 Favored 'General case' 0 N--CA 1.504 2.245 0 C-N-CA 118.796 -1.162 . . . . 0.0 112.54 -178.975 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.537 ' N ' HD12 ' A' ' 66' ' ' LEU . 33.5 t80 -86.52 -32.2 20.87 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 120.622 -1.299 . . . . 0.0 112.184 -179.212 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -98.35 -18.06 18.52 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.774 -1.203 . . . . 0.0 113.152 -178.277 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.402 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 4.6 mtpp -115.85 -57.24 2.25 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 120.46 -1.4 . . . . 0.0 110.993 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.5 mtt85 -76.02 -30.11 58.35 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.173 -0.954 . . . . 0.0 110.761 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.3 tptt 59.96 45.08 12.65 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 120.827 -1.17 . . . . 0.0 109.969 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -107.68 34.97 3.27 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.372 -0.83 . . . . 0.0 109.48 178.784 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.81 HG13 HD23 ' A' ' 77' ' ' LEU . 13.0 tt -151.82 162.68 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.239 -0.913 . . . . 0.0 109.742 -179.683 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 78.3 p -107.23 145.52 32.57 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.088 -1.008 . . . . 0.0 110.02 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -45.36 -32.84 2.23 Favored 'General case' 0 N--CA 1.518 2.932 0 O-C-N 121.328 -0.858 . . . . 0.0 111.455 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -60.94 -48.69 80.66 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 120.93 -1.106 . . . . 0.0 109.32 179.321 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.81 HD23 HG13 ' A' ' 73' ' ' ILE . 47.3 tp -68.26 -44.41 75.68 Favored 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 119.171 -1.011 . . . . 0.0 108.337 178.532 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.43 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 15.3 t80 -59.51 -37.29 77.92 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.389 -0.819 . . . . 0.0 109.557 179.005 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.418 ' O ' HG22 ' A' ' 82' ' ' ILE . 22.9 t70 -76.08 -41.67 49.81 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.125 -0.985 . . . . 0.0 108.842 178.678 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.753 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 82.9 t90 -58.82 -37.96 77.56 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.135 -0.978 . . . . 0.0 109.198 178.692 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.549 HD23 ' CE2' ' A' ' 86' ' ' TYR . 11.9 mt -66.95 -58.04 5.75 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.223 -0.923 . . . . 0.0 108.984 178.821 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.549 HD12 ' HB3' ' A' ' 87' ' ' ALA . 0.6 OUTLIER -56.19 -27.19 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 121.223 -0.923 . . . . 0.0 110.767 -179.976 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.6 ttpm? -89.13 -16.69 30.85 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 120.915 -1.115 . . . . 0.0 111.905 179.711 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.448 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 43.4 mm-40 -105.46 25.63 10.47 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 120.622 -1.299 . . . . 0.0 111.982 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.403 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 0.8 OUTLIER 76.47 68.37 0.06 Allowed 'General case' 0 N--CA 1.512 2.67 0 O-C-N 121.265 -0.897 . . . . 0.0 111.959 179.413 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.608 ' HE2' HD13 ' A' ' 23' ' ' LEU . 27.3 m-85 -131.12 -62.71 0.88 Allowed 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.594 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -134.84 168.4 19.12 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.476 -0.765 . . . . 0.0 109.303 179.281 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.459 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 15.3 t0 -116.09 109.92 18.16 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.093 -1.004 . . . . 0.0 110.555 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.513 ' N ' HD11 ' A' ' 82' ' ' ILE . 17.8 mttt -58.95 -38.04 78.12 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.208 -0.933 . . . . 0.0 109.927 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.64 HD23 HD13 ' A' ' 106' ' ' LEU . 18.0 tp -58.51 -38.22 77.22 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.131 -0.981 . . . . 0.0 110.033 179.799 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.562 HD21 ' CD2' ' A' ' 57' ' ' HIS . 58.4 tp -69.46 -47.23 64.64 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 120.996 -1.065 . . . . 0.0 108.856 179.299 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.461 HD13 ' HD2' ' A' ' 64' ' ' TYR . 72.8 mt -59.65 -39.16 78.85 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.42 0 O-C-N 121.155 -0.966 . . . . 0.0 108.527 178.431 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.17 -39.68 93.24 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.139 -0.976 . . . . 0.0 109.196 178.593 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.428 ' HB3' HD22 ' A' ' 103' ' ' LEU . 6.1 mmtm -56.74 -41.82 78.19 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.069 -1.019 . . . . 0.0 109.578 179.269 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.4 m0 -64.48 -33.65 76.37 Favored 'General case' 0 N--CA 1.507 2.41 0 C-N-CA 119.514 -0.875 . . . . 0.0 110.355 179.514 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -81.81 -34.51 30.23 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.089 -1.007 . . . . 0.0 110.586 179.523 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 25.3 mmtt -50.72 175.11 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.787 0 O-C-N 120.973 -1.079 . . . . 0.0 110.833 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 13.1 t -100.65 141.39 33.59 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.181 -0.949 . . . . 0.0 109.695 179.324 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.72 -24.96 30.09 Favored Glycine 0 N--CA 1.494 2.556 0 C-N-CA 119.888 -1.149 . . . . 0.0 110.523 -179.202 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.624 ' HB3' HD23 ' A' ' 103' ' ' LEU . 65.5 m-85 -91.82 58.11 3.36 Favored 'General case' 0 N--CA 1.503 2.206 0 CA-C-N 119.171 1.486 . . . . 0.0 110.225 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -71.96 -37.19 69.98 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.029 -1.044 . . . . 0.0 110.141 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -124.81 85.38 2.4 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.127 -0.983 . . . . 0.0 110.361 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.624 HD23 ' HB3' ' A' ' 100' ' ' TYR . 0.5 OUTLIER -126.05 150.1 48.38 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.149 -0.97 . . . . 0.0 110.35 179.72 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.476 ' N ' HD12 ' A' ' 103' ' ' LEU . 27.0 p -114.37 -31.35 6.29 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.227 -0.92 . . . . 0.0 113.144 -179.651 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.644 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.0 m -142.59 -167.94 2.63 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.171 -1.581 . . . . 0.0 109.928 179.215 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.64 HD13 HD23 ' A' ' 90' ' ' LEU . 15.3 mt -96.09 -39.56 9.66 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.266 -0.896 . . . . 0.0 109.943 179.035 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 46.7 ttt-85 -101.98 29.68 4.89 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 120.961 -1.087 . . . . 0.0 110.134 178.417 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.644 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.296 1.8 t -126.07 16.63 7.88 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.025 -1.047 . . . . 0.0 108.925 -179.784 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.461 HG23 ' C ' ' A' ' 108' ' ' CYS . 1.5 pt -156.29 34.56 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.17 0 O-C-N 120.791 -1.193 . . . . 0.0 110.776 -178.794 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.716 ' C ' HG23 ' A' ' 119' ' ' THR . 5.8 mt-30 . . . . . 0 N--CA 1.497 1.924 0 O-C-N 120.795 -1.191 . . . . 0.0 111.122 -179.222 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.716 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.2 OUTLIER . . . . . 0 N--CA 1.497 1.902 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 41.6 t -62.56 152.93 33.49 Favored 'General case' 0 N--CA 1.505 2.275 0 C-N-CA 118.962 -1.095 . . . . 0.0 108.985 179.1 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.81 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -75.57 -36.1 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 121.022 -1.049 . . . . 0.0 111.39 -178.803 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.466 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 10.8 p -53.46 -32.34 49.6 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 120.785 -1.197 . . . . 0.0 111.362 -178.687 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.47 HH12 HG21 ' A' ' 119' ' ' THR . 0.0 OUTLIER -59.91 -34.28 73.0 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 120.842 -1.161 . . . . 0.0 109.526 178.316 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.625 HG12 ' HG ' ' A' ' 129' ' ' LEU . 56.1 t -82.34 125.42 76.62 Favored Pre-proline 0 N--CA 1.503 2.22 0 O-C-N 121.053 -1.03 . . . . 0.0 109.647 179.457 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.511 ' HD3' ' HB1' ' A' ' 154' ' ' ALA . 38.7 Cg_endo -65.56 179.85 1.51 Allowed 'Trans proline' 0 N--CA 1.489 1.226 0 O-C-N 123.159 1.084 . . . . 0.0 110.721 179.589 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 2.6 tpp85 -75.18 -35.93 61.52 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.201 -0.937 . . . . 0.0 110.953 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.42 -47.38 86.35 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.023 -1.048 . . . . 0.0 109.797 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -64.62 -41.53 96.13 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.219 -0.926 . . . . 0.0 109.263 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.625 ' HG ' HG12 ' A' ' 124' ' ' VAL . 52.3 mt -62.59 -39.26 93.18 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.285 -0.884 . . . . 0.0 109.672 179.363 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -59.26 -39.62 83.44 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.102 -0.999 . . . . 0.0 110.059 179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -57.98 -36.53 72.74 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.145 -0.972 . . . . 0.0 110.467 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -59.74 -39.55 85.13 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.169 -0.957 . . . . 0.0 110.27 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.653 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -60.89 -44.91 96.47 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.082 -1.011 . . . . 0.0 109.93 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 10.4 mmt85 -59.72 -38.78 82.62 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.142 -0.974 . . . . 0.0 109.886 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 76.1 mttt -58.9 -36.35 74.55 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.147 -0.971 . . . . 0.0 110.554 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 22.6 mtmt -107.37 21.53 17.36 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.002 -1.061 . . . . 0.0 111.797 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.76 46.04 60.18 Favored Glycine 0 N--CA 1.5 2.918 0 O-C-N 120.648 -1.282 . . . . 0.0 110.545 179.313 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.653 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.9 t -140.6 -165.18 1.88 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.105 -1.232 . . . . 0.0 110.154 179.747 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -127.41 173.59 9.69 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.154 -0.966 . . . . 0.0 110.354 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.2 p -159.1 160.71 1.8 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.975 0 O-C-N 121.225 -0.922 . . . . 0.0 110.774 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 28.3 t -168.95 85.18 0.15 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.215 -0.928 . . . . 0.0 110.995 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.775 ' CG ' HD12 ' A' ' 121' ' ' ILE . 50.9 t80 -95.61 160.92 14.27 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.243 -0.911 . . . . 0.0 110.538 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 38.0 m80 -140.49 -60.54 0.51 Allowed 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.007 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -131.78 151.83 51.39 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.404 -0.81 . . . . 0.0 109.095 178.84 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 145' ' ' CYS . . . . . 0.404 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.8 p -95.57 153.65 17.6 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.027 -1.045 . . . . 0.0 110.96 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 27.3 m -71.98 -25.49 23.97 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.461 0 O-C-N 121.432 -0.793 . . . . 0.0 111.595 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 63.1 m170 -50.34 -61.67 2.04 Favored 'General case' 0 N--CA 1.514 2.748 0 O-C-N 120.888 -1.133 . . . . 0.0 110.336 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.499 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.3 p -124.56 -164.46 1.27 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.183 -0.948 . . . . 0.0 110.544 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.0 60.45 0.72 Allowed Glycine 0 N--CA 1.492 2.431 0 N-CA-C 108.13 -1.988 . . . . 0.0 108.13 178.658 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 28.4 t -102.26 142.44 33.48 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.333 -1.098 . . . . 0.0 109.818 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 6.2 mtt85 -99.04 49.04 0.96 Allowed 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.272 -0.892 . . . . 0.0 109.613 179.31 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 73.15 96.55 0.08 OUTLIER Glycine 0 N--CA 1.488 2.163 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.0 p -108.68 126.22 52.74 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.205 -1.174 . . . . 0.0 110.32 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 154' ' ' ALA . . . . . 0.511 ' HB1' ' HD3' ' A' ' 125' ' ' PRO . . . -152.77 148.93 27.81 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.098 -1.001 . . . . 0.0 110.467 -179.402 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 3.5 m . . . . . 0 N--CA 1.503 2.217 0 O-C-N 121.328 -0.857 . . . . 0.0 110.572 -179.976 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.843 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.512 2.631 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -84.36 82.68 1.8 Allowed 'Trans proline' 0 C--N 1.32 -0.922 0 O-C-N 123.129 1.068 . . . . 0.0 112.422 -178.216 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 48.73 92.67 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.258 -0.901 . . . . 0.0 111.737 178.314 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.73 -39.05 0.51 Allowed Glycine 0 N--CA 1.499 2.886 0 C-N-CA 119.792 -1.194 . . . . 0.0 110.538 179.407 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.605 ' N ' HD21 ' A' ' 77' ' ' LEU . 19.2 t80 -57.03 -29.74 63.63 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.063 -1.257 . . . . 0.0 110.462 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -52.86 -34.53 54.84 Favored 'General case' 0 N--CA 1.511 2.608 0 O-C-N 120.889 -1.132 . . . . 0.0 110.156 179.259 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.1 mtpp -58.73 -38.61 78.75 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.181 -0.949 . . . . 0.0 110.144 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.57 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.8 pt -116.74 36.58 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.17 -0.956 . . . . 0.0 110.43 179.765 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.423 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -84.08 -43.24 0.76 Allowed Pre-proline 0 N--CA 1.511 2.579 0 O-C-N 121.056 -1.028 . . . . 0.0 113.531 -178.804 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.2 Cg_endo -74.27 -34.55 4.66 Favored 'Trans proline' 0 N--CA 1.487 1.09 0 O-C-N 122.587 0.783 . . . . 0.0 112.043 -177.863 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.783 HG21 ' CE2' ' A' ' 62' ' ' TYR . 84.1 m -60.91 -43.56 98.4 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 120.973 -1.08 . . . . 0.0 110.071 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.57 HD12 ' O ' ' A' ' 19' ' ' ILE . 0.4 OUTLIER -63.46 -39.11 93.59 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.224 -0.923 . . . . 0.0 109.792 179.67 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -57.42 -35.04 69.55 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.102 -0.999 . . . . 0.0 110.29 179.538 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -57.31 -35.94 70.47 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.038 -1.039 . . . . 0.0 110.311 179.63 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.668 ' CD2' HD22 ' A' ' 55' ' ' LEU . 16.1 m-85 -57.67 -39.35 76.89 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.094 -1.003 . . . . 0.0 110.48 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -58.66 -39.69 81.36 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.223 -0.923 . . . . 0.0 110.487 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.42 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.1 mp -65.72 -41.1 89.68 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 C-N-CA 119.221 -0.992 . . . . 0.0 108.83 179.61 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -70.49 -49.59 46.81 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.198 -1.001 . . . . 0.0 108.619 178.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.048 HD11 HG23 ' A' ' 52' ' ' ILE . 0.9 OUTLIER -59.84 -34.46 73.13 Favored 'General case' 0 N--CA 1.507 2.42 0 C-N-CA 119.376 -0.929 . . . . 0.0 109.558 178.508 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 3.7 mtt85 -56.91 -39.63 74.78 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.041 -1.037 . . . . 0.0 110.071 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.48 -47.86 77.37 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.206 -0.997 . . . . 0.0 109.754 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.437 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -69.6 -37.93 77.08 Favored 'General case' 0 N--CA 1.504 2.265 0 C-N-CA 119.225 -0.99 . . . . 0.0 109.512 179.121 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 13.5 mt-30 -66.63 -32.73 74.25 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.222 -0.924 . . . . 0.0 110.277 179.532 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.1 mttp -95.05 -35.03 12.09 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 120.962 -1.086 . . . . 0.0 110.921 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 11.7 t70 . . . . . 0 N--CA 1.511 2.587 0 O-C-N 120.988 -1.07 . . . . 0.0 110.261 -179.934 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.502 2.151 0 CA-C-O 120.598 0.237 . . . . 0.0 110.488 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -58.63 -39.67 81.16 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.109 -0.994 . . . . 0.0 110.048 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -62.73 -42.5 99.69 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.266 -0.896 . . . . 0.0 109.829 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 58.1 tp60 -60.42 -39.26 86.78 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.168 -0.957 . . . . 0.0 109.872 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -57.85 -38.43 75.65 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.122 -0.986 . . . . 0.0 110.062 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.499 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.1 m0 -58.01 -36.12 72.24 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.157 -0.964 . . . . 0.0 109.989 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -61.95 -29.28 70.13 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.064 -1.022 . . . . 0.0 109.79 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 1.048 HG23 HD11 ' A' ' 30' ' ' LEU . 22.1 mt -72.26 -59.28 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.201 0 O-C-N 120.942 -1.099 . . . . 0.0 109.181 179.429 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.6 ptm -58.85 -27.89 65.56 Favored 'General case' 0 N--CA 1.511 2.6 0 C-N-CA 118.45 -1.3 . . . . 0.0 109.827 178.74 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.5 mm100 -69.86 -37.66 76.18 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 120.823 -1.173 . . . . 0.0 109.05 177.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.668 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.2 mt -53.36 -32.61 50.09 Favored 'General case' 0 N--CA 1.512 2.65 0 O-C-N 120.951 -1.093 . . . . 0.0 110.128 179.007 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.439 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 23.0 t60 -55.83 -36.82 67.9 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.145 -0.972 . . . . 0.0 110.198 179.73 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.424 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 7.4 m170 -59.64 -48.9 79.86 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.095 -1.003 . . . . 0.0 109.387 179.237 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.2 tp60 -58.37 -34.19 70.42 Favored 'General case' 0 N--CA 1.508 2.435 0 C-N-CA 119.461 -0.896 . . . . 0.0 109.573 178.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.467 ' HD3' ' CD1' ' A' ' 26' ' ' PHE . 38.8 mmm-85 -64.77 -52.87 54.64 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.031 -1.043 . . . . 0.0 109.28 179.066 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 84.5 p -64.02 -40.04 95.44 Favored 'General case' 0 N--CA 1.503 2.187 0 C-N-CA 119.3 -0.96 . . . . 0.0 108.997 179.203 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.423 ' HD3' ' OG1' ' A' ' 65' ' ' THR . 0.1 OUTLIER -63.11 -40.17 96.84 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.197 -0.939 . . . . 0.0 109.051 178.856 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.783 ' CE2' HG21 ' A' ' 22' ' ' THR . 30.5 t80 -63.58 -53.33 53.33 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.098 -1.001 . . . . 0.0 109.009 179.212 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.903 HD12 ' HB2' ' A' ' 87' ' ' ALA . 75.8 mt -65.64 -37.18 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.333 0 C-N-CA 119.223 -0.991 . . . . 0.0 109.19 179.307 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.438 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 8.1 t80 -66.03 -41.55 90.77 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.059 -1.026 . . . . 0.0 108.778 178.704 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.423 ' OG1' ' HD3' ' A' ' 61' ' ' ARG . 91.7 m -59.28 -41.44 88.92 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.211 -0.931 . . . . 0.0 110.806 -179.453 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.633 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.06 -34.9 26.1 Favored 'General case' 0 N--CA 1.505 2.282 0 C-N-CA 118.764 -1.174 . . . . 0.0 112.823 -178.523 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.56 ' N ' HD12 ' A' ' 66' ' ' LEU . 52.0 t80 -86.27 -32.02 21.32 Favored 'General case' 0 N--CA 1.514 2.751 0 O-C-N 120.564 -1.335 . . . . 0.0 111.961 -179.345 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.438 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 11.8 m-85 -97.05 -16.82 20.36 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 120.729 -1.232 . . . . 0.0 112.584 -178.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.419 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 5.8 mttt -124.74 -59.6 1.43 Allowed 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.495 -1.378 . . . . 0.0 110.996 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.406 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 5.2 ttt85 -59.94 -30.38 69.03 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.03 -1.044 . . . . 0.0 110.906 -179.387 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 27.2 tptt 57.1 41.2 27.69 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.803 -1.185 . . . . 0.0 110.131 -179.442 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.06 37.47 3.66 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.399 -0.813 . . . . 0.0 109.725 179.375 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.633 HG21 ' CD1' ' A' ' 66' ' ' LEU . 13.7 tt -154.23 162.77 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 121.249 -0.907 . . . . 0.0 109.904 -179.73 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 4.9 p -110.08 149.7 29.65 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.092 -1.005 . . . . 0.0 110.354 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 71.5 tttt -45.79 -32.35 2.5 Favored 'General case' 0 N--CA 1.515 2.799 0 O-C-N 121.338 -0.851 . . . . 0.0 111.596 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -65.49 -47.02 77.48 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 120.846 -1.159 . . . . 0.0 109.51 179.517 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.605 HD21 ' N ' ' A' ' 16' ' ' PHE . 0.3 OUTLIER -67.48 -41.61 84.27 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.183 -0.948 . . . . 0.0 108.727 179.02 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.453 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 14.6 t80 -67.85 -41.07 83.51 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.265 -0.897 . . . . 0.0 109.188 179.135 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -72.11 -40.7 67.98 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.19 -0.944 . . . . 0.0 108.795 178.736 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.843 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 80.5 t90 -55.11 -37.92 67.49 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.265 -0.897 . . . . 0.0 109.532 178.904 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.545 HD22 ' CD2' ' A' ' 86' ' ' TYR . 17.1 mt -69.69 -48.84 58.27 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 119.344 -0.942 . . . . 0.0 108.561 178.791 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.558 HD12 ' HG3' ' A' ' 89' ' ' LYS . 35.4 mm -57.4 -32.72 42.1 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.573 0 O-C-N 121.281 -0.887 . . . . 0.0 109.904 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.8 tttt -86.87 -23.9 25.09 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.952 -1.092 . . . . 0.0 111.589 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.428 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 16.7 mm-40 -97.39 19.4 13.31 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 120.707 -1.246 . . . . 0.0 111.948 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 28.2 tttt 73.38 80.53 0.13 Allowed 'General case' 0 N--CA 1.51 2.565 0 O-C-N 120.914 -1.116 . . . . 0.0 111.327 179.268 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.545 ' CD2' HD22 ' A' ' 81' ' ' LEU . 29.3 m-85 -137.24 -64.03 0.58 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.546 -0.722 . . . . 0.0 109.932 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.903 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -118.31 -172.55 2.29 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.419 -0.8 . . . . 0.0 109.593 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.439 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 7.1 t0 -122.56 102.77 8.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.058 -1.026 . . . . 0.0 110.373 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.558 ' HG3' HD12 ' A' ' 82' ' ' ILE . 12.0 mtpt -64.35 -40.19 95.38 Favored 'General case' 0 N--CA 1.508 2.429 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.63 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.574 HD23 HD13 ' A' ' 106' ' ' LEU . 32.4 tp -59.78 -37.21 78.44 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.23 -0.918 . . . . 0.0 110.056 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.564 HD21 ' CH2' ' A' ' 95' ' ' TRP . 34.3 tp -71.73 -48.16 48.86 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.005 -1.059 . . . . 0.0 108.756 179.142 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.485 HG22 ' HD2' ' A' ' 96' ' ' ARG . 50.7 mt -58.86 -36.19 60.01 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 C-N-CA 119.378 -0.929 . . . . 0.0 108.7 178.293 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.94 -39.48 83.44 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.128 -0.983 . . . . 0.0 109.062 178.435 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.427 ' HB3' ' CD2' ' A' ' 103' ' ' LEU . 7.1 mmtt -58.49 -44.35 89.34 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.139 -0.975 . . . . 0.0 109.364 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.564 ' CH2' HD21 ' A' ' 91' ' ' LEU . 7.8 m0 -65.72 -41.19 92.58 Favored 'General case' 0 N--CA 1.507 2.406 0 C-N-CA 119.557 -0.857 . . . . 0.0 109.506 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.485 ' HD2' HG22 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -65.71 -33.29 75.53 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.283 -0.885 . . . . 0.0 110.425 179.479 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.1 mmtp -54.31 -176.78 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.646 0 O-C-N 121.056 -1.028 . . . . 0.0 110.535 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 32.1 m -105.87 132.75 51.61 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.172 -0.955 . . . . 0.0 109.85 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 98.57 10.92 49.23 Favored Glycine 0 N--CA 1.492 2.427 0 C-N-CA 120.213 -0.994 . . . . 0.0 111.087 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -115.97 69.51 0.74 Allowed 'General case' 0 N--CA 1.495 1.778 0 CA-C-N 119.487 1.644 . . . . 0.0 110.117 179.75 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -92.08 -38.95 11.89 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.221 -0.924 . . . . 0.0 109.96 179.59 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -110.15 78.5 1.13 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.151 -0.968 . . . . 0.0 109.61 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.937 HD13 HD13 ' A' ' 109' ' ' ILE . 8.9 tp -122.23 137.87 54.69 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.242 -0.911 . . . . 0.0 109.823 -179.24 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.424 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 28.1 p -111.61 -38.6 4.86 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.234 -0.916 . . . . 0.0 112.483 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.821 ' O ' HD11 ' A' ' 103' ' ' LEU . 6.9 m -138.76 -168.49 2.42 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.17 -1.581 . . . . 0.0 109.85 179.077 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.574 HD13 HD23 ' A' ' 90' ' ' LEU . 13.9 mt -97.48 -38.15 9.7 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.177 -0.952 . . . . 0.0 110.295 179.189 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -102.2 31.34 4.02 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 120.953 -1.092 . . . . 0.0 109.804 178.221 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.676 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.7 t -125.86 16.28 8.01 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.131 -0.981 . . . . 0.0 108.929 -179.592 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.937 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -159.01 38.01 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.38 0 O-C-N 120.922 -1.111 . . . . 0.0 110.4 -178.854 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.575 ' O ' HG23 ' A' ' 119' ' ' THR . 2.0 tt0 . . . . . 0 N--CA 1.499 2.006 0 O-C-N 120.739 -1.226 . . . . 0.0 111.698 -178.273 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.575 HG23 ' O ' ' A' ' 110' ' ' GLN . 4.4 m . . . . . 0 N--CA 1.495 1.779 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 48.6 t -87.17 154.15 20.95 Favored 'General case' 0 N--CA 1.499 2.017 0 C-N-CA 119.499 -0.88 . . . . 0.0 109.202 179.053 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.804 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -72.64 -36.11 52.46 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.433 0 O-C-N 121.16 -0.962 . . . . 0.0 111.012 -179.225 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 7.9 p -55.46 -34.32 64.42 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 120.846 -1.158 . . . . 0.0 110.911 -178.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.481 ' HG3' HG22 ' A' ' 109' ' ' ILE . 16.8 ttt-85 -59.32 -36.43 75.62 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 120.995 -1.066 . . . . 0.0 109.681 178.435 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 61.0 t -76.19 125.42 87.87 Favored Pre-proline 0 N--CA 1.504 2.24 0 O-C-N 121.171 -0.956 . . . . 0.0 109.795 179.773 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.495 ' O ' HD12 ' A' ' 129' ' ' LEU . 37.5 Cg_endo -64.02 178.2 1.59 Allowed 'Trans proline' 0 N--CA 1.49 1.283 0 O-C-N 123.228 1.12 . . . . 0.0 110.791 179.521 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.09 -37.27 61.61 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.22 -0.925 . . . . 0.0 110.635 -179.582 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.41 -41.64 85.4 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.013 -1.054 . . . . 0.0 109.929 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 37.3 tp60 -68.8 -41.44 78.69 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 119.395 -0.922 . . . . 0.0 109.103 179.222 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.62 HD11 HD11 ' A' ' 121' ' ' ILE . 3.9 mt -62.54 -38.69 90.99 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.288 -0.883 . . . . 0.0 109.757 179.306 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -60.2 -39.83 87.97 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.193 -0.942 . . . . 0.0 109.971 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -58.08 -35.88 72.03 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.151 -0.968 . . . . 0.0 110.475 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -59.98 -40.99 91.03 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.152 -0.968 . . . . 0.0 110.164 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.705 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -61.72 -45.02 95.76 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.144 -0.972 . . . . 0.0 109.798 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 15.2 mtp85 -58.69 -38.7 78.82 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.208 -0.932 . . . . 0.0 109.929 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -58.01 -36.38 72.59 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.17 -0.956 . . . . 0.0 110.486 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 2.6 mtpm? -107.82 21.08 17.94 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.008 -1.057 . . . . 0.0 111.806 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 53.88 45.87 69.62 Favored Glycine 0 N--CA 1.499 2.85 0 O-C-N 120.572 -1.33 . . . . 0.0 110.467 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.705 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.7 t -141.68 -164.36 1.76 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.217 -1.167 . . . . 0.0 110.145 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -130.46 155.1 47.01 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.12 -0.988 . . . . 0.0 110.237 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.512 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.4 p -131.51 161.52 41.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.213 -0.929 . . . . 0.0 110.148 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 31.2 t -165.53 86.01 0.37 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.24 -0.913 . . . . 0.0 111.087 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.764 ' CG ' HD12 ' A' ' 121' ' ' ILE . 52.0 t80 -97.26 159.57 14.84 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.216 -0.927 . . . . 0.0 110.382 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 22.5 m80 -138.08 -61.13 0.62 Allowed 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 179.107 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -133.73 151.01 51.5 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.418 -0.801 . . . . 0.0 108.93 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 145' ' ' CYS . . . . . 0.402 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.6 p -91.98 152.53 19.97 Favored 'General case' 0 N--CA 1.505 2.285 0 C-N-CA 119.063 -1.055 . . . . 0.0 111.142 -179.581 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 23.2 m -69.71 -26.46 30.69 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.449 0 C-N-CA 119.748 -0.781 . . . . 0.0 111.347 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 63.4 m170 -50.91 -60.18 3.35 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 120.84 -1.163 . . . . 0.0 110.142 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.499 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 25.7 p -126.82 -167.41 1.72 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.3 -0.875 . . . . 0.0 110.797 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 149' ' ' GLY . . . . . 0.404 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -98.98 58.17 0.89 Allowed Glycine 0 N--CA 1.491 2.346 0 N-CA-C 108.04 -2.024 . . . . 0.0 108.04 178.629 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 16.8 t -99.67 145.97 27.01 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.442 -1.034 . . . . 0.0 109.755 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 4.9 ttm-85 -97.83 50.79 1.04 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.226 -0.922 . . . . 0.0 109.318 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.31 97.33 0.03 OUTLIER Glycine 0 N--CA 1.486 2.019 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.1 p -109.09 128.23 54.81 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.293 -1.122 . . . . 0.0 110.327 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -143.02 130.23 20.87 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.069 -1.02 . . . . 0.0 110.099 -179.63 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.502 2.151 0 O-C-N 121.17 -0.957 . . . . 0.0 110.606 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.676 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.504 2.269 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -71.95 166.41 29.65 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 O-C-N 123.308 1.162 . . . . 0.0 110.835 -179.667 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -47.97 -31.93 5.87 Favored 'General case' 0 N--CA 1.515 2.825 0 O-C-N 121.507 -0.745 . . . . 0.0 111.529 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.49 -34.46 34.74 Favored Glycine 0 N--CA 1.5 2.931 0 O-C-N 120.96 -1.087 . . . . 0.0 110.585 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.405 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 26.0 t80 -55.56 -33.27 63.72 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 120.938 -1.33 . . . . 0.0 110.555 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -54.32 -37.8 65.26 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.046 -1.034 . . . . 0.0 110.167 179.736 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.5 mtpt -57.4 -36.56 71.44 Favored 'General case' 0 N--CA 1.511 2.585 0 O-C-N 121.298 -0.877 . . . . 0.0 110.117 179.467 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.743 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.8 pt -118.69 35.28 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.2 -0.937 . . . . 0.0 110.388 179.453 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -83.73 -43.37 0.8 Allowed Pre-proline 0 N--CA 1.508 2.457 0 O-C-N 120.976 -1.077 . . . . 0.0 113.105 -179.087 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.8 Cg_endo -76.27 -36.4 1.85 Allowed 'Trans proline' 0 N--CA 1.487 1.113 0 O-C-N 122.583 0.78 . . . . 0.0 111.506 -178.464 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.825 HG21 ' CE2' ' A' ' 62' ' ' TYR . 78.5 m -59.8 -42.92 94.5 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.02 -1.05 . . . . 0.0 110.092 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.743 HD12 ' O ' ' A' ' 19' ' ' ILE . 2.7 mt -64.37 -39.84 94.66 Favored 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.672 179.601 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -57.97 -35.27 70.93 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.107 -0.996 . . . . 0.0 110.228 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -56.22 -34.52 66.4 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.127 -0.983 . . . . 0.0 110.528 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.669 ' CD1' HD22 ' A' ' 55' ' ' LEU . 13.9 m-85 -58.52 -40.35 82.65 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.037 -1.04 . . . . 0.0 110.642 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -60.41 -39.93 89.16 Favored 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.653 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.425 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.2 mp -66.08 -39.96 85.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.381 0 C-N-CA 119.195 -1.002 . . . . 0.0 109.126 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -70.34 -49.15 52.32 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.081 -1.012 . . . . 0.0 108.689 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.665 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -62.91 -32.94 74.33 Favored 'General case' 0 N--CA 1.508 2.433 0 C-N-CA 119.229 -0.988 . . . . 0.0 108.926 178.186 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 23.1 mtt180 -56.9 -40.31 76.04 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.009 -1.057 . . . . 0.0 110.018 179.387 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -62.9 -51.09 68.32 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.252 -0.979 . . . . 0.0 109.417 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.585 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -65.75 -40.35 92.0 Favored 'General case' 0 N--CA 1.504 2.263 0 C-N-CA 119.227 -0.989 . . . . 0.0 109.11 179.038 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.439 ' CG ' HD23 ' A' ' 30' ' ' LEU . 5.4 mm100 -62.74 -38.59 91.13 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.178 -0.951 . . . . 0.0 109.641 179.398 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.0 mmtm -60.5 -39.26 87.1 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.134 -0.979 . . . . 0.0 110.02 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 . . . . . 0 N--CA 1.51 2.534 0 O-C-N 121.142 -0.973 . . . . 0.0 110.114 179.867 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.9 p . . . . . 0 N--CA 1.498 1.961 0 CA-C-O 120.629 0.252 . . . . 0.0 110.553 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -55.91 -37.97 69.62 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.163 -0.96 . . . . 0.0 110.142 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -61.01 -40.96 95.55 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.17 -0.957 . . . . 0.0 109.823 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -62.64 -40.23 96.37 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.195 -0.941 . . . . 0.0 109.82 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.477 HD23 HD12 ' A' ' 52' ' ' ILE . 12.5 mt -59.46 -38.03 79.69 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.203 -0.935 . . . . 0.0 110.26 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.492 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.5 m0 -58.36 -36.67 73.81 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.038 -1.039 . . . . 0.0 110.127 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -62.33 -30.34 71.09 Favored 'General case' 0 N--CA 1.506 2.327 0 C-N-CA 119.204 -0.998 . . . . 0.0 109.983 178.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.665 HG23 ' CG ' ' A' ' 30' ' ' LEU . 69.6 mt -71.91 -57.09 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.269 0 O-C-N 120.913 -1.117 . . . . 0.0 109.466 179.526 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.5 ptm -61.13 -29.48 69.8 Favored 'General case' 0 N--CA 1.509 2.49 0 C-N-CA 118.414 -1.314 . . . . 0.0 109.704 178.674 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -67.82 -37.42 81.93 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.841 -1.162 . . . . 0.0 109.09 178.085 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.669 HD22 ' CD1' ' A' ' 26' ' ' PHE . 11.0 mt -53.15 -31.87 44.72 Favored 'General case' 0 N--CA 1.512 2.636 0 O-C-N 120.965 -1.084 . . . . 0.0 110.169 178.952 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.466 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 70.6 t60 -54.79 -39.3 68.29 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.038 -1.038 . . . . 0.0 109.828 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.51 ' CD2' HD21 ' A' ' 91' ' ' LEU . 5.7 m170 -59.49 -46.61 88.31 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.158 -0.964 . . . . 0.0 109.404 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.9 tp-100 -59.44 -34.93 73.11 Favored 'General case' 0 N--CA 1.506 2.349 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.489 178.846 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.446 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 8.2 mmm-85 -65.39 -53.33 44.86 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.041 -1.037 . . . . 0.0 109.194 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 12.3 p -61.65 -38.58 88.23 Favored 'General case' 0 N--CA 1.505 2.277 0 C-N-CA 119.3 -0.96 . . . . 0.0 109.357 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.426 ' O ' ' OG1' ' A' ' 65' ' ' THR . 6.3 ttt85 -65.1 -41.37 95.02 Favored 'General case' 0 N--CA 1.504 2.259 0 C-N-CA 119.216 -0.993 . . . . 0.0 109.221 179.064 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.825 ' CE2' HG21 ' A' ' 22' ' ' THR . 40.1 t80 -62.62 -49.54 74.8 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.17 -0.956 . . . . 0.0 109.547 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.751 HD12 ' HB2' ' A' ' 87' ' ' ALA . 85.4 mt -71.85 -38.85 66.62 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.327 0 O-C-N 121.204 -0.935 . . . . 0.0 109.448 179.564 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.405 ' HD2' HD13 ' A' ' 92' ' ' ILE . 9.4 t80 -66.03 -42.25 89.86 Favored 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.107 -0.996 . . . . 0.0 108.832 178.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.426 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 91.6 m -60.97 -42.17 97.78 Favored 'General case' 0 N--CA 1.504 2.239 0 C-N-CA 119.253 -0.979 . . . . 0.0 110.171 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.567 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.1 -33.11 26.42 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.962 -1.086 . . . . 0.0 112.474 -178.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.495 ' N ' HD12 ' A' ' 66' ' ' LEU . 36.3 t80 -86.33 -32.86 20.78 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 120.554 -1.341 . . . . 0.0 111.896 -179.158 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -97.54 -21.1 17.29 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 120.878 -1.138 . . . . 0.0 112.527 -178.744 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.414 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 6.9 mtpt -118.3 -59.65 1.87 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 120.56 -1.337 . . . . 0.0 110.808 179.778 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.415 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 11.3 ttt85 -62.16 -29.7 70.54 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.129 -0.982 . . . . 0.0 110.865 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.2 mtpt 56.27 42.32 28.06 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.938 -1.102 . . . . 0.0 110.171 -179.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.51 35.6 3.95 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.444 -0.785 . . . . 0.0 110.0 179.368 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.776 HG13 HD23 ' A' ' 77' ' ' LEU . 14.1 tt -153.87 162.27 2.14 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.202 -0.936 . . . . 0.0 109.974 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 50.4 m -110.0 148.29 31.94 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.181 -0.95 . . . . 0.0 110.136 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.2 tttm -46.77 -31.72 3.18 Favored 'General case' 0 N--CA 1.515 2.781 0 O-C-N 121.302 -0.874 . . . . 0.0 111.55 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -62.88 -52.01 64.74 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 120.836 -1.165 . . . . 0.0 109.261 179.57 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.776 HD23 HG13 ' A' ' 73' ' ' ILE . 22.4 tp -64.76 -45.68 85.36 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 119.232 -0.987 . . . . 0.0 108.469 178.834 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.759 ' HA ' HD12 ' A' ' 81' ' ' LEU . 11.8 t80 -59.3 -40.84 87.47 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.337 -0.852 . . . . 0.0 109.424 179.177 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -71.65 -43.14 66.61 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.178 -0.951 . . . . 0.0 108.506 178.718 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.676 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 88.7 t90 -57.0 -34.68 68.38 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.229 -0.92 . . . . 0.0 109.353 178.436 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.759 HD12 ' HA ' ' A' ' 78' ' ' TYR . 11.3 mt -67.11 -59.89 3.08 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.115 -0.991 . . . . 0.0 108.889 179.012 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.423 HG13 ' HB3' ' A' ' 87' ' ' ALA . 5.4 mt -57.97 -26.51 28.86 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.555 0 O-C-N 120.941 -1.1 . . . . 0.0 110.035 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.9 tttp -80.03 -19.07 48.53 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 120.869 -1.144 . . . . 0.0 110.853 178.323 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.442 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 8.3 mm-40 -108.47 23.11 14.99 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 120.752 -1.217 . . . . 0.0 111.984 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.415 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 1.5 tmtt? 76.83 69.82 0.06 Allowed 'General case' 0 N--CA 1.515 2.794 0 O-C-N 121.148 -0.97 . . . . 0.0 111.882 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.678 ' HE2' HD13 ' A' ' 23' ' ' LEU . 21.8 m-85 -130.95 -62.34 0.9 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.488 -0.758 . . . . 0.0 109.215 179.354 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.751 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -127.75 166.99 17.11 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.458 -0.776 . . . . 0.0 109.812 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.466 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 19.1 t0 -115.41 109.45 17.89 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.231 -0.918 . . . . 0.0 110.156 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.44 -38.09 73.87 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.216 -0.927 . . . . 0.0 110.171 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.46 HD23 HD22 ' A' ' 106' ' ' LEU . 11.2 tp -59.52 -38.77 81.85 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.178 -0.951 . . . . 0.0 110.179 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.51 HD21 ' CD2' ' A' ' 57' ' ' HIS . 55.6 tp -68.32 -50.02 56.3 Favored 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 119.17 -1.012 . . . . 0.0 109.164 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.405 HD13 ' HD2' ' A' ' 64' ' ' TYR . 68.9 mt -60.94 -37.57 77.32 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 C-N-CA 119.117 -1.033 . . . . 0.0 108.817 178.645 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.81 -38.67 86.92 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.082 -1.011 . . . . 0.0 109.086 178.437 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.484 ' HB3' HD22 ' A' ' 103' ' ' LEU . 9.7 mmtm -58.3 -44.85 88.74 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.105 -0.997 . . . . 0.0 109.565 179.345 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 3.2 m0 -60.68 -35.86 77.31 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.317 -0.865 . . . . 0.0 110.053 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.83 -32.79 40.64 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.105 -0.997 . . . . 0.0 110.491 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 10.3 mmtp -51.66 177.93 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.728 0 O-C-N 120.952 -1.092 . . . . 0.0 110.841 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 3.5 m -105.4 141.77 36.33 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.22 -0.925 . . . . 0.0 109.39 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 103.68 -29.15 12.78 Favored Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.896 -1.282 . . . . 0.0 109.896 -179.046 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.603 ' HB3' HD23 ' A' ' 103' ' ' LEU . 55.9 m-85 -92.98 57.76 2.84 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 120.906 -1.349 . . . . 0.0 109.986 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.425 ' HB2' ' OG ' ' A' ' 155' ' ' SER . 5.4 mt-10 -63.02 -37.73 88.34 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 120.972 -1.08 . . . . 0.0 110.287 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -131.91 83.25 2.07 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.071 -1.018 . . . . 0.0 110.636 -179.781 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.603 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.2 pp -114.49 147.51 39.23 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.243 -0.911 . . . . 0.0 109.951 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.428 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.4 p -109.22 -27.63 9.45 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.215 -0.928 . . . . 0.0 113.003 -179.383 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.654 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 11.5 m -143.73 -167.72 2.66 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.202 -1.562 . . . . 0.0 109.789 179.107 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.46 HD22 HD23 ' A' ' 90' ' ' LEU . 13.2 mt -95.97 -38.54 10.19 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.149 -0.97 . . . . 0.0 110.098 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 22.6 ttt180 -103.37 31.73 4.18 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 120.972 -1.08 . . . . 0.0 109.876 178.31 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.654 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.7 t -128.38 19.44 6.32 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.266 -0.897 . . . . 0.0 108.733 -179.632 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.497 HG22 ' HG3' ' A' ' 123' ' ' ARG . 1.4 pt -158.34 39.01 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.345 0 O-C-N 120.974 -1.079 . . . . 0.0 110.064 -178.783 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.795 ' C ' HG23 ' A' ' 119' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.506 2.335 0 O-C-N 120.95 -1.094 . . . . 0.0 111.004 -178.633 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.795 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.9 OUTLIER . . . . . 0 N--CA 1.497 1.877 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.432 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 49.9 t -82.19 153.9 25.73 Favored 'General case' 0 N--CA 1.499 2.005 0 C-N-CA 119.213 -0.995 . . . . 0.0 108.705 178.596 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.964 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -75.52 -30.62 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.52 0 O-C-N 121.053 -1.03 . . . . 0.0 111.759 -178.702 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.495 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 14.2 p -58.94 -35.41 73.07 Favored 'General case' 0 N--CA 1.511 2.61 0 O-C-N 120.692 -1.255 . . . . 0.0 110.869 -179.037 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.497 ' HG3' HG22 ' A' ' 109' ' ' ILE . 0.0 OUTLIER -57.12 -30.41 64.37 Favored 'General case' 0 N--CA 1.51 2.557 0 O-C-N 120.917 -1.114 . . . . 0.0 110.261 179.034 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.4 t -83.06 124.35 76.59 Favored Pre-proline 0 N--CA 1.505 2.298 0 O-C-N 121.061 -1.024 . . . . 0.0 110.147 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -66.17 174.8 5.51 Favored 'Trans proline' 0 N--CA 1.49 1.27 0 O-C-N 123.138 1.072 . . . . 0.0 110.774 179.462 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 31.1 mmm-85 -75.08 -37.0 61.7 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.216 -0.927 . . . . 0.0 110.57 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.36 -40.65 78.56 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 120.996 -1.065 . . . . 0.0 110.044 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 38.6 tp60 -69.35 -41.98 75.87 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.338 -0.945 . . . . 0.0 109.128 179.296 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.654 HD11 HD11 ' A' ' 121' ' ' ILE . 8.0 mt -65.23 -39.47 92.77 Favored 'General case' 0 N--CA 1.505 2.304 0 C-N-CA 119.461 -0.895 . . . . 0.0 109.407 179.044 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -59.84 -39.0 83.67 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.17 -0.956 . . . . 0.0 109.994 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -59.78 -40.07 87.01 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.127 -0.983 . . . . 0.0 110.054 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -61.62 -44.29 97.27 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.189 -0.944 . . . . 0.0 109.819 179.79 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.453 ' HB1' ' HA ' ' A' ' 139' ' ' GLN . . . -60.94 -41.41 96.21 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.209 -0.932 . . . . 0.0 109.953 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 18.3 ttt-85 -63.44 -33.13 74.88 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.111 -0.993 . . . . 0.0 110.492 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 24.5 mtmt -79.95 -30.85 39.95 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.014 -1.054 . . . . 0.0 111.197 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.37 23.51 8.35 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 120.836 -1.165 . . . . 0.0 111.739 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.89 46.6 49.17 Favored Glycine 0 N--CA 1.5 2.923 0 O-C-N 120.645 -1.284 . . . . 0.0 110.882 179.232 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.43 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 9.3 t -147.8 -164.01 1.91 Allowed 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.136 -1.214 . . . . 0.0 110.383 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 139' ' ' GLN . . . . . 0.453 ' HA ' ' HB1' ' A' ' 133' ' ' ALA . 27.5 mt-30 -136.25 151.42 49.64 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.135 -0.978 . . . . 0.0 110.224 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.584 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.8 p -132.12 161.07 41.99 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.123 -0.985 . . . . 0.0 110.222 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 34.7 t -168.33 92.99 0.34 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.249 -0.907 . . . . 0.0 111.001 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.964 ' CD1' HD12 ' A' ' 121' ' ' ILE . 78.3 t80 -100.53 159.97 14.73 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.161 -0.962 . . . . 0.0 110.57 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -138.27 -60.92 0.61 Allowed 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -142.46 149.57 39.4 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.48 -0.762 . . . . 0.0 109.079 178.673 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 145' ' ' CYS . . . . . 0.409 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.6 p -90.32 153.82 20.16 Favored 'General case' 0 N--CA 1.506 2.368 0 C-N-CA 119.102 -1.039 . . . . 0.0 111.195 -179.439 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 27.0 m -72.11 -24.96 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.439 0 O-C-N 121.445 -0.785 . . . . 0.0 111.396 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 61.8 m170 -50.06 -61.31 2.23 Favored 'General case' 0 N--CA 1.515 2.802 0 O-C-N 120.837 -1.164 . . . . 0.0 110.036 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.492 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.3 p -125.93 -166.13 1.52 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.273 -0.892 . . . . 0.0 110.459 179.325 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -99.43 64.52 0.67 Allowed Glycine 0 N--CA 1.492 2.376 0 N-CA-C 107.987 -2.045 . . . . 0.0 107.987 178.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 29.9 t -104.73 137.32 42.71 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.359 -1.083 . . . . 0.0 110.007 -179.074 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 18.7 ttt85 -95.3 53.79 1.55 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.306 -0.871 . . . . 0.0 109.419 178.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 68.95 98.09 0.04 OUTLIER Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.986 -1.245 . . . . 0.0 109.986 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 29.8 p -105.56 119.01 38.04 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.279 -1.13 . . . . 0.0 110.248 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -145.86 154.64 42.2 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.141 -0.975 . . . . 0.0 110.063 -179.215 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 155' ' ' SER . . . . . 0.425 ' OG ' ' HB2' ' A' ' 101' ' ' GLU . 0.7 OUTLIER . . . . . 0 N--CA 1.505 2.304 0 O-C-N 121.29 -0.881 . . . . 0.0 110.693 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.664 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.504 2.236 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.415 ' HG2' HD13 ' A' ' 77' ' ' LEU . 44.8 Cg_endo -71.13 160.69 48.35 Favored 'Trans proline' 0 C--N 1.317 -1.097 0 O-C-N 123.358 1.188 . . . . 0.0 110.852 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -49.05 -31.72 8.25 Favored 'General case' 0 N--CA 1.515 2.791 0 O-C-N 121.411 -0.805 . . . . 0.0 111.361 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.8 -33.93 43.76 Favored Glycine 0 N--CA 1.498 2.826 0 O-C-N 120.957 -1.089 . . . . 0.0 110.503 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -55.66 -33.28 63.96 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.029 -1.277 . . . . 0.0 110.673 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -53.62 -38.29 63.89 Favored 'General case' 0 N--CA 1.513 2.687 0 O-C-N 121.047 -1.033 . . . . 0.0 110.2 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.7 mtmt -60.29 -37.42 80.47 Favored 'General case' 0 N--CA 1.509 2.482 0 C-N-CA 119.559 -0.856 . . . . 0.0 109.999 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.862 ' O ' HD12 ' A' ' 23' ' ' LEU . 1.3 pt -115.41 33.64 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.193 -0.942 . . . . 0.0 110.61 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 2.5 tttt -84.64 -43.08 0.71 Allowed Pre-proline 0 N--CA 1.51 2.557 0 O-C-N 120.936 -1.102 . . . . 0.0 113.393 -179.03 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.6 Cg_endo -75.57 -35.09 2.94 Favored 'Trans proline' 0 N--CA 1.487 1.094 0 O-C-N 122.604 0.792 . . . . 0.0 111.797 -178.093 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.472 HG21 ' CE2' ' A' ' 62' ' ' TYR . 82.9 m -60.43 -43.76 96.46 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 120.955 -1.091 . . . . 0.0 110.019 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.862 HD12 ' O ' ' A' ' 19' ' ' ILE . 6.2 mt -65.33 -39.49 92.49 Favored 'General case' 0 N--CA 1.507 2.377 0 C-N-CA 119.337 -0.945 . . . . 0.0 109.466 179.465 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.1 m -57.62 -35.54 70.6 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.085 -1.009 . . . . 0.0 110.185 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -56.81 -36.14 69.57 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.067 -1.021 . . . . 0.0 110.438 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.709 ' CD2' HD22 ' A' ' 55' ' ' LEU . 14.7 m-85 -58.46 -38.98 78.67 Favored 'General case' 0 N--CA 1.51 2.526 0 O-C-N 121.114 -0.991 . . . . 0.0 110.51 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -60.47 -38.48 84.35 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.185 -0.947 . . . . 0.0 110.711 -179.253 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.414 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.2 mp -66.9 -40.97 86.94 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.397 0 C-N-CA 119.238 -0.985 . . . . 0.0 109.089 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 29.2 tp60 -67.76 -47.17 69.99 Favored 'General case' 0 N--CA 1.506 2.354 0 C-N-CA 119.178 -1.009 . . . . 0.0 108.785 179.013 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.698 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.1 OUTLIER -63.58 -36.23 83.13 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 121.225 -0.922 . . . . 0.0 109.001 178.474 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.2 mtt85 -57.88 -41.41 82.46 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.026 -1.046 . . . . 0.0 109.874 179.517 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.86 -46.3 88.54 Favored 'General case' 0 N--CA 1.506 2.334 0 C-N-CA 119.27 -0.972 . . . . 0.0 109.602 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.53 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -66.91 -41.66 86.72 Favored 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 119.262 -0.975 . . . . 0.0 109.202 179.194 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -60.29 -34.24 73.49 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.566 -0.854 . . . . 0.0 110.191 179.51 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -92.72 -32.79 14.58 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.05 -1.031 . . . . 0.0 110.824 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 . . . . . 0 N--CA 1.512 2.638 0 O-C-N 120.933 -1.105 . . . . 0.0 110.357 -179.968 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.415 ' OG ' ' N ' ' A' ' 46' ' ' ASN . 24.0 p . . . . . 0 N--CA 1.496 1.832 0 CA-C-O 120.657 0.265 . . . . 0.0 110.368 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.415 ' N ' ' OG ' ' A' ' 45' ' ' SER . 1.3 m-80 -57.0 -38.79 73.58 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.281 -0.887 . . . . 0.0 109.966 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -64.58 -40.09 94.91 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.213 -0.93 . . . . 0.0 109.687 179.548 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.8 tp60 -62.33 -41.05 98.24 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.207 -0.933 . . . . 0.0 109.765 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.452 ' HA ' HD13 ' A' ' 49' ' ' LEU . 4.3 mm? -60.5 -39.87 89.31 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.212 -0.93 . . . . 0.0 109.993 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.497 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 52.9 m0 -60.83 -37.63 82.68 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.132 -0.98 . . . . 0.0 110.041 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -61.15 -31.07 70.8 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.038 -1.039 . . . . 0.0 109.916 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.698 HG23 ' CG ' ' A' ' 30' ' ' LEU . 70.6 mt -71.57 -58.41 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.244 0 O-C-N 120.864 -1.148 . . . . 0.0 109.286 179.451 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.407 ' HE1' ' O ' ' A' ' 147' ' ' HIS . 3.2 ptm -60.62 -28.28 68.41 Favored 'General case' 0 N--CA 1.509 2.52 0 C-N-CA 118.503 -1.279 . . . . 0.0 109.847 178.678 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -68.45 -37.26 80.05 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.756 -1.215 . . . . 0.0 109.24 178.139 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.709 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.3 mt -52.78 -32.5 44.02 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 120.967 -1.083 . . . . 0.0 110.175 179.044 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.473 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 10.4 t60 -54.61 -37.82 66.04 Favored 'General case' 0 N--CA 1.511 2.579 0 O-C-N 121.049 -1.032 . . . . 0.0 110.178 179.562 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.437 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 5.2 m170 -62.06 -51.84 66.33 Favored 'General case' 0 N--CA 1.508 2.443 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.472 179.29 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 19.6 tp60 -57.74 -34.67 69.76 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.273 -0.892 . . . . 0.0 109.831 179.332 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.426 ' HD3' ' CE2' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -68.81 -49.94 54.36 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.005 -1.06 . . . . 0.0 109.142 178.938 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 65.5 p -61.78 -37.45 84.38 Favored 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.162 -0.961 . . . . 0.0 109.432 179.107 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.84 -39.0 93.17 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.068 -1.02 . . . . 0.0 109.546 179.34 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.752 ' OH ' HG22 ' A' ' 19' ' ' ILE . 36.8 t80 -61.7 -49.82 74.92 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.182 -0.949 . . . . 0.0 109.379 179.578 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.764 HD12 ' HB2' ' A' ' 87' ' ' ALA . 85.1 mt -73.61 -41.47 55.47 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 C-N-CA 119.398 -0.921 . . . . 0.0 109.137 179.151 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.443 ' CE1' HG23 ' A' ' 92' ' ' ILE . 45.9 t80 -60.81 -33.07 72.44 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.289 -0.882 . . . . 0.0 110.135 179.125 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.7 m -79.25 -35.82 40.9 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.886 -1.133 . . . . 0.0 110.748 -179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.631 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -82.93 -33.69 26.74 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.836 -1.165 . . . . 0.0 112.412 -179.035 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.529 ' N ' HD12 ' A' ' 66' ' ' LEU . 64.2 t80 -86.6 -34.94 19.71 Favored 'General case' 0 N--CA 1.511 2.617 0 O-C-N 120.674 -1.266 . . . . 0.0 112.047 -179.35 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -98.55 -20.73 16.88 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.778 -1.201 . . . . 0.0 112.862 -178.316 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.415 ' HE2' ' CD2' ' A' ' 64' ' ' TYR . 0.6 OUTLIER -118.75 -56.65 2.1 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.552 -1.343 . . . . 0.0 111.198 -179.523 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.424 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 6.9 ttt85 -66.2 -30.84 71.38 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 121.085 -1.01 . . . . 0.0 110.706 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.2 ttpt 58.64 44.0 18.13 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.785 -1.197 . . . . 0.0 110.133 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.65 38.12 3.56 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.367 -0.833 . . . . 0.0 109.701 179.292 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.824 HG13 HD23 ' A' ' 77' ' ' LEU . 14.2 tt -155.32 162.97 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.92 0 O-C-N 121.25 -0.906 . . . . 0.0 110.206 -179.604 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.8 m -108.11 146.05 33.2 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.118 -0.989 . . . . 0.0 109.978 179.493 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -45.99 -32.9 3.02 Favored 'General case' 0 N--CA 1.516 2.835 0 O-C-N 121.269 -0.894 . . . . 0.0 111.598 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -61.42 -49.63 76.08 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 120.947 -1.095 . . . . 0.0 109.324 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.824 HD23 HG13 ' A' ' 73' ' ' ILE . 34.5 tp -67.31 -43.01 82.73 Favored 'General case' 0 N--CA 1.504 2.26 0 C-N-CA 119.25 -0.98 . . . . 0.0 108.593 178.753 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.463 ' HA ' HD12 ' A' ' 81' ' ' LEU . 17.6 t80 -61.3 -38.69 87.72 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 121.352 -0.842 . . . . 0.0 109.35 178.972 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.464 ' O ' HG22 ' A' ' 82' ' ' ILE . 10.4 t0 -74.73 -41.2 60.57 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.171 -0.956 . . . . 0.0 108.954 178.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.664 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 81.6 t90 -59.73 -38.33 81.38 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.175 -0.953 . . . . 0.0 109.291 178.871 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.463 HD12 ' HA ' ' A' ' 78' ' ' TYR . 16.6 mt -66.01 -55.69 15.4 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.179 -0.951 . . . . 0.0 109.278 179.144 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.537 HD12 ' HB3' ' A' ' 87' ' ' ALA . 0.9 OUTLIER -56.48 -27.43 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 O-C-N 121.104 -0.997 . . . . 0.0 110.831 -179.726 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 10.2 tppt? -89.26 -15.37 33.71 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 120.918 -1.114 . . . . 0.0 111.868 179.623 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.438 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 75.0 mm-40 -107.48 25.04 11.95 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.564 -1.335 . . . . 0.0 111.927 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.408 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 7.0 ttmt 76.69 67.89 0.06 Allowed 'General case' 0 N--CA 1.514 2.741 0 O-C-N 121.252 -0.905 . . . . 0.0 112.022 179.278 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.603 ' HE2' HD13 ' A' ' 23' ' ' LEU . 27.2 m-85 -131.28 -62.58 0.88 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.406 -0.809 . . . . 0.0 108.977 178.929 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.764 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -132.89 168.53 18.26 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.388 -0.82 . . . . 0.0 109.391 179.318 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.473 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.7 t70 -121.29 111.88 17.91 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.132 -0.98 . . . . 0.0 110.546 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 7.8 mttt -58.61 -35.26 72.16 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.229 -0.919 . . . . 0.0 110.259 179.634 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.3 tp -57.61 -40.55 79.36 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 120.992 -1.067 . . . . 0.0 110.069 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.689 ' HA ' HD21 ' A' ' 106' ' ' LEU . 63.1 tp -71.03 -49.85 40.43 Favored 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 119.195 -1.002 . . . . 0.0 108.723 179.275 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.443 HG23 ' CE1' ' A' ' 64' ' ' TYR . 63.8 mt -60.76 -30.3 46.84 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.289 0 C-N-CA 119.32 -0.952 . . . . 0.0 109.377 178.501 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.9 -45.39 78.13 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 120.964 -1.085 . . . . 0.0 109.423 178.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.486 ' HD3' HD23 ' A' ' 106' ' ' LEU . 11.9 mttp -59.47 -44.27 93.05 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.003 -1.061 . . . . 0.0 109.859 179.282 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 3.3 m0 -57.49 -33.52 68.11 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.077 -1.014 . . . . 0.0 110.367 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.29 -35.58 35.6 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.129 -0.982 . . . . 0.0 110.282 179.418 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.8 mmtm -53.57 -178.62 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.641 0 O-C-N 120.953 -1.092 . . . . 0.0 110.62 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.87 140.18 39.3 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.257 -0.902 . . . . 0.0 109.472 179.143 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 102.52 -27.55 19.81 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 -178.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.604 ' HB3' HD23 ' A' ' 103' ' ' LEU . 66.0 m-85 -92.62 59.05 3.24 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 120.859 -1.377 . . . . 0.0 109.734 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -81.37 -35.98 30.16 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.064 -1.022 . . . . 0.0 110.456 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.17 66.71 0.83 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.049 -1.032 . . . . 0.0 110.694 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.604 HD23 ' HB3' ' A' ' 100' ' ' TYR . 0.7 OUTLIER -109.59 149.46 29.64 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 120.967 -1.083 . . . . 0.0 109.82 179.43 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.437 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 27.0 p -111.62 -27.88 8.37 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.193 -0.942 . . . . 0.0 113.264 -179.186 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.684 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 12.4 m -144.86 -168.77 3.01 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 120.168 -1.582 . . . . 0.0 109.865 179.207 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.689 HD21 ' HA ' ' A' ' 91' ' ' LEU . 17.3 mt -97.01 -37.34 10.2 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.165 -0.959 . . . . 0.0 110.234 179.002 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 7.9 ttp180 -104.07 33.32 3.51 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.93 -1.106 . . . . 0.0 109.675 178.316 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.684 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.304 1.7 t -128.37 20.84 6.19 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 108.388 -0.968 . . . . 0.0 108.388 -179.629 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.466 HG23 ' C ' ' A' ' 108' ' ' CYS . 1.6 pt -157.29 38.34 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.298 0 O-C-N 121.017 -1.052 . . . . 0.0 110.211 -178.776 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.751 ' C ' HG23 ' A' ' 119' ' ' THR . 83.4 mt-30 . . . . . 0 N--CA 1.509 2.512 0 O-C-N 120.953 -1.092 . . . . 0.0 110.675 -178.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.751 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.7 m . . . . . 0 N--CA 1.503 2.193 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 39.6 t -92.62 154.2 18.54 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 119.386 -0.926 . . . . 0.0 108.962 178.715 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.965 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -77.29 -30.15 17.28 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.443 0 O-C-N 121.025 -1.047 . . . . 0.0 111.775 -178.711 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.48 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.7 p -59.02 -35.55 73.47 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 120.676 -1.265 . . . . 0.0 110.75 -179.156 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.08 -32.57 64.25 Favored 'General case' 0 N--CA 1.512 2.629 0 O-C-N 120.94 -1.1 . . . . 0.0 110.001 178.835 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 62.5 t -81.3 124.76 80.36 Favored Pre-proline 0 N--CA 1.503 2.212 0 O-C-N 121.051 -1.031 . . . . 0.0 109.681 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.97 178.81 2.15 Favored 'Trans proline' 0 N--CA 1.488 1.174 0 O-C-N 123.114 1.06 . . . . 0.0 110.762 179.617 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -75.12 -38.44 61.07 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.308 -0.87 . . . . 0.0 110.355 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.2 -40.88 82.73 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.089 -1.007 . . . . 0.0 110.029 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -67.41 -42.2 83.64 Favored 'General case' 0 N--CA 1.506 2.368 0 C-N-CA 119.432 -0.907 . . . . 0.0 109.217 179.309 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.698 HD11 HD11 ' A' ' 121' ' ' ILE . 9.5 mt -63.59 -39.78 95.26 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.155 -0.966 . . . . 0.0 109.547 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -58.82 -37.79 77.21 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.096 -1.002 . . . . 0.0 110.059 179.62 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -57.42 -37.18 72.35 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.098 -1.001 . . . . 0.0 110.381 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 62.7 mt-10 -61.43 -47.59 85.05 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.144 -0.972 . . . . 0.0 109.695 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.85 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -59.81 -37.97 80.67 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.171 -0.956 . . . . 0.0 109.877 179.644 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 23.6 ttm-85 -61.69 -38.72 88.89 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.155 -0.966 . . . . 0.0 110.318 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 49.5 mttm -87.08 -39.66 15.38 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.105 -0.997 . . . . 0.0 110.212 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 67.7 mttt -69.13 -26.0 64.67 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.21 -0.931 . . . . 0.0 111.17 179.67 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 90.0 33.54 8.88 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.85 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.7 t -144.31 -161.41 1.28 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.049 -1.266 . . . . 0.0 109.946 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -125.74 150.86 47.37 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.089 -1.007 . . . . 0.0 109.979 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.514 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.0 p -132.14 160.72 42.29 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.17 -0.956 . . . . 0.0 110.434 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 46.9 t -170.26 98.04 0.27 Allowed 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.237 -0.915 . . . . 0.0 110.892 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.965 ' CD1' HD12 ' A' ' 121' ' ' ILE . 81.6 t80 -103.93 159.97 15.2 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.124 -0.985 . . . . 0.0 110.85 -179.608 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -138.75 -61.06 0.58 Allowed 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.843 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -141.69 148.51 39.21 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.536 -0.728 . . . . 0.0 109.155 178.753 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 145' ' ' CYS . . . . . 0.417 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 29.8 p -89.81 154.13 20.14 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.073 -1.051 . . . . 0.0 111.069 -179.467 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.2 p -72.34 -25.77 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.386 0 O-C-N 121.385 -0.822 . . . . 0.0 111.463 -179.56 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 147' ' ' HIS . . . . . 0.407 ' O ' ' HE1' ' A' ' 53' ' ' MET . 61.7 m170 -49.78 -59.34 3.92 Favored 'General case' 0 N--CA 1.516 2.844 0 O-C-N 120.853 -1.154 . . . . 0.0 110.208 -179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.497 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.6 p -126.96 -165.23 1.44 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.278 -0.889 . . . . 0.0 110.333 179.289 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 149' ' ' GLY . . . . . 0.44 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -101.55 63.18 0.52 Allowed Glycine 0 N--CA 1.492 2.387 0 N-CA-C 107.879 -2.088 . . . . 0.0 107.879 178.377 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 20.6 t -101.49 141.26 34.62 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.347 -1.09 . . . . 0.0 109.819 -179.153 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 23.9 mtt85 -97.55 50.19 1.05 Allowed 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.246 -0.909 . . . . 0.0 109.546 179.067 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 71.42 98.37 0.06 OUTLIER Glycine 0 N--CA 1.486 2.017 0 N-CA-C 109.975 -1.25 . . . . 0.0 109.975 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.4 p -109.43 126.04 53.05 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.244 -1.15 . . . . 0.0 110.173 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -150.17 151.75 33.58 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.077 -1.015 . . . . 0.0 110.434 -179.366 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.5 2.058 0 O-C-N 121.217 -0.927 . . . . 0.0 110.583 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.768 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.504 2.24 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.45 165.05 33.82 Favored 'Trans proline' 0 C--N 1.317 -1.115 0 O-C-N 123.296 1.156 . . . . 0.0 110.514 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -48.18 -32.25 6.8 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 121.5 -0.75 . . . . 0.0 111.368 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.99 -33.99 51.47 Favored Glycine 0 N--CA 1.499 2.833 0 O-C-N 120.984 -1.072 . . . . 0.0 110.514 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.504 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 28.5 t80 -54.98 -31.63 60.94 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.039 -1.271 . . . . 0.0 110.689 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -53.27 -37.03 61.79 Favored 'General case' 0 N--CA 1.512 2.662 0 O-C-N 120.982 -1.074 . . . . 0.0 110.236 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp -59.0 -37.7 77.46 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.24 -0.913 . . . . 0.0 110.116 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.889 HD12 HD11 ' A' ' 23' ' ' LEU . 1.9 pt -119.51 35.07 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.223 -0.923 . . . . 0.0 110.537 179.77 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.439 ' HG3' ' CE2' ' A' ' 16' ' ' PHE . 3.0 tttt -84.9 -43.3 0.68 Allowed Pre-proline 0 N--CA 1.509 2.481 0 O-C-N 120.992 -1.067 . . . . 0.0 113.42 -178.901 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.42 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.7 Cg_endo -75.74 -35.45 2.64 Favored 'Trans proline' 0 N--CA 1.486 1.085 0 O-C-N 122.559 0.768 . . . . 0.0 111.867 -177.967 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.513 HG21 ' CE2' ' A' ' 62' ' ' TYR . 59.8 m -61.5 -45.62 93.45 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.985 -1.072 . . . . 0.0 110.061 -179.585 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.889 HD11 HD12 ' A' ' 19' ' ' ILE . 9.0 mt -63.53 -40.36 96.83 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.509 -0.877 . . . . 0.0 109.694 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.09 -35.34 73.23 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.157 -0.964 . . . . 0.0 110.087 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -57.92 -36.05 71.93 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.009 -1.057 . . . . 0.0 110.272 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.513 ' CZ ' ' NE2' ' A' ' 58' ' ' GLN . 10.4 m-85 -55.46 -40.95 72.25 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 120.879 -1.138 . . . . 0.0 109.978 179.598 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -58.58 -25.1 62.2 Favored 'General case' 0 N--CA 1.505 2.323 0 C-N-CA 119.484 -0.887 . . . . 0.0 110.711 179.284 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 11.3 mm -70.53 -49.01 55.76 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.31 0 O-C-N 120.894 -1.129 . . . . 0.0 109.136 179.624 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.77 -43.35 72.39 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.154 -0.967 . . . . 0.0 108.867 179.155 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.67 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -64.43 -34.68 78.75 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.249 -0.98 . . . . 0.0 109.215 178.544 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.58 -40.86 84.37 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.014 -1.054 . . . . 0.0 109.957 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -62.43 -48.19 80.77 Favored 'General case' 0 N--CA 1.508 2.45 0 C-N-CA 119.28 -0.968 . . . . 0.0 109.541 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.615 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -67.68 -41.05 84.28 Favored 'General case' 0 N--CA 1.505 2.292 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.245 179.124 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.52 ' HG3' HD23 ' A' ' 30' ' ' LEU . 8.8 mm-40 -66.28 -34.21 77.49 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.309 -0.869 . . . . 0.0 110.159 179.401 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt -85.87 -34.32 21.04 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.033 -1.042 . . . . 0.0 110.631 179.713 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 36.1 t70 . . . . . 0 N--CA 1.511 2.619 0 O-C-N 121.002 -1.062 . . . . 0.0 110.209 179.907 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 27.9 t . . . . . 0 N--CA 1.494 1.758 0 CA-C-O 120.685 0.279 . . . . 0.0 110.363 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -56.96 -39.45 74.62 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 121.169 -0.957 . . . . 0.0 109.911 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -63.07 -39.35 94.45 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.153 -0.967 . . . . 0.0 109.763 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 46.4 tp60 -62.15 -41.02 97.88 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.167 -0.958 . . . . 0.0 109.855 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -60.05 -39.99 87.87 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.225 -0.922 . . . . 0.0 110.169 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.496 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.3 m0 -59.13 -36.38 75.11 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.214 -0.929 . . . . 0.0 110.276 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -60.99 -29.86 69.93 Favored 'General case' 0 N--CA 1.507 2.378 0 C-N-CA 119.164 -1.014 . . . . 0.0 110.173 179.136 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.67 HG23 ' CG ' ' A' ' 30' ' ' LEU . 71.7 mt -72.58 -58.16 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.269 0 O-C-N 120.936 -1.103 . . . . 0.0 109.196 179.461 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.4 ptm -60.53 -29.96 69.45 Favored 'General case' 0 N--CA 1.51 2.548 0 C-N-CA 118.609 -1.237 . . . . 0.0 109.861 178.904 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.9 mt-30 -69.81 -37.66 76.35 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.894 -1.129 . . . . 0.0 109.075 178.111 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.414 ' HA ' HD23 ' A' ' 55' ' ' LEU . 12.5 mt -54.26 -32.65 56.69 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.003 -1.06 . . . . 0.0 110.211 178.957 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.449 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 6.2 t60 -55.0 -37.13 66.2 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.008 -1.057 . . . . 0.0 110.111 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.493 ' NE2' HD21 ' A' ' 91' ' ' LEU . 5.1 m170 -59.61 -48.3 82.19 Favored 'General case' 0 N--CA 1.509 2.508 0 C-N-CA 119.313 -0.955 . . . . 0.0 109.538 179.05 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.513 ' NE2' ' CZ ' ' A' ' 26' ' ' PHE . 16.8 tt0 -60.58 -36.15 77.81 Favored 'General case' 0 N--CA 1.506 2.327 0 C-N-CA 119.396 -0.921 . . . . 0.0 109.505 179.036 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.451 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -67.59 -49.58 62.46 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.182 -0.949 . . . . 0.0 109.304 179.073 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.6 p -61.26 -38.11 85.54 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.146 -0.971 . . . . 0.0 109.586 179.26 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.0 ttt85 -65.7 -39.0 90.77 Favored 'General case' 0 N--CA 1.507 2.392 0 C-N-CA 119.164 -1.014 . . . . 0.0 109.406 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.56 ' OH ' HG22 ' A' ' 19' ' ' ILE . 40.5 t80 -59.88 -47.13 86.98 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.21 -0.931 . . . . 0.0 109.561 179.496 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.772 HD12 ' HB2' ' A' ' 87' ' ' ALA . 86.2 mt -78.01 -44.06 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 O-C-N 121.186 -0.946 . . . . 0.0 108.947 179.212 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.523 ' CE1' HG23 ' A' ' 92' ' ' ILE . 37.7 t80 -59.17 -25.62 64.08 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.326 -0.859 . . . . 0.0 110.289 178.871 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.417 ' HA ' ' CD ' ' A' ' 69' ' ' LYS . 71.2 m -87.47 -37.12 17.25 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.774 -1.204 . . . . 0.0 110.283 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.58 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.6 pp -83.14 -31.82 26.99 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.005 -1.059 . . . . 0.0 112.485 -179.116 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.491 ' HD1' HG23 ' A' ' 73' ' ' ILE . 73.5 t80 -86.27 -36.2 19.5 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 120.697 -1.252 . . . . 0.0 111.482 -179.192 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -94.36 -17.11 22.87 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 120.889 -1.132 . . . . 0.0 112.726 -178.536 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.417 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 1.1 mttt -125.0 -60.48 1.35 Allowed 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.53 -1.356 . . . . 0.0 111.264 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.426 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 1.7 tpt180 -59.82 -29.89 68.56 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 120.986 -1.071 . . . . 0.0 110.825 -179.636 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.2 tttt 58.55 43.86 18.64 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.885 -1.134 . . . . 0.0 110.058 -179.526 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -114.07 36.63 3.62 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.366 -0.834 . . . . 0.0 109.798 179.234 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.755 HG13 HD23 ' A' ' 77' ' ' LEU . 13.8 tt -159.43 162.36 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.202 -0.936 . . . . 0.0 110.119 -179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.05 149.44 29.26 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.048 -1.032 . . . . 0.0 110.199 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.9 tttp -46.09 -32.7 3.03 Favored 'General case' 0 N--CA 1.515 2.804 0 O-C-N 121.375 -0.828 . . . . 0.0 111.588 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -62.46 -51.37 67.74 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 120.961 -1.087 . . . . 0.0 109.224 179.577 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.755 HD23 HG13 ' A' ' 73' ' ' ILE . 29.6 tp -65.92 -42.35 90.26 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.192 -1.003 . . . . 0.0 108.659 178.809 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.584 ' HA ' HD12 ' A' ' 81' ' ' LEU . 17.6 t80 -61.86 -40.13 94.29 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.302 -0.874 . . . . 0.0 109.244 179.022 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -70.84 -42.21 70.45 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.14 -0.975 . . . . 0.0 108.868 178.821 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.768 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 81.5 t90 -57.57 -36.84 72.21 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.248 -0.907 . . . . 0.0 109.65 179.049 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.584 HD12 ' HA ' ' A' ' 78' ' ' TYR . 15.8 mt -67.99 -51.37 47.99 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.059 -1.025 . . . . 0.0 109.082 179.176 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.494 HG21 ' HD2' ' A' ' 89' ' ' LYS . 34.8 mm -56.77 -29.27 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.53 0 O-C-N 121.208 -0.932 . . . . 0.0 110.209 179.415 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 25.2 tttt -89.1 -20.33 24.44 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 120.873 -1.142 . . . . 0.0 111.93 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.441 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 29.0 mm-40 -102.91 22.9 13.04 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 120.635 -1.291 . . . . 0.0 112.077 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? 73.81 77.65 0.13 Allowed 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.02 -1.05 . . . . 0.0 111.685 179.245 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.736 ' HE2' HD13 ' A' ' 23' ' ' LEU . 31.8 m-85 -135.9 -62.39 0.68 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.51 -0.743 . . . . 0.0 109.342 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.772 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -127.96 171.67 11.61 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.478 -0.763 . . . . 0.0 109.41 179.324 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.449 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 25.8 t0 -114.35 104.94 12.56 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.144 -0.973 . . . . 0.0 110.246 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.494 ' HD2' HG21 ' A' ' 82' ' ' ILE . 20.5 mttm -58.83 -39.91 82.6 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.219 -0.926 . . . . 0.0 109.934 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.596 HD23 HD13 ' A' ' 106' ' ' LEU . 27.5 tp -61.52 -38.59 87.95 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.135 -0.978 . . . . 0.0 109.924 179.84 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.493 HD21 ' NE2' ' A' ' 57' ' ' HIS . 57.0 tp -71.47 -47.25 56.86 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.056 -1.028 . . . . 0.0 108.702 179.241 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.523 HG23 ' CE1' ' A' ' 64' ' ' TYR . 23.1 mt -58.02 -36.44 56.49 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 O-C-N 121.16 -0.962 . . . . 0.0 108.627 178.305 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.99 -38.91 86.88 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 121.154 -0.966 . . . . 0.0 109.137 178.369 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.433 ' HD2' ' CZ ' ' A' ' 100' ' ' TYR . 4.9 mmtt -57.64 -42.91 84.41 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.152 -0.967 . . . . 0.0 109.474 179.288 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.5 m0 -64.79 -37.46 87.7 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.56 -0.856 . . . . 0.0 110.055 179.533 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.3 mtp85 -75.68 -32.81 60.29 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.194 -0.941 . . . . 0.0 110.543 179.585 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -54.06 -176.59 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.7 0 O-C-N 121.065 -1.022 . . . . 0.0 110.657 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -104.03 136.14 44.23 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.129 -0.982 . . . . 0.0 109.694 179.228 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 95.63 11.3 55.63 Favored Glycine 0 N--CA 1.494 2.553 0 C-N-CA 120.172 -1.013 . . . . 0.0 111.023 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.641 ' HB3' HD23 ' A' ' 103' ' ' LEU . 48.2 m-85 -119.28 71.95 0.88 Allowed 'General case' 0 N--CA 1.493 1.715 0 CA-C-N 119.403 1.602 . . . . 0.0 109.777 179.703 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -96.73 -36.26 10.72 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.177 -0.952 . . . . 0.0 110.807 -179.701 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.33 66.98 0.99 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.015 -1.053 . . . . 0.0 110.822 -179.598 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.641 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.2 pp -114.5 153.04 30.72 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.035 -1.041 . . . . 0.0 109.78 179.297 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.433 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.7 p -114.36 -29.92 6.74 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.172 -0.955 . . . . 0.0 113.569 -178.991 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.645 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.8 m -142.92 -167.99 2.67 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 120.051 -1.656 . . . . 0.0 109.907 179.263 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.596 HD13 HD23 ' A' ' 90' ' ' LEU . 15.0 mt -95.69 -39.04 10.09 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.2 -0.937 . . . . 0.0 109.937 179.083 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 5.7 ttm-85 -102.83 30.74 4.55 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.026 -1.046 . . . . 0.0 109.933 178.332 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.645 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.299 1.8 t -128.14 17.98 6.59 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.12 -0.988 . . . . 0.0 108.947 -179.554 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.461 HG23 ' C ' ' A' ' 108' ' ' CYS . 1.2 pt -158.28 37.83 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.275 0 O-C-N 120.864 -1.147 . . . . 0.0 110.571 -178.702 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.524 ' C ' HG23 ' A' ' 119' ' ' THR . 12.1 mm-40 . . . . . 0 N--CA 1.51 2.559 0 O-C-N 120.854 -1.154 . . . . 0.0 110.509 -178.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.524 HG23 ' C ' ' A' ' 110' ' ' GLN . 2.7 m . . . . . 0 N--CA 1.495 1.824 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.428 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 41.7 t -102.74 155.28 18.42 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.247 -0.908 . . . . 0.0 109.698 179.521 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.778 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -72.96 -36.34 51.13 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.457 0 O-C-N 121.114 -0.991 . . . . 0.0 111.052 -179.36 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.483 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 11.9 p -53.65 -33.17 54.33 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 120.84 -1.163 . . . . 0.0 111.253 -178.772 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.32 -32.57 70.2 Favored 'General case' 0 N--CA 1.512 2.65 0 O-C-N 120.952 -1.092 . . . . 0.0 109.666 178.392 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 49.3 t -82.84 125.41 75.45 Favored Pre-proline 0 N--CA 1.505 2.297 0 O-C-N 121.06 -1.025 . . . . 0.0 109.85 179.603 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.64 175.29 4.49 Favored 'Trans proline' 0 N--CA 1.488 1.189 0 O-C-N 123.155 1.082 . . . . 0.0 110.797 179.596 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.11 -36.71 61.66 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.256 -0.902 . . . . 0.0 110.73 -179.758 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.65 -40.22 78.8 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 121.031 -1.043 . . . . 0.0 110.105 -179.672 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -69.84 -41.35 75.02 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 119.356 -0.938 . . . . 0.0 109.288 179.316 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.728 HD11 HD11 ' A' ' 121' ' ' ILE . 2.9 mt -65.04 -38.45 90.87 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.246 -0.909 . . . . 0.0 109.648 179.231 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -61.22 -40.46 94.08 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.088 -1.008 . . . . 0.0 109.842 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -59.8 -37.49 79.29 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.144 -0.973 . . . . 0.0 110.294 179.82 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -61.53 -43.44 98.86 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.169 -0.957 . . . . 0.0 110.071 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.618 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -60.29 -40.89 92.09 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.186 -0.946 . . . . 0.0 110.015 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.94 -33.82 69.22 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.183 -0.948 . . . . 0.0 110.401 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 25.1 mttt -76.88 -30.93 56.44 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.065 -1.022 . . . . 0.0 110.949 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 14.8 mtpp -98.42 22.33 9.9 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 120.916 -1.115 . . . . 0.0 111.688 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.67 39.38 46.13 Favored Glycine 0 N--CA 1.5 2.964 0 O-C-N 120.691 -1.255 . . . . 0.0 110.727 179.265 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.618 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 7.0 t -143.55 -166.64 2.38 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.089 -1.242 . . . . 0.0 110.338 179.898 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 139' ' ' GLN . . . . . 0.438 ' HA ' ' HB1' ' A' ' 133' ' ' ALA . 37.6 mt-30 -132.94 155.05 49.81 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.245 -0.91 . . . . 0.0 110.248 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.611 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.2 p -130.63 161.36 40.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.152 -0.968 . . . . 0.0 109.961 179.807 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 42.2 t -166.41 85.52 0.3 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.138 -0.976 . . . . 0.0 111.285 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.762 ' CG ' HD12 ' A' ' 121' ' ' ILE . 55.1 t80 -97.43 159.94 14.62 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.207 -0.933 . . . . 0.0 110.136 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 9.8 m-70 -136.82 -61.47 0.67 Allowed 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 179.013 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -136.7 151.0 48.76 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.45 -0.781 . . . . 0.0 108.928 178.663 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 145' ' ' CYS . . . . . 0.402 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 29.0 p -91.49 154.48 19.09 Favored 'General case' 0 N--CA 1.506 2.331 0 C-N-CA 119.121 -1.032 . . . . 0.0 111.093 -179.456 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.5 m -72.7 -25.1 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.462 0 C-N-CA 119.742 -0.783 . . . . 0.0 111.541 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 63.3 m170 -50.43 -60.81 2.63 Favored 'General case' 0 N--CA 1.516 2.856 0 O-C-N 120.906 -1.121 . . . . 0.0 110.022 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.496 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.9 p -126.43 -165.39 1.44 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.215 -0.928 . . . . 0.0 110.393 179.263 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 149' ' ' GLY . . . . . 0.441 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.39 63.52 0.61 Allowed Glycine 0 N--CA 1.492 2.42 0 N-CA-C 108.053 -2.019 . . . . 0.0 108.053 178.543 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 30.5 t -103.69 138.89 39.69 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.357 -1.084 . . . . 0.0 110.074 -179.191 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -95.03 54.38 1.68 Allowed 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.266 -0.896 . . . . 0.0 109.444 179.022 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.66 97.93 0.03 OUTLIER Glycine 0 N--CA 1.486 2.024 0 N-CA-C 109.819 -1.312 . . . . 0.0 109.819 -179.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.5 p -107.22 126.23 52.14 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.219 -1.165 . . . . 0.0 110.391 179.734 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -150.29 148.5 28.93 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.193 -0.942 . . . . 0.0 110.343 -179.514 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.502 2.174 0 O-C-N 121.248 -0.907 . . . . 0.0 110.772 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.712 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.507 2.405 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -71.82 162.1 43.01 Favored 'Trans proline' 0 C--N 1.318 -1.072 0 O-C-N 123.281 1.148 . . . . 0.0 110.896 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -48.82 -31.96 7.94 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 121.464 -0.773 . . . . 0.0 111.344 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.35 -33.91 40.28 Favored Glycine 0 N--CA 1.498 2.827 0 O-C-N 120.992 -1.067 . . . . 0.0 110.584 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -54.89 -32.6 61.08 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 120.972 -1.311 . . . . 0.0 110.634 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -54.44 -37.94 65.73 Favored 'General case' 0 N--CA 1.512 2.659 0 O-C-N 121.04 -1.037 . . . . 0.0 110.251 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.8 mttm -57.94 -37.14 73.58 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.27 -0.894 . . . . 0.0 110.115 179.523 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.89 HD12 HD11 ' A' ' 23' ' ' LEU . 2.6 pt -116.1 35.31 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.206 -0.934 . . . . 0.0 110.402 179.392 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.432 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -83.59 -43.09 0.81 Allowed Pre-proline 0 N--CA 1.51 2.529 0 O-C-N 121.082 -1.011 . . . . 0.0 113.17 -179.179 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.432 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.2 Cg_endo -76.12 -35.79 2.23 Favored 'Trans proline' 0 N--CA 1.487 1.123 0 O-C-N 122.632 0.806 . . . . 0.0 111.66 -178.392 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.781 HG21 ' CE2' ' A' ' 62' ' ' TYR . 88.6 m -60.5 -44.96 95.44 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 120.946 -1.096 . . . . 0.0 109.828 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.89 HD11 HD12 ' A' ' 19' ' ' ILE . 8.4 mt -65.01 -39.36 93.33 Favored 'General case' 0 N--CA 1.505 2.321 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.416 179.401 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 20.2 m -58.5 -35.41 72.19 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.076 -1.015 . . . . 0.0 110.051 179.16 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -56.37 -35.87 68.18 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 121.037 -1.039 . . . . 0.0 110.394 179.586 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.685 ' CD2' HD22 ' A' ' 55' ' ' LEU . 12.9 m-85 -56.82 -36.4 69.9 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.075 -1.016 . . . . 0.0 110.475 179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -57.79 -38.61 75.8 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.069 -1.02 . . . . 0.0 110.499 -179.685 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.422 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.1 mp -65.96 -41.01 88.98 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.412 0 C-N-CA 119.31 -0.956 . . . . 0.0 109.033 179.624 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 8.7 tp60 -68.97 -46.75 67.31 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.108 -0.995 . . . . 0.0 108.826 179.044 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.026 HD11 HG23 ' A' ' 52' ' ' ILE . 2.4 tp -61.89 -36.97 82.86 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.205 -0.935 . . . . 0.0 109.235 178.735 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.1 mtt85 -57.24 -36.46 70.96 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.138 -0.976 . . . . 0.0 110.298 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -62.93 -51.78 65.59 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.072 -1.017 . . . . 0.0 109.503 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.456 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -69.08 -42.27 76.43 Favored 'General case' 0 N--CA 1.504 2.274 0 C-N-CA 119.045 -1.062 . . . . 0.0 108.614 178.81 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -61.26 -33.19 73.13 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 119.455 -0.898 . . . . 0.0 110.297 179.369 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.8 mmtt -94.25 -29.23 15.19 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 120.897 -1.127 . . . . 0.0 111.289 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 . . . . . 0 N--CA 1.513 2.69 0 O-C-N 120.79 -1.194 . . . . 0.0 110.473 -179.869 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.8 m . . . . . 0 N--CA 1.494 1.755 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -56.81 -39.07 73.5 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 121.226 -0.921 . . . . 0.0 109.763 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -58.54 -35.16 71.88 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.243 -0.911 . . . . 0.0 110.137 179.36 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.422 ' HG2' ' CB ' ' A' ' 33' ' ' ALA . 0.3 OUTLIER -58.72 -46.31 87.63 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 120.974 -1.079 . . . . 0.0 109.585 179.72 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 92.1 mt -63.28 -37.78 88.58 Favored 'General case' 0 N--CA 1.508 2.463 0 C-N-CA 119.305 -0.958 . . . . 0.0 109.916 179.517 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.498 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 38.3 m0 -59.36 -33.99 71.84 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.153 -0.967 . . . . 0.0 109.405 179.413 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -68.03 -33.49 74.68 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 120.727 -1.233 . . . . 0.0 109.326 178.091 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 1.026 HG23 HD11 ' A' ' 30' ' ' LEU . 11.2 mt -70.82 -53.64 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.245 0 O-C-N 121.03 -1.044 . . . . 0.0 109.491 179.222 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.496 ' CE ' ' HB2' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -59.83 -33.1 71.32 Favored 'General case' 0 N--CA 1.51 2.538 0 C-N-CA 118.764 -1.174 . . . . 0.0 109.718 179.169 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.36 -39.59 91.18 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 120.91 -1.119 . . . . 0.0 109.44 179.129 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.685 HD22 ' CD2' ' A' ' 26' ' ' PHE . 18.0 mt -54.46 -34.31 61.27 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.158 -0.964 . . . . 0.0 110.097 179.235 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.441 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 4.8 t60 -58.55 -39.21 79.6 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 120.983 -1.073 . . . . 0.0 109.85 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.439 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 7.6 m170 -59.95 -48.39 81.91 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.086 -1.009 . . . . 0.0 109.064 179.24 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.88 -38.51 88.59 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.55 -0.86 . . . . 0.0 109.397 179.065 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.23 -44.71 96.83 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.246 -0.909 . . . . 0.0 109.502 179.478 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 52.7 p -66.34 -39.96 89.56 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.091 -1.006 . . . . 0.0 109.151 179.07 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 60.3 ttt-85 -63.04 -40.24 97.11 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.117 -0.989 . . . . 0.0 109.298 179.086 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.781 ' CE2' HG21 ' A' ' 22' ' ' THR . 40.1 t80 -62.2 -50.58 71.23 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.151 -0.968 . . . . 0.0 109.383 179.595 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.842 HD12 ' HB2' ' A' ' 87' ' ' ALA . 82.3 mt -70.59 -37.56 70.19 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 C-N-CA 119.289 -0.964 . . . . 0.0 109.332 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.413 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 8.5 t80 -66.56 -41.65 88.28 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.146 -0.971 . . . . 0.0 108.996 178.854 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 86.3 m -60.84 -41.82 96.54 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.112 -0.992 . . . . 0.0 110.098 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.603 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.18 -35.65 25.32 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 120.958 -1.089 . . . . 0.0 112.716 -178.915 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.58 ' N ' HD12 ' A' ' 66' ' ' LEU . 41.8 t80 -86.58 -33.56 20.17 Favored 'General case' 0 N--CA 1.514 2.751 0 O-C-N 120.614 -1.304 . . . . 0.0 112.044 -179.066 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.413 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 6.8 m-85 -98.25 -3.35 37.56 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.854 -1.153 . . . . 0.0 113.308 -178.351 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -136.32 -57.52 0.75 Allowed 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.374 -1.454 . . . . 0.0 111.134 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.422 ' HB2' ' HA ' ' A' ' 66' ' ' LEU . 14.3 mtp85 -69.19 -28.58 66.51 Favored 'General case' 0 N--CA 1.51 2.557 0 O-C-N 120.949 -1.094 . . . . 0.0 110.731 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.0 tttp 60.22 44.78 12.27 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.781 -1.199 . . . . 0.0 109.985 -179.516 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.54 35.73 3.71 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.343 -0.848 . . . . 0.0 109.817 179.107 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.804 HG13 HD23 ' A' ' 77' ' ' LEU . 14.3 tt -155.99 162.69 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 O-C-N 121.151 -0.968 . . . . 0.0 110.052 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.7 p -109.5 147.08 33.53 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.085 -1.009 . . . . 0.0 110.095 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.3 tttt -45.87 -32.23 2.52 Favored 'General case' 0 N--CA 1.515 2.809 0 O-C-N 121.309 -0.869 . . . . 0.0 111.621 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -61.8 -50.54 71.93 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.955 -1.091 . . . . 0.0 109.274 179.445 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.804 HD23 HG13 ' A' ' 73' ' ' ILE . 38.5 tp -66.68 -44.44 81.78 Favored 'General case' 0 N--CA 1.505 2.295 0 C-N-CA 119.241 -0.984 . . . . 0.0 108.442 178.873 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.435 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 18.5 t80 -60.43 -38.74 85.06 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.327 -0.858 . . . . 0.0 109.564 179.208 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -73.39 -41.92 62.77 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.059 -1.026 . . . . 0.0 109.016 178.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.712 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 84.1 t90 -57.65 -37.3 73.13 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.219 -0.926 . . . . 0.0 109.756 179.143 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.779 HD22 ' CD2' ' A' ' 86' ' ' TYR . 60.9 mt -69.28 -47.86 63.35 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.209 -0.932 . . . . 0.0 108.949 179.217 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.566 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 33.1 mm -56.23 -31.72 32.96 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.64 0 O-C-N 121.264 -0.897 . . . . 0.0 109.975 179.383 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 8.3 ttmt -89.24 -16.55 30.99 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 120.868 -1.145 . . . . 0.0 112.136 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.454 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 15.5 mm-40 -104.53 22.73 14.46 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 120.583 -1.323 . . . . 0.0 112.158 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.6 tptt 75.75 71.44 0.08 Allowed 'General case' 0 N--CA 1.512 2.643 0 O-C-N 121.149 -0.969 . . . . 0.0 111.903 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.779 ' CD2' HD22 ' A' ' 81' ' ' LEU . 33.2 m-85 -134.1 -63.03 0.74 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.42 -0.8 . . . . 0.0 109.019 179.198 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.842 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -128.36 164.08 23.44 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.485 -0.759 . . . . 0.0 109.26 179.168 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.441 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 3.3 t0 -112.04 107.33 16.24 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.102 -0.999 . . . . 0.0 110.468 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.6 mttt -58.82 -39.59 81.64 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.13 -0.981 . . . . 0.0 109.914 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.597 HD23 HD22 ' A' ' 106' ' ' LEU . 16.2 tp -60.61 -39.3 87.65 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.233 -0.917 . . . . 0.0 110.05 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.43 ' HA ' HD21 ' A' ' 106' ' ' LEU . 61.0 tp -70.11 -48.2 58.58 Favored 'General case' 0 N--CA 1.507 2.4 0 C-N-CA 119.203 -0.999 . . . . 0.0 108.669 179.229 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.441 HG22 ' HD2' ' A' ' 96' ' ' ARG . 62.9 mt -61.34 -38.22 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.434 0 C-N-CA 119.32 -0.952 . . . . 0.0 108.552 178.285 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.99 -39.06 83.31 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.146 -0.971 . . . . 0.0 109.087 178.401 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.467 ' HB3' HD22 ' A' ' 103' ' ' LEU . 5.8 mmtt -57.7 -41.85 82.5 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.043 -1.036 . . . . 0.0 109.43 179.363 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.418 ' CZ3' ' HG ' ' A' ' 91' ' ' LEU . 4.7 m0 -68.11 -40.21 82.62 Favored 'General case' 0 N--CA 1.506 2.352 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.475 179.296 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.441 ' HD2' HG22 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -66.16 -36.0 81.95 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.274 -0.891 . . . . 0.0 110.229 179.503 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.2 mmtp -53.84 -179.41 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.637 0 O-C-N 121.075 -1.016 . . . . 0.0 110.471 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -106.03 141.26 37.7 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.308 -0.87 . . . . 0.0 109.58 179.428 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.36 -20.49 49.62 Favored Glycine 0 N--CA 1.491 2.366 0 C-N-CA 119.854 -1.165 . . . . 0.0 110.608 -179.298 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -92.55 57.06 2.85 Favored 'General case' 0 N--CA 1.504 2.233 0 CA-C-N 119.313 1.556 . . . . 0.0 110.282 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -74.93 -38.57 61.76 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.009 -1.057 . . . . 0.0 109.66 179.324 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -111.91 83.95 1.88 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.239 -0.913 . . . . 0.0 109.602 179.583 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.881 HD13 HD13 ' A' ' 109' ' ' ILE . 9.3 tp -121.02 137.39 54.67 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.268 -0.895 . . . . 0.0 110.017 -179.293 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.439 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.8 p -111.6 -38.54 4.88 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.208 -0.932 . . . . 0.0 112.327 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.819 ' O ' HD11 ' A' ' 103' ' ' LEU . 5.5 m -139.65 -168.71 2.54 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 120.25 -1.531 . . . . 0.0 109.884 178.939 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.597 HD22 HD23 ' A' ' 90' ' ' LEU . 12.4 mt -97.59 -37.98 9.72 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.006 -1.059 . . . . 0.0 110.557 179.425 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.8 ttt-85 -101.89 32.2 3.54 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.939 -1.101 . . . . 0.0 109.464 178.067 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.672 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.306 1.7 t -127.36 16.22 7.13 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.231 -0.918 . . . . 0.0 109.119 -179.21 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.881 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -159.77 39.21 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 O-C-N 120.905 -1.122 . . . . 0.0 110.1 -178.891 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.769 ' C ' HG23 ' A' ' 119' ' ' THR . 1.7 tt0 . . . . . 0 N--CA 1.501 2.113 0 O-C-N 120.813 -1.179 . . . . 0.0 111.124 -178.518 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.769 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.3 OUTLIER . . . . . 0 N--CA 1.494 1.739 0 CA-C-O 120.76 0.314 . . . . 0.0 110.198 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.462 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 42.5 t -106.59 155.49 19.57 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.25 -0.906 . . . . 0.0 109.282 178.973 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.793 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -71.22 -36.81 63.66 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.336 0 O-C-N 121.098 -1.001 . . . . 0.0 110.757 -179.637 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.439 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 5.1 p -54.92 -32.68 61.44 Favored 'General case' 0 N--CA 1.512 2.636 0 O-C-N 120.84 -1.163 . . . . 0.0 110.968 -179.161 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.45 ' HG2' HG22 ' A' ' 109' ' ' ILE . 0.0 OUTLIER -58.5 -35.59 72.47 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.914 -1.116 . . . . 0.0 109.378 178.171 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 55.8 t -79.92 125.42 82.01 Favored Pre-proline 0 N--CA 1.503 2.187 0 O-C-N 121.21 -0.931 . . . . 0.0 109.478 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -64.94 167.94 14.78 Favored 'Trans proline' 0 N--CA 1.488 1.173 0 O-C-N 123.145 1.076 . . . . 0.0 110.662 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.03 -36.86 61.86 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.259 -0.901 . . . . 0.0 110.794 -179.529 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.11 -40.37 81.02 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.045 -1.035 . . . . 0.0 110.077 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -68.14 -41.52 81.5 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.201 -0.937 . . . . 0.0 109.323 179.434 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.781 HD11 HD11 ' A' ' 121' ' ' ILE . 10.9 mt -62.49 -38.48 90.05 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.496 -0.882 . . . . 0.0 109.859 179.495 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -59.98 -40.32 88.73 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.081 -1.012 . . . . 0.0 109.958 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -64.3 -38.96 92.88 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.174 -0.954 . . . . 0.0 109.822 179.474 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -60.61 -39.94 89.99 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.24 -0.913 . . . . 0.0 109.99 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.08 -45.06 95.18 Favored 'General case' 0 N--CA 1.508 2.452 0 C-N-CA 119.351 -0.94 . . . . 0.0 109.85 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 10.2 ttp85 -60.83 -39.05 87.58 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.203 -0.936 . . . . 0.0 109.789 179.617 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 27.8 mtmt -61.86 -34.38 75.89 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.144 -0.973 . . . . 0.0 110.602 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 29.4 mttt -102.49 18.48 21.06 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.005 -1.059 . . . . 0.0 111.921 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 55.35 45.45 83.34 Favored Glycine 0 N--CA 1.498 2.792 0 O-C-N 120.607 -1.308 . . . . 0.0 110.38 179.491 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.8 t -140.67 -163.44 1.53 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.171 -1.194 . . . . 0.0 110.079 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -138.51 145.41 40.73 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.184 -0.948 . . . . 0.0 110.253 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.571 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.6 p -132.03 160.85 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 O-C-N 121.147 -0.971 . . . . 0.0 110.109 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 41.4 t -168.8 80.68 0.14 Allowed 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.22 -0.925 . . . . 0.0 111.149 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.781 ' CG ' HD12 ' A' ' 121' ' ' ILE . 49.6 t80 -94.4 159.8 14.95 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.222 -0.924 . . . . 0.0 110.195 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 28.8 m170 -136.16 -61.13 0.71 Allowed 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 178.907 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -136.79 152.6 50.48 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.459 -0.776 . . . . 0.0 109.357 179.067 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 26.2 p -94.74 155.65 16.74 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.156 -0.965 . . . . 0.0 110.904 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.8 p -74.15 -25.28 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.532 0 O-C-N 121.344 -0.848 . . . . 0.0 111.583 -179.557 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -50.59 -46.68 58.04 Favored 'General case' 0 N--CA 1.517 2.896 0 O-C-N 120.755 -1.216 . . . . 0.0 109.594 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.498 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 29.5 p -141.5 -178.58 5.7 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.411 -0.806 . . . . 0.0 110.411 179.315 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -91.02 62.21 2.93 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 107.781 -2.128 . . . . 0.0 107.781 178.116 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.5 t -105.68 138.77 41.33 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.382 -1.069 . . . . 0.0 109.626 -178.978 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 3.7 tpt85 -92.65 57.05 2.81 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.276 -0.89 . . . . 0.0 109.727 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 61.82 96.25 0.01 OUTLIER Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.739 -1.344 . . . . 0.0 109.739 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.3 p -104.71 128.51 52.82 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.308 -1.113 . . . . 0.0 110.401 179.743 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -138.44 142.67 39.5 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.168 -0.957 . . . . 0.0 109.85 -179.856 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.495 1.788 0 O-C-N 121.205 -0.934 . . . . 0.0 110.174 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.726 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.503 2.183 0 CA-C-O 120.453 0.168 . . . . 0.0 110.691 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.56 162.63 40.83 Favored 'Trans proline' 0 C--N 1.318 -1.039 0 O-C-N 123.245 1.129 . . . . 0.0 110.675 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -48.77 -32.14 8.13 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 121.466 -0.771 . . . . 0.0 111.325 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -54.31 -33.42 52.73 Favored Glycine 0 N--CA 1.499 2.847 0 O-C-N 121.067 -1.021 . . . . 0.0 110.572 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -53.51 -31.48 46.27 Favored 'General case' 0 N--CA 1.512 2.662 0 O-C-N 120.903 -1.351 . . . . 0.0 110.818 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -54.37 -36.97 64.45 Favored 'General case' 0 N--CA 1.513 2.711 0 O-C-N 121.038 -1.039 . . . . 0.0 110.33 179.714 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.6 mmmt -57.14 -35.02 69.0 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.262 -0.899 . . . . 0.0 110.406 179.424 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.656 ' O ' HD12 ' A' ' 23' ' ' LEU . 3.2 pt -117.32 37.55 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.137 -0.977 . . . . 0.0 110.366 179.577 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.435 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 2.7 tmtt? -83.79 -42.91 0.79 Allowed Pre-proline 0 N--CA 1.507 2.394 0 O-C-N 121.142 -0.974 . . . . 0.0 113.254 -179.155 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.435 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.4 Cg_endo -75.85 -39.68 0.89 Allowed 'Trans proline' 0 N--CA 1.487 1.118 0 O-C-N 122.615 0.797 . . . . 0.0 111.853 -178.306 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.806 HG21 ' CE2' ' A' ' 62' ' ' TYR . 90.7 m -59.39 -43.25 92.96 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 120.906 -1.121 . . . . 0.0 109.952 -179.695 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.656 HD12 ' O ' ' A' ' 19' ' ' ILE . 3.6 mt -63.48 -37.8 88.67 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 119.425 -0.91 . . . . 0.0 109.506 179.304 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.3 m -56.63 -34.82 67.65 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.058 -1.026 . . . . 0.0 110.353 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.11 -38.81 73.95 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.004 -1.06 . . . . 0.0 110.014 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.723 ' CD2' HD22 ' A' ' 55' ' ' LEU . 22.6 m-85 -57.85 -40.09 79.28 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.121 -0.987 . . . . 0.0 110.025 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -57.02 -27.64 61.8 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.267 -0.896 . . . . 0.0 111.066 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.499 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.7 mp -78.09 -35.7 20.53 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.386 0 O-C-N 120.996 -1.065 . . . . 0.0 109.423 179.392 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.1 tp60 -79.78 -39.85 30.0 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 120.985 -1.072 . . . . 0.0 108.61 178.344 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.131 HD11 HG23 ' A' ' 52' ' ' ILE . 6.6 tp -69.6 -34.31 73.93 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.235 -0.916 . . . . 0.0 110.369 179.103 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -71.01 -35.54 72.07 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 120.885 -1.134 . . . . 0.0 109.953 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -65.44 -38.58 90.29 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.062 -1.024 . . . . 0.0 110.006 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.431 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -73.81 -42.02 61.51 Favored 'General case' 0 N--CA 1.504 2.251 0 C-N-CA 118.975 -1.09 . . . . 0.0 109.097 179.178 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -63.76 -33.19 75.1 Favored 'General case' 0 N--CA 1.505 2.322 0 C-N-CA 119.471 -0.892 . . . . 0.0 110.129 179.352 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.1 mttm -82.16 -31.35 30.53 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 120.857 -1.152 . . . . 0.0 110.893 179.756 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.3 t70 . . . . . 0 N--CA 1.512 2.653 0 O-C-N 120.97 -1.081 . . . . 0.0 110.709 179.985 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.499 1.993 0 CA-C-O 120.648 0.261 . . . . 0.0 110.434 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.416 ' O ' ' CG ' ' A' ' 50' ' ' TRP . 35.7 m120 -57.92 -40.01 79.36 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.168 -0.958 . . . . 0.0 109.924 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -66.13 -42.88 88.55 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.163 -0.96 . . . . 0.0 109.59 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.401 ' CG ' ' HA ' ' A' ' 33' ' ' ALA . 49.5 tp60 -68.51 -40.58 80.78 Favored 'General case' 0 N--CA 1.505 2.278 0 C-N-CA 119.293 -0.963 . . . . 0.0 109.347 179.283 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.586 HD23 HD12 ' A' ' 52' ' ' ILE . 13.1 mt -63.41 -36.85 85.1 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.238 -0.914 . . . . 0.0 109.924 179.574 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.516 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 53.6 m0 -58.04 -37.28 74.06 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 120.955 -1.09 . . . . 0.0 109.908 179.663 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -30.17 71.32 Favored 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 119.125 -1.03 . . . . 0.0 109.516 178.181 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 1.131 HG23 HD11 ' A' ' 30' ' ' LEU . 17.7 mt -69.61 -58.66 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.268 0 O-C-N 120.875 -1.14 . . . . 0.0 109.181 179.371 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.8 ptm -61.48 -29.96 70.31 Favored 'General case' 0 N--CA 1.51 2.557 0 C-N-CA 118.462 -1.295 . . . . 0.0 109.779 179.144 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -65.92 -38.23 88.13 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 120.887 -1.133 . . . . 0.0 109.167 178.276 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.723 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.3 mt -53.3 -32.23 47.82 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 120.962 -1.086 . . . . 0.0 110.182 179.108 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.461 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 72.6 t60 -55.61 -38.23 69.17 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 120.982 -1.074 . . . . 0.0 110.113 179.634 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.422 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.3 m170 -58.57 -47.17 85.18 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.091 -1.006 . . . . 0.0 109.412 179.261 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 -61.26 -35.64 77.82 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 119.407 -0.917 . . . . 0.0 109.219 178.65 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.459 ' HD3' ' CD1' ' A' ' 26' ' ' PHE . 20.2 mmm-85 -63.9 -51.14 65.88 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.105 -0.997 . . . . 0.0 109.37 179.212 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 52.0 p -60.58 -39.63 88.74 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.22 -0.925 . . . . 0.0 109.661 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.3 ttt85 -65.18 -41.76 94.28 Favored 'General case' 0 N--CA 1.504 2.255 0 C-N-CA 119.115 -1.034 . . . . 0.0 109.012 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.806 ' CE2' HG21 ' A' ' 22' ' ' THR . 46.1 t80 -63.37 -50.06 71.42 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.244 -0.91 . . . . 0.0 109.502 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.578 HD12 ' HB2' ' A' ' 87' ' ' ALA . 84.9 mt -70.2 -37.68 72.31 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.292 0 O-C-N 121.211 -0.931 . . . . 0.0 109.524 179.451 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.461 ' HD2' HD13 ' A' ' 92' ' ' ILE . 12.9 t80 -67.56 -42.17 83.04 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.168 -0.958 . . . . 0.0 108.995 179.04 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.404 ' HA ' ' HD3' ' A' ' 69' ' ' LYS . 90.0 m -61.19 -40.76 95.14 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.123 -0.986 . . . . 0.0 110.322 -179.653 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.599 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.35 -33.28 25.89 Favored 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 118.894 -1.122 . . . . 0.0 112.504 -178.875 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.502 ' N ' HD12 ' A' ' 66' ' ' LEU . 45.6 t80 -86.35 -32.12 21.15 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 120.611 -1.305 . . . . 0.0 111.927 -179.295 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -98.34 -18.98 18.04 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 120.874 -1.141 . . . . 0.0 112.721 -178.732 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.404 ' HD3' ' HA ' ' A' ' 65' ' ' THR . 13.5 mtpt -119.38 -58.77 1.89 Allowed 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.483 -1.385 . . . . 0.0 110.794 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.41 ' HB3' ' HA ' ' A' ' 66' ' ' LEU . 5.8 tpt180 -64.53 -30.59 71.62 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.11 -0.994 . . . . 0.0 110.99 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt 57.51 41.8 25.36 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 120.815 -1.178 . . . . 0.0 110.056 -179.367 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.07 35.46 3.93 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.409 -0.807 . . . . 0.0 109.941 179.288 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.81 HG13 HD23 ' A' ' 77' ' ' LEU . 13.8 tt -152.83 162.19 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.145 -0.972 . . . . 0.0 109.874 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.0 m -109.64 147.58 32.82 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.038 -1.039 . . . . 0.0 110.133 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.7 ttmt -45.81 -32.42 2.56 Favored 'General case' 0 N--CA 1.514 2.774 0 O-C-N 121.317 -0.865 . . . . 0.0 111.556 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.75 -50.28 73.02 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 120.987 -1.071 . . . . 0.0 109.205 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.81 HD23 HG13 ' A' ' 73' ' ' ILE . 41.7 tp -67.24 -44.48 79.35 Favored 'General case' 0 N--CA 1.505 2.292 0 C-N-CA 119.208 -0.997 . . . . 0.0 108.354 178.708 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.436 ' HA ' HD12 ' A' ' 81' ' ' LEU . 14.3 t80 -59.97 -37.58 80.04 Favored 'General case' 0 N--CA 1.507 2.397 0 C-N-CA 119.628 -0.829 . . . . 0.0 109.511 179.117 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.455 ' O ' HG22 ' A' ' 82' ' ' ILE . 32.3 t70 -75.22 -40.93 58.65 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.141 -0.974 . . . . 0.0 108.902 178.819 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.726 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 87.4 t90 -59.26 -37.83 78.6 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.05 -1.031 . . . . 0.0 109.263 178.744 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.54 HD23 ' CE2' ' A' ' 86' ' ' TYR . 11.4 mt -66.68 -57.28 7.48 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.188 -0.945 . . . . 0.0 109.057 178.855 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.553 HD11 ' N ' ' A' ' 89' ' ' LYS . 0.7 OUTLIER -56.01 -27.36 22.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.406 0 O-C-N 121.228 -0.92 . . . . 0.0 110.837 -179.877 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.9 tttt -89.52 -16.75 30.02 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 120.938 -1.101 . . . . 0.0 111.919 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.445 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 76.3 mm-40 -104.89 25.72 10.1 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.516 -1.365 . . . . 0.0 111.98 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.403 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 18.8 ttmt 76.64 66.92 0.05 Allowed 'General case' 0 N--CA 1.511 2.623 0 O-C-N 121.198 -0.938 . . . . 0.0 112.053 179.274 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.609 ' HE2' HD13 ' A' ' 23' ' ' LEU . 26.1 m-85 -129.95 -63.31 0.92 Allowed 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 178.751 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.578 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -135.75 171.21 14.78 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.497 -0.752 . . . . 0.0 109.23 179.164 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.461 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 11.0 t0 -119.49 111.72 18.46 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.151 -0.968 . . . . 0.0 110.273 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.553 ' N ' HD11 ' A' ' 82' ' ' ILE . 8.3 mtpt -57.58 -37.93 73.99 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.207 -0.933 . . . . 0.0 110.077 179.728 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.489 HD23 HD22 ' A' ' 106' ' ' LEU . 17.5 tp -59.08 -37.16 76.44 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.181 -0.949 . . . . 0.0 110.163 179.689 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.442 ' HA ' HD21 ' A' ' 106' ' ' LEU . 58.8 tp -70.03 -49.34 52.29 Favored 'General case' 0 N--CA 1.506 2.354 0 C-N-CA 119.231 -0.988 . . . . 0.0 108.764 179.275 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.461 HD13 ' HD2' ' A' ' 64' ' ' TYR . 68.1 mt -57.57 -38.51 64.37 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.52 0 O-C-N 121.148 -0.97 . . . . 0.0 108.693 178.415 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.04 -41.59 86.29 Favored 'General case' 0 N--CA 1.502 2.165 0 C-N-CA 119.356 -0.938 . . . . 0.0 108.742 178.309 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 8.3 mmtm -53.21 -39.84 64.02 Favored 'General case' 0 N--CA 1.512 2.669 0 O-C-N 121.162 -0.961 . . . . 0.0 109.892 179.177 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 3.6 m0 -68.85 -26.48 65.17 Favored 'General case' 0 N--CA 1.508 2.447 0 C-N-CA 119.436 -0.906 . . . . 0.0 110.723 179.486 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.49 -33.84 25.48 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 120.809 -1.182 . . . . 0.0 110.776 179.48 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? -53.26 -177.7 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.767 0 O-C-N 120.992 -1.068 . . . . 0.0 110.793 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -102.55 146.86 27.53 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.237 -0.914 . . . . 0.0 109.525 179.1 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 86.0 0.31 87.34 Favored Glycine 0 N--CA 1.495 2.619 0 C-N-CA 119.979 -1.105 . . . . 0.0 111.277 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.583 ' HB3' HD23 ' A' ' 103' ' ' LEU . 48.4 m-85 -111.06 67.17 0.64 Allowed 'General case' 0 N--CA 1.498 1.936 0 CA-C-N 119.576 1.688 . . . . 0.0 109.593 179.641 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -96.17 -35.35 11.34 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.111 -0.993 . . . . 0.0 110.935 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.54 63.0 0.77 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.021 -1.049 . . . . 0.0 110.895 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.583 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.5 pp -111.95 154.61 25.0 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.932 -1.105 . . . . 0.0 109.798 179.319 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.422 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.4 p -115.6 -30.47 6.16 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -178.923 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.634 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.5 m -142.09 -167.45 2.47 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 120.052 -1.655 . . . . 0.0 110.087 179.399 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.489 HD22 HD23 ' A' ' 90' ' ' LEU . 13.6 mt -95.53 -40.13 9.61 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.142 -0.974 . . . . 0.0 109.89 179.17 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -101.15 28.51 5.3 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.044 -1.035 . . . . 0.0 110.067 178.189 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.634 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.8 t -126.92 15.6 7.4 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.047 -1.033 . . . . 0.0 109.112 -179.584 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.501 HG22 ' HG3' ' A' ' 123' ' ' ARG . 1.0 OUTLIER -159.34 38.75 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 O-C-N 120.931 -1.106 . . . . 0.0 110.345 -178.783 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.695 ' C ' HG23 ' A' ' 119' ' ' THR . 1.2 tt0 . . . . . 0 N--CA 1.501 2.118 0 O-C-N 120.79 -1.194 . . . . 0.0 111.452 -178.503 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.695 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.718 0 CA-C-O 120.855 0.36 . . . . 0.0 110.476 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.458 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 48.5 t -109.25 155.48 21.07 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.359 -0.838 . . . . 0.0 109.116 178.811 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.962 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -73.65 -30.83 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 121.026 -1.046 . . . . 0.0 111.475 -179.163 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.478 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.4 p -59.79 -35.85 75.51 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 120.598 -1.314 . . . . 0.0 110.486 -179.432 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.501 ' HG3' HG22 ' A' ' 109' ' ' ILE . 0.1 OUTLIER -57.03 -33.13 66.88 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.041 -1.037 . . . . 0.0 109.961 178.807 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 61.6 t -79.78 123.93 83.65 Favored Pre-proline 0 N--CA 1.504 2.25 0 O-C-N 121.062 -1.024 . . . . 0.0 109.965 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.462 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.8 Cg_endo -66.33 -178.22 1.08 Allowed 'Trans proline' 0 N--CA 1.488 1.149 0 O-C-N 123.112 1.059 . . . . 0.0 110.785 179.574 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -75.06 -38.0 61.48 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.208 -0.932 . . . . 0.0 110.413 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.1 -43.37 91.87 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.052 -1.03 . . . . 0.0 109.95 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 64.1 tp60 -67.3 -41.54 85.21 Favored 'General case' 0 N--CA 1.506 2.331 0 C-N-CA 119.296 -0.962 . . . . 0.0 109.298 179.364 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.497 HD11 HD11 ' A' ' 121' ' ' ILE . 4.6 mt -63.44 -38.95 93.11 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.274 -0.891 . . . . 0.0 109.508 179.195 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -59.07 -39.55 82.43 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.058 -1.026 . . . . 0.0 109.989 179.766 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -58.59 -38.04 77.08 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.122 -0.986 . . . . 0.0 110.212 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -59.98 -41.99 93.23 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.177 -0.952 . . . . 0.0 110.048 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.662 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -61.49 -45.12 95.57 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.17 -0.956 . . . . 0.0 109.809 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 14.2 mmt180 -59.58 -39.26 83.55 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.155 -0.966 . . . . 0.0 109.9 179.653 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 3.4 ttmt -58.82 -35.75 73.39 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.148 -0.97 . . . . 0.0 110.515 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 43.8 mttt -107.74 21.62 17.16 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 120.961 -1.087 . . . . 0.0 111.827 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.5 46.26 58.57 Favored Glycine 0 N--CA 1.499 2.888 0 O-C-N 120.695 -1.253 . . . . 0.0 110.656 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.662 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 9.0 t -141.03 -165.06 1.87 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.155 -1.203 . . . . 0.0 110.176 179.822 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -126.54 171.98 10.62 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.12 -0.988 . . . . 0.0 110.355 -179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 8.7 p -157.06 160.94 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.326 -0.859 . . . . 0.0 110.664 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 27.3 t -167.58 107.31 0.57 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.185 -0.947 . . . . 0.0 110.911 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.962 ' CD1' HD12 ' A' ' 121' ' ' ILE . 84.2 t80 -108.79 160.23 16.14 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.247 -0.908 . . . . 0.0 111.035 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -138.61 -61.03 0.59 Allowed 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.587 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -142.15 149.12 39.35 Favored 'General case' 0 N--CA 1.495 1.821 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 178.53 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 145' ' ' CYS . . . . . 0.415 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 29.6 p -89.88 153.88 20.3 Favored 'General case' 0 N--CA 1.506 2.342 0 C-N-CA 119.078 -1.049 . . . . 0.0 111.187 -179.372 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 19.6 m -72.54 -23.43 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 121.428 -0.795 . . . . 0.0 111.385 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 61.6 m170 -51.52 -62.6 1.52 Allowed 'General case' 0 N--CA 1.513 2.723 0 O-C-N 120.781 -1.2 . . . . 0.0 110.021 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.516 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 21.9 p -123.9 -164.5 1.24 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.27 -0.894 . . . . 0.0 110.321 179.255 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 149' ' ' GLY . . . . . 0.434 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -101.58 64.45 0.5 Allowed Glycine 0 N--CA 1.493 2.462 0 N-CA-C 107.897 -2.081 . . . . 0.0 107.897 178.501 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 28.4 t -104.36 141.42 36.35 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.314 -1.109 . . . . 0.0 109.965 -179.046 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 46.0 ttt180 -97.06 51.01 1.1 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.271 -0.893 . . . . 0.0 109.476 179.044 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.2 99.32 0.05 OUTLIER Glycine 0 N--CA 1.486 2.028 0 N-CA-C 109.969 -1.252 . . . . 0.0 109.969 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 26.2 p -110.19 126.37 54.04 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.269 -1.136 . . . . 0.0 110.148 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -150.33 148.44 28.82 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.038 -1.039 . . . . 0.0 110.472 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.501 2.092 0 O-C-N 121.26 -0.9 . . . . 0.0 110.562 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.757 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.504 2.235 0 N-CA-C 110.394 -0.224 . . . . 0.0 110.394 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.01 163.77 38.09 Favored 'Trans proline' 0 C--N 1.317 -1.095 0 O-C-N 123.387 1.204 . . . . 0.0 110.718 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -48.27 -32.39 7.22 Favored 'General case' 0 N--CA 1.516 2.841 0 O-C-N 121.435 -0.791 . . . . 0.0 111.426 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.81 -34.89 51.77 Favored Glycine 0 N--CA 1.498 2.812 0 O-C-N 120.967 -1.083 . . . . 0.0 110.417 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.436 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 27.3 t80 -55.17 -33.14 62.72 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 121.039 -1.271 . . . . 0.0 110.739 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.7 tm-20 -54.4 -38.06 65.78 Favored 'General case' 0 N--CA 1.511 2.623 0 O-C-N 120.984 -1.073 . . . . 0.0 110.206 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.8 mttm -59.06 -35.62 73.65 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.257 -0.902 . . . . 0.0 110.21 179.512 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.64 ' O ' HD12 ' A' ' 23' ' ' LEU . 1.9 pt -117.99 37.07 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 121.074 -1.016 . . . . 0.0 110.34 179.756 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.432 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 2.5 tmtt? -84.82 -43.35 0.69 Allowed Pre-proline 0 N--CA 1.509 2.488 0 O-C-N 121.12 -0.988 . . . . 0.0 113.379 -179.041 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.432 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.7 Cg_endo -76.3 -37.15 1.52 Allowed 'Trans proline' 0 N--CA 1.486 1.065 0 O-C-N 122.586 0.782 . . . . 0.0 111.892 -178.018 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.67 HG21 ' CE2' ' A' ' 62' ' ' TYR . 88.2 m -59.85 -42.07 92.84 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 120.919 -1.113 . . . . 0.0 110.131 -179.579 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.704 HD13 ' HE2' ' A' ' 86' ' ' TYR . 2.4 mt -64.85 -39.07 92.98 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 119.387 -0.925 . . . . 0.0 109.577 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.0 -35.59 69.4 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.159 -0.963 . . . . 0.0 110.247 179.502 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -57.24 -36.33 70.8 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.056 -1.027 . . . . 0.0 110.389 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.528 ' CD2' HD22 ' A' ' 55' ' ' LEU . 15.5 m-85 -59.05 -39.64 82.64 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.07 -1.019 . . . . 0.0 110.525 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -59.45 -39.43 83.6 Favored 'General case' 0 N--CA 1.508 2.427 0 C-N-CA 119.362 -0.935 . . . . 0.0 110.42 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.431 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.1 mp -65.37 -41.78 92.04 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.341 0 C-N-CA 119.204 -0.998 . . . . 0.0 108.764 179.452 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.66 -50.83 40.31 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.209 -0.997 . . . . 0.0 108.443 178.617 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.054 HD11 HG23 ' A' ' 52' ' ' ILE . 5.2 tp -58.9 -34.53 71.78 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.25 -0.906 . . . . 0.0 109.502 178.404 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.08 -39.8 79.47 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 121.061 -1.025 . . . . 0.0 110.194 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -63.03 -51.12 67.97 Favored 'General case' 0 N--CA 1.507 2.403 0 C-N-CA 119.27 -0.972 . . . . 0.0 109.57 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.495 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -68.26 -38.71 82.03 Favored 'General case' 0 N--CA 1.505 2.314 0 C-N-CA 119.249 -0.98 . . . . 0.0 109.262 179.031 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -67.41 -34.04 76.42 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.207 -0.933 . . . . 0.0 110.117 179.293 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 9.2 mmtt -78.79 -38.03 39.44 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.0 -1.063 . . . . 0.0 110.293 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.8 t70 . . . . . 0 N--CA 1.509 2.515 0 O-C-N 121.06 -1.025 . . . . 0.0 110.162 179.833 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.497 1.923 0 CA-C-O 120.679 0.275 . . . . 0.0 110.406 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -56.87 -39.44 74.33 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 121.167 -0.958 . . . . 0.0 109.962 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -61.48 -40.53 94.86 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.238 -0.914 . . . . 0.0 109.766 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 49.7 tp60 -61.4 -40.54 94.74 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.147 -0.971 . . . . 0.0 109.848 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -60.01 -39.19 84.94 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.124 -0.985 . . . . 0.0 110.083 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.505 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.8 m0 -58.09 -37.03 73.74 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.011 -1.055 . . . . 0.0 110.023 179.603 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -60.59 -30.36 69.76 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.081 -1.012 . . . . 0.0 110.089 178.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 1.054 HG23 HD11 ' A' ' 30' ' ' LEU . 17.1 mt -72.27 -58.78 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.237 0 O-C-N 120.871 -1.143 . . . . 0.0 109.107 179.424 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.3 ptm -60.79 -29.53 69.5 Favored 'General case' 0 N--CA 1.509 2.515 0 C-N-CA 118.52 -1.272 . . . . 0.0 109.684 178.59 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -70.33 -38.91 74.98 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 120.904 -1.122 . . . . 0.0 108.931 177.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.528 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.3 mt -53.69 -31.53 48.29 Favored 'General case' 0 N--CA 1.512 2.642 0 O-C-N 121.058 -1.026 . . . . 0.0 110.3 178.821 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.451 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 3.9 t60 -57.13 -37.38 71.92 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.002 -1.062 . . . . 0.0 110.097 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.489 ' NE2' HD21 ' A' ' 91' ' ' LEU . 5.8 m170 -59.31 -48.67 80.77 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.006 -1.059 . . . . 0.0 109.457 179.044 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.6 tp60 -60.82 -37.27 81.43 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 119.34 -0.944 . . . . 0.0 109.071 178.755 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.434 ' HD2' ' CD2' ' A' ' 26' ' ' PHE . 11.5 mtp85 -66.36 -51.79 53.58 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.147 -0.971 . . . . 0.0 109.024 178.7 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.453 ' HA ' ' HB1' ' A' ' 87' ' ' ALA . 22.2 p -63.46 -38.78 92.45 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.241 -0.912 . . . . 0.0 109.177 179.156 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -65.18 -38.82 91.72 Favored 'General case' 0 N--CA 1.507 2.41 0 C-N-CA 119.242 -0.983 . . . . 0.0 109.25 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.67 ' CE2' HG21 ' A' ' 22' ' ' THR . 37.1 t80 -60.99 -49.8 75.99 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.155 -0.966 . . . . 0.0 109.313 179.441 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.63 HD12 ' HB2' ' A' ' 87' ' ' ALA . 87.7 mt -74.3 -41.76 50.63 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 C-N-CA 119.42 -0.912 . . . . 0.0 109.128 179.219 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.497 ' CD1' ' CD2' ' A' ' 68' ' ' TYR . 45.8 t80 -60.51 -35.38 75.83 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.259 -0.901 . . . . 0.0 109.653 178.873 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.401 ' HA ' ' CD ' ' A' ' 69' ' ' LYS . 79.7 m -74.52 -38.24 62.85 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.926 -1.109 . . . . 0.0 110.422 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.561 ' C ' HD12 ' A' ' 66' ' ' LEU . 3.7 pp -83.08 -30.86 27.66 Favored 'General case' 0 N--CA 1.505 2.288 0 C-N-CA 119.028 -1.069 . . . . 0.0 112.512 -179.046 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.482 ' N ' HD12 ' A' ' 66' ' ' LEU . 42.1 t80 -86.04 -33.25 21.07 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 120.634 -1.291 . . . . 0.0 111.724 -179.203 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.497 ' CD2' ' CD1' ' A' ' 64' ' ' TYR . 29.4 m-85 -97.4 -25.73 15.11 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.708 -1.245 . . . . 0.0 112.432 -178.774 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.401 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 4.6 mttt -113.37 -60.14 1.92 Allowed 'General case' 0 N--CA 1.501 2.078 0 O-C-N 120.659 -1.275 . . . . 0.0 111.131 -179.645 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.418 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 3.0 ttt85 -62.68 -31.06 71.88 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.127 -0.983 . . . . 0.0 110.641 -179.714 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.1 tttt 58.29 44.33 18.78 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 120.813 -1.18 . . . . 0.0 110.001 -179.635 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.33 36.36 3.59 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.358 -0.839 . . . . 0.0 109.891 179.238 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.79 HG13 HD23 ' A' ' 77' ' ' LEU . 14.2 tt -157.32 162.53 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.206 -0.934 . . . . 0.0 110.175 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.56 149.49 29.57 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.164 -0.96 . . . . 0.0 110.232 179.848 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.9 tttt -46.29 -32.35 3.06 Favored 'General case' 0 N--CA 1.515 2.807 0 O-C-N 121.362 -0.836 . . . . 0.0 111.584 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -63.1 -51.96 64.49 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.925 -1.109 . . . . 0.0 109.274 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.79 HD23 HG13 ' A' ' 73' ' ' ILE . 40.5 tp -65.04 -43.48 92.2 Favored 'General case' 0 N--CA 1.506 2.347 0 C-N-CA 119.141 -1.024 . . . . 0.0 108.559 178.905 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.71 ' HA ' HD12 ' A' ' 81' ' ' LEU . 14.0 t80 -60.99 -41.72 97.03 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.301 -0.875 . . . . 0.0 109.242 179.151 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -70.57 -42.69 70.77 Favored 'General case' 0 N--CA 1.503 2.221 0 C-N-CA 119.321 -0.951 . . . . 0.0 108.518 178.583 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.757 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 86.6 t90 -56.99 -35.19 68.89 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.338 -0.851 . . . . 0.0 109.519 178.526 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.71 HD12 ' HA ' ' A' ' 78' ' ' TYR . 13.4 mt -67.53 -57.94 5.6 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.084 -1.01 . . . . 0.0 109.081 179.077 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.417 ' CD1' ' CE1' ' A' ' 78' ' ' TYR . 0.5 OUTLIER -57.24 -27.22 27.45 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.685 0 C-N-CA 119.044 -1.063 . . . . 0.0 109.897 179.218 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -83.34 -20.42 34.35 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 120.885 -1.134 . . . . 0.0 111.391 179.399 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.437 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 16.5 mm-40 -107.21 22.97 15.17 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 120.652 -1.28 . . . . 0.0 111.989 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 8.1 tttp 74.44 78.45 0.12 Allowed 'General case' 0 N--CA 1.511 2.61 0 O-C-N 121.072 -1.017 . . . . 0.0 111.37 179.446 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.704 ' HE2' HD13 ' A' ' 23' ' ' LEU . 28.4 m-85 -136.52 -63.79 0.61 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.622 -0.674 . . . . 0.0 109.707 -179.781 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.63 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -128.5 -173.42 2.95 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.349 -0.844 . . . . 0.0 109.755 179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.451 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 7.8 t0 -126.18 102.57 7.26 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.151 -0.968 . . . . 0.0 110.53 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.6 mtmt -59.37 -38.48 80.57 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 121.184 -0.948 . . . . 0.0 109.95 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.665 HD23 HD13 ' A' ' 106' ' ' LEU . 26.0 tp -60.44 -41.71 94.62 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.194 -0.941 . . . . 0.0 109.864 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.495 ' N ' HD11 ' A' ' 106' ' ' LEU . 60.5 tp -67.01 -49.42 65.38 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.068 -1.02 . . . . 0.0 108.961 179.321 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.482 HG23 ' CE1' ' A' ' 64' ' ' TYR . 40.7 mt -56.81 -36.36 49.32 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.47 0 O-C-N 121.124 -0.985 . . . . 0.0 108.918 178.609 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.77 -39.64 94.79 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.121 -0.987 . . . . 0.0 109.082 178.224 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.436 ' HD2' ' CZ ' ' A' ' 100' ' ' TYR . 4.3 mmtt -59.32 -46.58 88.19 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.087 -1.008 . . . . 0.0 109.276 179.274 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.0 m0 -60.17 -37.54 80.48 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.247 -0.908 . . . . 0.0 110.111 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.6 mtp85 -75.14 -31.92 61.21 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.064 -1.023 . . . . 0.0 110.615 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -53.97 -176.9 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.699 0 O-C-N 121.014 -1.054 . . . . 0.0 110.572 179.754 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 2.4 m -102.89 133.38 48.08 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.183 -0.948 . . . . 0.0 109.751 179.217 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.39 9.09 57.08 Favored Glycine 0 N--CA 1.493 2.486 0 C-N-CA 120.152 -1.023 . . . . 0.0 111.242 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.486 ' HB3' HD23 ' A' ' 103' ' ' LEU . 51.4 m-85 -116.08 69.02 0.73 Allowed 'General case' 0 N--CA 1.495 1.801 0 CA-C-N 119.569 1.685 . . . . 0.0 109.971 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -97.29 -35.25 10.79 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.143 -0.973 . . . . 0.0 110.915 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.98 71.88 0.95 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.999 -1.063 . . . . 0.0 110.8 -179.611 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.486 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.3 pp -123.58 161.78 24.3 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.038 -1.039 . . . . 0.0 109.946 179.38 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.483 ' N ' HD12 ' A' ' 103' ' ' LEU . 26.8 p -120.48 -33.0 3.95 Favored 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -178.83 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.626 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.8 m -140.92 -168.39 2.59 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.067 -1.646 . . . . 0.0 110.162 179.51 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.665 HD13 HD23 ' A' ' 90' ' ' LEU . 13.2 mt -95.47 -39.4 10.0 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.235 -0.916 . . . . 0.0 109.909 178.934 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 9.3 ttm180 -101.15 27.23 6.28 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.913 -1.117 . . . . 0.0 110.271 178.174 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.626 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.287 1.8 t -124.82 14.38 8.6 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.054 -1.029 . . . . 0.0 109.213 -179.779 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.458 HG23 ' C ' ' A' ' 108' ' ' CYS . 1.0 OUTLIER -158.67 35.64 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.339 0 O-C-N 120.714 -1.241 . . . . 0.0 111.116 -178.8 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.59 ' O ' HG23 ' A' ' 119' ' ' THR . 12.3 mt-30 . . . . . 0 N--CA 1.5 2.038 0 O-C-N 120.604 -1.31 . . . . 0.0 111.498 -178.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.59 HG23 ' O ' ' A' ' 110' ' ' GLN . 2.8 m . . . . . 0 N--CA 1.494 1.763 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 46.7 t -101.49 155.55 18.01 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.259 -0.9 . . . . 0.0 109.785 179.698 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.815 HD12 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -71.64 -37.47 63.33 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.347 0 O-C-N 121.087 -1.008 . . . . 0.0 110.682 -179.554 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.463 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 9.2 p -52.82 -32.98 47.13 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 120.953 -1.092 . . . . 0.0 111.262 -178.773 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -33.19 68.71 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 120.907 -1.121 . . . . 0.0 109.852 178.34 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 48.4 t -81.11 125.73 78.85 Favored Pre-proline 0 N--CA 1.503 2.216 0 O-C-N 121.1 -1.0 . . . . 0.0 109.746 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.661 ' HD3' ' HB1' ' A' ' 154' ' ' ALA . 38.1 Cg_endo -65.91 172.02 9.04 Favored 'Trans proline' 0 N--CA 1.489 1.224 0 O-C-N 123.145 1.076 . . . . 0.0 110.815 179.696 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 5.1 tpt180 -75.07 -37.88 61.47 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.304 -0.873 . . . . 0.0 110.426 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.53 -40.28 78.45 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.071 -1.018 . . . . 0.0 110.107 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -69.41 -40.89 77.03 Favored 'General case' 0 N--CA 1.505 2.302 0 C-N-CA 119.344 -0.942 . . . . 0.0 109.333 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.663 ' O ' HG11 ' A' ' 140' ' ' VAL . 4.3 mt -67.14 -38.93 86.39 Favored 'General case' 0 N--CA 1.507 2.377 0 C-N-CA 119.494 -0.882 . . . . 0.0 109.591 179.254 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -65.96 -40.07 90.96 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.133 -0.98 . . . . 0.0 109.573 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.71 -39.64 94.66 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.165 -0.959 . . . . 0.0 109.791 179.551 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -60.41 -41.78 94.64 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.287 -0.883 . . . . 0.0 110.031 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.41 -40.63 91.69 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.223 -0.923 . . . . 0.0 110.025 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -60.16 -39.59 86.94 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.239 -0.913 . . . . 0.0 109.95 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -61.76 -34.92 76.71 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.247 -0.908 . . . . 0.0 110.697 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.14 19.24 19.93 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 120.948 -1.095 . . . . 0.0 111.942 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 53.35 41.47 62.7 Favored Glycine 0 N--CA 1.5 2.903 0 O-C-N 120.612 -1.305 . . . . 0.0 110.593 179.406 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.7 t -131.54 -163.49 1.33 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.091 -1.241 . . . . 0.0 109.969 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -142.1 140.78 32.61 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.131 -0.981 . . . . 0.0 110.494 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.663 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.4 p -131.87 161.2 41.69 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.186 -0.946 . . . . 0.0 109.886 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 33.2 t -167.59 83.25 0.21 Allowed 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.175 -0.953 . . . . 0.0 111.48 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.815 ' CG ' HD12 ' A' ' 121' ' ' ILE . 36.5 t80 -93.56 162.1 14.09 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.187 -0.946 . . . . 0.0 109.943 179.501 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -139.07 -59.51 0.59 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.417 -0.802 . . . . 0.0 109.379 179.129 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.82 152.14 51.51 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.324 -0.86 . . . . 0.0 109.384 179.179 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 145' ' ' CYS . . . . . 0.408 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 25.1 p -97.19 156.89 16.21 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.21 -0.931 . . . . 0.0 110.894 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 12.9 p -77.83 -22.18 13.84 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.509 0 O-C-N 121.337 -0.852 . . . . 0.0 111.872 -179.472 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 62.8 m170 -50.96 -57.88 7.44 Favored 'General case' 0 N--CA 1.516 2.839 0 O-C-N 120.834 -1.166 . . . . 0.0 109.9 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.505 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.8 p -128.78 -163.43 1.29 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.303 -0.873 . . . . 0.0 110.279 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.41 65.22 0.57 Allowed Glycine 0 N--CA 1.493 2.435 0 N-CA-C 108.036 -2.026 . . . . 0.0 108.036 178.405 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 37.3 t -104.59 147.36 27.71 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.31 -1.111 . . . . 0.0 110.297 -178.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 28.7 mtt85 -102.79 42.94 1.11 Allowed 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.327 -0.858 . . . . 0.0 109.482 179.237 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 77.06 96.72 0.19 Allowed Glycine 0 N--CA 1.487 2.08 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 22.7 p -111.53 128.42 56.02 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.23 -1.159 . . . . 0.0 110.554 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 154' ' ' ALA . . . . . 0.661 ' HB1' ' HD3' ' A' ' 125' ' ' PRO . . . -154.83 145.86 22.68 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.162 -0.962 . . . . 0.0 110.474 -179.735 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.632 0 O-C-N 121.199 -0.938 . . . . 0.0 110.349 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.676 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.51 2.539 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.405 ' HG2' HD13 ' A' ' 77' ' ' LEU . 45.2 Cg_endo -70.6 162.26 43.13 Favored 'Trans proline' 0 N--CA 1.487 1.13 0 O-C-N 123.335 1.177 . . . . 0.0 110.772 -179.744 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -48.53 -32.03 7.36 Favored 'General case' 0 N--CA 1.514 2.772 0 O-C-N 121.443 -0.786 . . . . 0.0 111.402 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.12 -34.0 38.74 Favored Glycine 0 N--CA 1.499 2.867 0 O-C-N 120.938 -1.101 . . . . 0.0 110.641 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.434 ' CE2' ' HG2' ' A' ' 20' ' ' LYS . 27.2 t80 -55.19 -32.4 62.17 Favored 'General case' 0 N--CA 1.511 2.585 0 O-C-N 120.882 -1.363 . . . . 0.0 110.795 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -53.15 -37.84 62.21 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 120.975 -1.078 . . . . 0.0 110.276 179.792 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.5 mmtt -59.56 -36.48 76.27 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.579 -0.848 . . . . 0.0 110.213 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.879 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.2 pt -120.79 35.6 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.175 -0.953 . . . . 0.0 110.602 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.434 ' HG2' ' CE2' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -85.22 -43.11 0.66 Allowed Pre-proline 0 N--CA 1.509 2.522 0 O-C-N 121.052 -1.03 . . . . 0.0 113.561 -178.892 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.1 Cg_endo -75.37 -35.86 2.66 Favored 'Trans proline' 0 N--CA 1.486 1.051 0 O-C-N 122.521 0.748 . . . . 0.0 112.007 -177.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.597 HG21 ' CE2' ' A' ' 62' ' ' TYR . 79.5 m -61.83 -46.38 89.75 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 120.982 -1.074 . . . . 0.0 109.945 -179.717 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.879 HD12 ' O ' ' A' ' 19' ' ' ILE . 5.0 mt -60.8 -37.2 81.13 Favored 'General case' 0 N--CA 1.507 2.397 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.812 179.512 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 72.6 m -57.22 -36.45 70.91 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 121.066 -1.021 . . . . 0.0 110.22 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -57.4 -38.82 74.93 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.06 -1.025 . . . . 0.0 110.081 179.794 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.641 ' CD2' HD22 ' A' ' 55' ' ' LEU . 15.0 m-85 -58.24 -40.03 80.67 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.094 -1.004 . . . . 0.0 110.131 179.697 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -59.18 -24.45 63.09 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.247 -0.908 . . . . 0.0 111.406 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.489 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.8 mp -77.96 -36.22 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.459 0 O-C-N 120.877 -1.14 . . . . 0.0 109.851 179.826 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.583 ' OE1' HD21 ' A' ' 55' ' ' LEU . 44.1 tt0 -80.73 -37.18 30.99 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.006 -1.058 . . . . 0.0 109.311 178.733 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.724 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -73.74 -31.84 63.55 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.134 -0.979 . . . . 0.0 110.164 179.023 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.401 ' CD ' ' HA ' ' A' ' 28' ' ' ILE . 6.0 ptm85 -71.3 -36.74 71.75 Favored 'General case' 0 N--CA 1.505 2.302 0 C-N-CA 118.738 -1.185 . . . . 0.0 109.724 179.257 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.42 -41.4 98.71 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.069 -1.052 . . . . 0.0 109.168 179.107 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.606 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -68.62 -43.13 77.04 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.221 -0.925 . . . . 0.0 109.05 179.053 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.84 -38.36 85.22 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.312 -0.868 . . . . 0.0 109.604 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -57.7 -34.49 69.5 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 121.125 -0.984 . . . . 0.0 110.467 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.6 t70 . . . . . 0 N--CA 1.511 2.608 0 O-C-N 121.078 -1.014 . . . . 0.0 110.335 179.893 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 68.4 m . . . . . 0 N--CA 1.497 1.895 0 CA-C-O 120.63 0.252 . . . . 0.0 110.392 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -55.54 -37.88 68.54 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.202 -0.936 . . . . 0.0 110.092 179.688 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -60.32 -39.73 88.07 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.269 -0.894 . . . . 0.0 109.998 179.72 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.4 tp60 -61.73 -40.9 96.73 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.157 -0.964 . . . . 0.0 109.819 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.477 HD23 HD12 ' A' ' 52' ' ' ILE . 16.9 mt -61.12 -37.86 84.31 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.243 -0.911 . . . . 0.0 110.146 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 49.3 m0 -58.8 -37.75 77.05 Favored 'General case' 0 N--CA 1.511 2.596 0 O-C-N 121.146 -0.971 . . . . 0.0 110.086 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -61.81 -31.02 71.22 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.038 -1.039 . . . . 0.0 109.83 178.614 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.724 HG23 ' CG ' ' A' ' 30' ' ' LEU . 79.3 mt -71.81 -59.25 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.272 0 O-C-N 121.078 -1.014 . . . . 0.0 109.047 179.238 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -60.86 -29.45 69.54 Favored 'General case' 0 N--CA 1.509 2.523 0 C-N-CA 118.626 -1.23 . . . . 0.0 109.948 178.882 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -70.15 -37.82 75.33 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 120.808 -1.182 . . . . 0.0 109.136 178.277 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.641 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.7 mt -54.35 -33.02 58.16 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.146 -0.971 . . . . 0.0 110.296 179.109 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.454 ' NE2' ' N ' ' A' ' 88' ' ' ASP . 5.5 t60 -55.67 -37.33 68.14 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 120.993 -1.067 . . . . 0.0 110.205 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.446 ' NE2' HD21 ' A' ' 91' ' ' LEU . 6.0 m170 -61.48 -49.81 75.28 Favored 'General case' 0 N--CA 1.507 2.412 0 C-N-CA 119.254 -0.978 . . . . 0.0 109.332 179.231 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -60.33 -38.51 83.97 Favored 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 119.346 -0.942 . . . . 0.0 109.074 178.626 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.449 ' CD ' ' CD2' ' A' ' 26' ' ' PHE . 9.3 mtp180 -64.42 -51.49 62.89 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.256 -0.902 . . . . 0.0 109.315 178.753 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.0 p -60.75 -37.5 82.02 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.198 -0.939 . . . . 0.0 109.61 179.486 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -64.78 -39.76 94.14 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.058 -1.026 . . . . 0.0 109.442 179.17 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.597 ' CE2' HG21 ' A' ' 22' ' ' THR . 26.6 t80 -61.58 -49.19 77.66 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.124 -0.985 . . . . 0.0 109.487 179.491 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.453 ' CG2' ' CD1' ' A' ' 78' ' ' TYR . 74.3 mt -73.34 -41.64 57.34 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.381 0 O-C-N 121.232 -0.918 . . . . 0.0 109.0 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.4 ' O ' ' HB2' ' A' ' 68' ' ' TYR . 66.3 t80 -62.64 -40.44 97.0 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.309 -0.869 . . . . 0.0 109.386 179.303 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 86.7 m -66.53 -40.83 89.32 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.997 -1.064 . . . . 0.0 110.477 -179.689 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.553 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.2 -32.76 26.37 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 120.922 -1.111 . . . . 0.0 112.643 -178.76 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.491 ' N ' HD12 ' A' ' 66' ' ' LEU . 35.3 t80 -86.28 -32.45 21.08 Favored 'General case' 0 N--CA 1.513 2.697 0 O-C-N 120.635 -1.291 . . . . 0.0 111.953 -178.955 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.4 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 10.3 m-85 -97.98 -18.19 18.76 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.632 -1.293 . . . . 0.0 112.674 -178.694 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.1 mttm -118.64 -58.92 1.92 Allowed 'General case' 0 N--CA 1.503 2.187 0 O-C-N 120.574 -1.329 . . . . 0.0 110.676 179.842 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.404 ' HB3' ' HA ' ' A' ' 66' ' ' LEU . 1.1 tpt180 -67.63 -29.25 68.51 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.204 -0.935 . . . . 0.0 110.984 -179.578 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.7 mttt 56.45 42.92 26.83 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 120.858 -1.151 . . . . 0.0 109.971 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.45 34.68 3.8 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.482 -0.761 . . . . 0.0 109.851 179.15 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.673 HG13 HD23 ' A' ' 77' ' ' LEU . 13.8 tt -152.52 162.6 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.197 -0.94 . . . . 0.0 109.753 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.0 m -108.36 144.81 35.41 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.106 -0.996 . . . . 0.0 110.434 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.4 tttp -45.9 -32.28 2.59 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.302 -0.874 . . . . 0.0 111.636 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.63 -49.67 75.65 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 120.861 -1.149 . . . . 0.0 109.312 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.673 HD23 HG13 ' A' ' 73' ' ' ILE . 37.0 tp -68.24 -44.54 75.45 Favored 'General case' 0 N--CA 1.506 2.348 0 C-N-CA 119.148 -1.021 . . . . 0.0 108.294 178.737 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.453 ' CD1' ' CG2' ' A' ' 63' ' ' ILE . 13.4 t80 -59.78 -37.51 79.28 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.369 -0.832 . . . . 0.0 109.471 179.091 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -71.33 -41.58 69.64 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 120.981 -1.074 . . . . 0.0 108.919 178.916 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.676 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 63.3 t90 -57.11 -39.59 75.38 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.172 -0.955 . . . . 0.0 109.512 179.095 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.49 HD23 ' CD2' ' A' ' 86' ' ' TYR . 3.7 mp -65.92 -50.85 62.96 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.222 -0.924 . . . . 0.0 109.183 179.127 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.9 mm -56.42 -34.62 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.658 0 O-C-N 121.121 -0.987 . . . . 0.0 110.02 179.509 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.7 mmtt -89.44 -5.8 57.06 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 120.947 -1.095 . . . . 0.0 112.526 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.436 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 45.9 mm-40 -114.99 24.16 11.95 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 120.447 -1.408 . . . . 0.0 112.05 -179.781 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.5 tttt 75.45 71.18 0.09 Allowed 'General case' 0 N--CA 1.512 2.657 0 O-C-N 121.159 -0.963 . . . . 0.0 111.724 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.586 ' HE2' HD13 ' A' ' 23' ' ' LEU . 27.2 m-85 -131.56 -62.48 0.87 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.468 -0.77 . . . . 0.0 109.255 179.29 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.443 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -136.49 175.92 9.17 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.49 -0.756 . . . . 0.0 109.528 179.438 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.454 ' N ' ' NE2' ' A' ' 56' ' ' HIS . 13.4 t0 -114.79 108.85 17.31 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.186 -0.946 . . . . 0.0 110.417 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 11.2 mtpp -59.02 -40.32 84.64 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.153 -0.967 . . . . 0.0 109.732 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.731 HD23 HD13 ' A' ' 106' ' ' LEU . 16.0 tp -60.08 -37.84 81.1 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.202 -0.936 . . . . 0.0 109.946 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.446 HD21 ' NE2' ' A' ' 57' ' ' HIS . 64.5 tp -68.82 -50.02 53.61 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.013 -1.054 . . . . 0.0 108.808 179.336 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 50.0 mt -57.85 -36.62 56.29 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.511 0 O-C-N 121.179 -0.951 . . . . 0.0 108.803 178.41 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.31 -39.7 89.47 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.178 -0.951 . . . . 0.0 109.244 178.537 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.453 ' HD2' ' CE2' ' A' ' 100' ' ' TYR . 7.0 mmtt -57.8 -46.1 85.13 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.088 -1.008 . . . . 0.0 109.395 179.313 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.1 m0 -58.24 -25.67 61.99 Favored 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 119.186 -1.006 . . . . 0.0 110.484 179.375 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.7 24.46 12.88 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 120.927 -1.108 . . . . 0.0 111.461 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.6 mmtt -92.52 -83.44 0.3 Allowed 'General case' 0 N--CA 1.505 2.284 0 O-C-N 120.694 -1.254 . . . . 0.0 109.897 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.439 HG23 ' O ' ' A' ' 98' ' ' THR . 5.9 t -177.52 128.88 0.15 Allowed 'General case' 0 N--CA 1.506 2.358 0 O-C-N 120.843 -1.161 . . . . 0.0 110.764 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.21 11.81 79.48 Favored Glycine 0 N--CA 1.492 2.376 0 C-N-CA 120.131 -1.033 . . . . 0.0 111.551 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.453 ' CE2' ' HD2' ' A' ' 94' ' ' LYS . 20.0 m-85 -100.5 46.88 0.94 Allowed 'General case' 0 N--CA 1.504 2.261 0 CA-C-N 119.746 1.773 . . . . 0.0 110.239 179.389 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -62.93 -39.96 96.19 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.163 -0.961 . . . . 0.0 109.539 179.586 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.421 ' HB2' ' OG ' ' A' ' 155' ' ' SER . 1.0 OUTLIER -111.94 100.45 8.9 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.215 -0.928 . . . . 0.0 109.684 179.358 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.925 HD13 HD13 ' A' ' 109' ' ' ILE . 9.6 tp -137.41 132.63 33.73 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.226 -0.921 . . . . 0.0 109.925 -179.385 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.442 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.0 p -109.5 -37.53 5.69 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.286 -0.883 . . . . 0.0 112.197 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.801 ' O ' HD11 ' A' ' 103' ' ' LEU . 7.4 m -140.57 -168.03 2.48 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 120.355 -1.466 . . . . 0.0 110.001 179.018 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.731 HD13 HD23 ' A' ' 90' ' ' LEU . 12.5 mt -97.41 -38.38 9.64 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.007 -1.058 . . . . 0.0 110.489 179.277 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 26.8 ttt85 -102.21 31.64 3.88 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 120.995 -1.066 . . . . 0.0 109.614 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.66 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.305 1.7 t -126.94 15.47 7.4 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.193 -0.942 . . . . 0.0 109.003 -179.279 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.925 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -158.59 36.87 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.361 0 O-C-N 120.799 -1.188 . . . . 0.0 110.844 -178.646 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.592 ' O ' HG23 ' A' ' 119' ' ' THR . 89.3 mt-30 . . . . . 0 N--CA 1.5 2.075 0 O-C-N 120.735 -1.228 . . . . 0.0 111.563 -178.673 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.592 HG23 ' O ' ' A' ' 110' ' ' GLN . 0.7 OUTLIER . . . . . 0 N--CA 1.497 1.918 0 CA-C-O 120.855 0.359 . . . . 0.0 110.353 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.401 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 44.4 t -105.02 155.26 19.13 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.409 -0.807 . . . . 0.0 109.575 179.394 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.802 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -70.47 -36.28 65.63 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 121.151 -0.968 . . . . 0.0 110.872 -179.374 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.455 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.9 p -54.83 -32.49 60.53 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 120.809 -1.182 . . . . 0.0 110.932 -179.153 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.465 ' HG3' HG22 ' A' ' 109' ' ' ILE . 0.0 OUTLIER -61.26 -34.87 75.87 Favored 'General case' 0 N--CA 1.509 2.525 0 O-C-N 120.986 -1.071 . . . . 0.0 109.415 178.047 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 48.4 t -79.84 126.0 81.0 Favored Pre-proline 0 N--CA 1.504 2.267 0 O-C-N 121.109 -0.994 . . . . 0.0 109.707 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.477 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.7 Cg_endo -65.65 172.3 8.3 Favored 'Trans proline' 0 N--CA 1.489 1.255 0 O-C-N 123.159 1.083 . . . . 0.0 110.795 179.676 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.1 -37.55 61.47 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.287 -0.883 . . . . 0.0 110.548 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.68 -41.0 80.71 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.071 -1.018 . . . . 0.0 110.044 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -69.48 -41.58 75.98 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.175 -0.953 . . . . 0.0 109.187 179.248 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.531 ' CD1' HD11 ' A' ' 121' ' ' ILE . 1.9 mt -65.86 -39.26 90.56 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.258 -0.901 . . . . 0.0 109.455 179.088 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -60.93 -39.69 90.42 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.199 -0.938 . . . . 0.0 109.829 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -59.62 -38.14 80.51 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.208 -0.933 . . . . 0.0 110.188 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -61.16 -44.61 97.04 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.209 -0.932 . . . . 0.0 109.929 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.27 -41.53 93.49 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.103 -0.998 . . . . 0.0 109.961 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.57 -35.37 72.26 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.187 -0.946 . . . . 0.0 110.322 179.652 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 21.3 mttm -71.74 -32.55 67.86 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.088 -1.007 . . . . 0.0 110.94 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 33.8 mttm -98.26 19.35 14.41 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.923 -1.111 . . . . 0.0 111.829 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 54.56 43.59 78.28 Favored Glycine 0 N--CA 1.498 2.825 0 O-C-N 120.591 -1.318 . . . . 0.0 110.502 179.372 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 7.3 t -142.88 -164.78 1.91 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.127 -1.219 . . . . 0.0 110.088 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.5 mp0 -138.25 149.57 45.87 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.193 -0.942 . . . . 0.0 110.407 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.429 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.5 p -131.86 161.49 41.19 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.165 -0.96 . . . . 0.0 109.949 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 29.1 t -165.79 88.88 0.41 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.164 -0.96 . . . . 0.0 111.167 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.766 ' CG ' HD12 ' A' ' 121' ' ' ILE . 47.1 t80 -97.58 159.9 14.65 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.317 -0.864 . . . . 0.0 110.239 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 68.8 m80 -137.11 -61.6 0.65 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.482 -0.761 . . . . 0.0 109.001 179.051 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -133.63 151.96 51.79 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.41 -0.806 . . . . 0.0 108.912 178.601 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 31.2 p -92.92 153.19 18.93 Favored 'General case' 0 N--CA 1.504 2.243 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.179 -179.462 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 27.0 m -71.64 -25.94 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 O-C-N 121.396 -0.815 . . . . 0.0 111.387 -179.603 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 63.2 m170 -50.65 -55.42 16.49 Favored 'General case' 0 N--CA 1.515 2.779 0 O-C-N 120.764 -1.21 . . . . 0.0 110.079 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 25.5 p -130.96 -165.64 1.59 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.276 -0.89 . . . . 0.0 110.566 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.77 56.61 0.76 Allowed Glycine 0 N--CA 1.493 2.457 0 N-CA-C 107.961 -2.056 . . . . 0.0 107.961 178.438 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 17.7 t -99.99 142.25 31.72 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.374 -1.074 . . . . 0.0 109.85 -179.225 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 5.2 mtt-85 -95.46 53.69 1.51 Allowed 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.301 -0.874 . . . . 0.0 109.593 179.27 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 64.5 96.68 0.02 OUTLIER Glycine 0 N--CA 1.487 2.087 0 N-CA-C 109.915 -1.274 . . . . 0.0 109.915 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 26.2 p -106.3 124.8 50.15 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.311 -1.111 . . . . 0.0 110.048 179.437 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -134.59 135.31 42.12 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.131 -0.981 . . . . 0.0 110.1 -179.397 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 155' ' ' SER . . . . . 0.421 ' OG ' ' HB2' ' A' ' 102' ' ' LYS . 0.7 OUTLIER . . . . . 0 N--CA 1.497 1.922 0 O-C-N 121.231 -0.918 . . . . 0.0 109.855 179.647 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.691 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.502 2.147 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.31 162.01 43.84 Favored 'Trans proline' 0 C--N 1.317 -1.109 0 O-C-N 123.335 1.176 . . . . 0.0 110.833 -179.421 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -48.79 -31.92 7.82 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.476 -0.765 . . . . 0.0 111.358 -179.828 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.5 -34.95 43.5 Favored Glycine 0 N--CA 1.498 2.825 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 179.776 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -55.95 -33.45 64.76 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 121.057 -1.261 . . . . 0.0 110.656 179.814 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -53.9 -37.94 64.29 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.085 -1.01 . . . . 0.0 110.149 179.693 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 44.1 mmtt -59.55 -37.38 78.26 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.268 -0.895 . . . . 0.0 110.045 179.504 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.738 HG22 ' OH ' ' A' ' 62' ' ' TYR . 2.1 pt -116.37 35.29 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.182 -0.949 . . . . 0.0 110.552 179.814 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.423 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 4.5 tttt -84.38 -42.89 0.73 Allowed Pre-proline 0 N--CA 1.509 2.491 0 O-C-N 121.136 -0.977 . . . . 0.0 113.334 -179.163 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.0 Cg_endo -75.44 -35.17 2.99 Favored 'Trans proline' 0 N--CA 1.486 1.073 0 O-C-N 122.467 0.72 . . . . 0.0 111.805 -178.138 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.547 HG21 ' CE2' ' A' ' 62' ' ' TYR . 85.4 m -61.62 -46.79 88.32 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 120.932 -1.105 . . . . 0.0 109.896 -179.875 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.714 HD13 ' HE2' ' A' ' 86' ' ' TYR . 6.1 mt -62.58 -39.61 94.24 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 119.4 -0.92 . . . . 0.0 109.605 179.446 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.7 m -57.62 -35.69 70.81 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 121.123 -0.985 . . . . 0.0 110.256 179.524 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -57.6 -36.42 71.72 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 121.089 -1.007 . . . . 0.0 110.287 179.756 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.717 ' CD2' HD22 ' A' ' 55' ' ' LEU . 16.7 m-85 -57.42 -39.98 77.34 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.062 -1.024 . . . . 0.0 110.323 179.994 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -60.38 -23.28 64.19 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.224 -0.922 . . . . 0.0 111.514 -179.668 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.538 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.8 mp -81.18 -34.2 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.347 0 O-C-N 120.776 -1.202 . . . . 0.0 109.738 179.655 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.6 tp60 -80.96 -36.32 31.02 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.948 -1.095 . . . . 0.0 109.453 178.752 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.726 ' CD2' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -75.12 -31.83 61.23 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.131 -0.981 . . . . 0.0 109.96 178.913 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -70.17 -36.15 74.48 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 120.865 -1.147 . . . . 0.0 109.745 179.196 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.33 -41.85 93.54 Favored 'General case' 0 N--CA 1.507 2.387 0 C-N-CA 119.145 -1.022 . . . . 0.0 109.329 179.407 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.59 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -69.06 -42.16 76.63 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.301 -0.874 . . . . 0.0 109.53 179.323 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -68.67 -30.89 69.67 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.344 -0.847 . . . . 0.0 110.435 179.575 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.1 mtpt -92.07 -31.46 15.54 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 120.99 -1.068 . . . . 0.0 111.088 -179.971 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.1 t70 . . . . . 0 N--CA 1.513 2.692 0 O-C-N 120.838 -1.164 . . . . 0.0 110.309 -179.972 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.502 2.128 0 CA-C-O 120.596 0.236 . . . . 0.0 110.693 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -58.0 -39.32 77.98 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 121.077 -1.014 . . . . 0.0 110.115 -179.935 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -59.68 -40.02 86.47 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.158 -0.964 . . . . 0.0 110.128 179.943 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 51.3 tp60 -59.5 -39.56 84.2 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.063 -1.023 . . . . 0.0 110.186 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 49' ' ' LEU . 12.5 mt -59.62 -39.66 85.01 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.137 -0.977 . . . . 0.0 110.181 -179.923 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.498 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.3 m0 -59.14 -37.19 76.68 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.186 -0.947 . . . . 0.0 110.164 179.827 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -59.94 -30.95 69.42 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.015 -1.053 . . . . 0.0 110.139 179.119 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.726 HG23 ' CD2' ' A' ' 30' ' ' LEU . 77.6 mt -71.28 -58.4 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.286 0 O-C-N 120.989 -1.069 . . . . 0.0 109.102 179.355 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.1 ptm -62.84 -29.94 71.12 Favored 'General case' 0 N--CA 1.507 2.408 0 C-N-CA 118.646 -1.221 . . . . 0.0 109.883 178.851 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.6 mm100 -69.43 -36.82 77.05 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.867 -1.146 . . . . 0.0 109.157 178.117 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.717 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.4 mt -53.24 -32.16 46.93 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.018 -1.052 . . . . 0.0 110.196 179.032 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.459 ' NE2' ' CB ' ' A' ' 88' ' ' ASP . 41.2 t60 -54.6 -39.76 68.18 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.09 -1.006 . . . . 0.0 110.07 179.859 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.428 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 4.9 m170 -62.41 -49.15 76.63 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.668 179.213 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -59.22 -36.23 75.05 Favored 'General case' 0 N--CA 1.508 2.438 0 C-N-CA 119.355 -0.938 . . . . 0.0 109.523 179.154 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.453 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -68.71 -52.09 34.58 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.085 -1.009 . . . . 0.0 108.761 178.769 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 91.7 p -61.21 -38.57 87.05 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.268 -0.895 . . . . 0.0 109.263 178.862 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 57.6 ttp85 -64.05 -38.49 91.26 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.094 -1.004 . . . . 0.0 109.456 179.028 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.738 ' OH ' HG22 ' A' ' 19' ' ' ILE . 48.1 t80 -60.31 -47.2 87.03 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.083 -1.011 . . . . 0.0 109.617 179.565 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.606 HD12 ' HB2' ' A' ' 87' ' ' ALA . 82.8 mt -77.77 -42.47 28.93 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.365 0 O-C-N 121.242 -0.911 . . . . 0.0 109.098 179.16 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.506 ' CE1' HG23 ' A' ' 92' ' ' ILE . 18.7 t80 -61.35 -23.37 65.7 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.354 -0.841 . . . . 0.0 110.659 179.01 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 97.2 m -91.02 -38.78 12.59 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.643 -1.286 . . . . 0.0 110.198 179.831 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.517 ' C ' HD12 ' A' ' 66' ' ' LEU . 3.5 pp -83.04 -30.28 28.19 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.893 -1.13 . . . . 0.0 111.924 -179.429 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.464 ' HD2' HG23 ' A' ' 73' ' ' ILE . 39.9 t80 -86.25 -35.96 19.68 Favored 'General case' 0 N--CA 1.511 2.591 0 O-C-N 120.573 -1.329 . . . . 0.0 111.467 -179.81 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.419 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 15.1 m-85 -94.08 -29.88 14.96 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.828 -1.17 . . . . 0.0 112.422 -178.158 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.8 mtpp -105.52 -59.46 1.76 Allowed 'General case' 0 N--CA 1.504 2.268 0 O-C-N 120.684 -1.26 . . . . 0.0 110.42 -179.81 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.407 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 29.9 ttt85 -57.13 -33.27 67.21 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 121.109 -0.994 . . . . 0.0 110.366 -179.996 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.6 mttt 57.47 45.84 18.99 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.887 -1.133 . . . . 0.0 110.328 179.965 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -111.11 -57.17 2.28 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.372 -0.83 . . . . 0.0 109.38 179.289 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.786 HG13 HD23 ' A' ' 77' ' ' LEU . 15.1 tt -56.17 162.21 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.574 0 O-C-N 121.443 -0.786 . . . . 0.0 110.121 179.533 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.8 t -111.62 149.76 31.06 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.07 -1.019 . . . . 0.0 109.921 179.106 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.39 -32.71 1.42 Allowed 'General case' 0 N--CA 1.517 2.902 0 O-C-N 121.282 -0.886 . . . . 0.0 111.984 -179.709 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -61.68 -50.94 70.48 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 120.941 -1.099 . . . . 0.0 109.36 179.635 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.786 HD23 HG13 ' A' ' 73' ' ' ILE . 52.1 tp -67.96 -42.88 80.22 Favored 'General case' 0 N--CA 1.506 2.345 0 C-N-CA 119.139 -1.024 . . . . 0.0 108.466 178.727 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.709 ' HA ' HD12 ' A' ' 81' ' ' LEU . 21.8 t80 -60.1 -38.54 83.28 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.324 -0.86 . . . . 0.0 109.479 178.869 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -70.58 -42.67 70.74 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.067 -1.021 . . . . 0.0 108.73 178.745 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.691 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 72.0 t90 -59.03 -38.41 79.24 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.262 -0.899 . . . . 0.0 109.545 178.926 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.709 HD12 ' HA ' ' A' ' 78' ' ' TYR . 11.8 mt -64.86 -51.27 62.95 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.167 -0.958 . . . . 0.0 109.519 179.365 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.4 mm -57.75 -33.13 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.592 0 O-C-N 121.169 -0.957 . . . . 0.0 110.102 179.645 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -89.23 -9.03 52.27 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 120.898 -1.126 . . . . 0.0 112.437 -179.862 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.438 ' HB2' ' CE1' ' A' ' 86' ' ' TYR . 4.3 mm-40 -111.16 22.11 15.6 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 120.449 -1.407 . . . . 0.0 111.974 -179.984 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.4 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 0.0 OUTLIER 74.94 73.58 0.1 Allowed 'General case' 0 N--CA 1.51 2.562 0 O-C-N 121.031 -1.043 . . . . 0.0 111.66 179.451 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.714 ' HE2' HD13 ' A' ' 23' ' ' LEU . 32.6 m-85 -134.2 -62.8 0.74 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.557 -0.715 . . . . 0.0 109.215 179.456 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.606 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -131.16 163.04 28.59 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.478 -0.764 . . . . 0.0 109.248 179.313 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.459 ' CB ' ' NE2' ' A' ' 56' ' ' HIS . 30.7 t0 -111.27 118.27 35.43 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.084 -1.01 . . . . 0.0 110.314 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -57.67 -35.76 71.02 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 121.34 -0.85 . . . . 0.0 110.194 179.72 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.423 HD12 ' HA ' ' A' ' 90' ' ' LEU . 7.9 tp -60.68 -38.51 85.19 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.121 -0.987 . . . . 0.0 109.684 179.481 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.691 HD12 ' CZ3' ' A' ' 95' ' ' TRP . 0.3 OUTLIER -66.56 -56.71 9.5 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.085 -1.009 . . . . 0.0 108.829 179.078 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.506 HG23 ' CE1' ' A' ' 64' ' ' TYR . 38.8 mt -61.0 -33.74 57.03 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.416 0 C-N-CA 119.339 -0.944 . . . . 0.0 109.165 178.851 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.24 -41.1 86.2 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 120.985 -1.072 . . . . 0.0 109.239 178.854 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.474 ' HB3' HD22 ' A' ' 103' ' ' LEU . 10.0 mmtm -57.62 -44.25 85.38 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.177 -0.952 . . . . 0.0 109.49 179.387 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.691 ' CZ3' HD12 ' A' ' 91' ' ' LEU . 2.3 m0 -59.05 -26.37 64.54 Favored 'General case' 0 N--CA 1.508 2.44 0 C-N-CA 119.148 -1.021 . . . . 0.0 110.786 179.165 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.18 -35.51 25.43 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 120.736 -1.227 . . . . 0.0 110.671 179.587 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -51.1 175.79 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.803 0 O-C-N 121.025 -1.047 . . . . 0.0 110.831 179.89 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 60.8 m -103.79 138.83 39.85 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.168 -0.957 . . . . 0.0 109.487 179.219 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 103.47 -29.15 12.87 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.84 -1.304 . . . . 0.0 109.84 -178.881 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -94.43 58.16 2.37 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.867 -1.372 . . . . 0.0 109.898 179.658 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -73.0 -38.76 66.49 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.026 -1.046 . . . . 0.0 109.864 179.717 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.01 73.86 1.05 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.157 -0.964 . . . . 0.0 110.143 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.474 HD22 ' HB3' ' A' ' 94' ' ' LYS . 1.1 pp -110.1 148.77 31.1 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.068 -1.02 . . . . 0.0 110.149 179.941 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.428 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.7 p -110.21 -30.08 7.89 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.238 -0.914 . . . . 0.0 112.997 -179.727 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.625 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.3 m -143.56 -168.13 2.75 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 120.256 -1.527 . . . . 0.0 109.884 179.159 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.425 HD23 ' HA ' ' A' ' 106' ' ' LEU . 44.4 mt -96.73 -38.14 10.02 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.088 -1.007 . . . . 0.0 110.066 178.986 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 18.0 ttp180 -102.45 30.56 4.53 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 120.972 -1.08 . . . . 0.0 109.826 178.051 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.625 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.304 1.8 t -128.65 18.43 6.27 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.11 -0.994 . . . . 0.0 108.97 -179.575 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.469 HG23 ' C ' ' A' ' 108' ' ' CYS . 1.7 pt -156.39 36.81 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.158 0 O-C-N 120.78 -1.2 . . . . 0.0 110.493 -178.631 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.503 ' C ' HG23 ' A' ' 119' ' ' THR . 9.5 tt0 . . . . . 0 N--CA 1.51 2.554 0 O-C-N 120.995 -1.066 . . . . 0.0 110.788 -178.854 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.503 HG23 ' C ' ' A' ' 110' ' ' GLN . 7.1 m . . . . . 0 N--CA 1.494 1.774 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 41.5 t -82.21 153.93 25.7 Favored 'General case' 0 N--CA 1.501 2.109 0 C-N-CA 119.321 -0.952 . . . . 0.0 108.802 178.766 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.71 HG23 ' CE1' ' A' ' 142' ' ' PHE . 14.1 tt -81.11 -29.33 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 O-C-N 121.047 -1.033 . . . . 0.0 112.448 -178.787 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.489 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 14.4 p -53.97 -35.14 61.47 Favored 'General case' 0 N--CA 1.512 2.647 0 O-C-N 120.707 -1.246 . . . . 0.0 110.658 -178.736 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -58.54 -26.85 63.98 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.118 -0.988 . . . . 0.0 109.836 177.707 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 48.9 t -73.89 118.24 67.74 Favored Pre-proline 0 N--CA 1.509 2.48 0 O-C-N 120.866 -1.146 . . . . 0.0 110.584 179.975 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.473 ' HB3' ' HB1' ' A' ' 154' ' ' ALA . 37.4 Cg_endo -64.79 168.11 14.15 Favored 'Trans proline' 0 N--CA 1.489 1.224 0 O-C-N 123.026 1.013 . . . . 0.0 110.553 178.611 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.18 -38.81 60.67 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.203 -0.935 . . . . 0.0 110.189 179.971 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.28 -40.65 82.48 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.034 -1.041 . . . . 0.0 110.053 -179.811 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 -67.08 -41.1 86.96 Favored 'General case' 0 N--CA 1.507 2.42 0 C-N-CA 119.359 -0.936 . . . . 0.0 109.399 179.46 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.478 ' O ' HG11 ' A' ' 140' ' ' VAL . 5.4 mt -64.27 -40.66 96.43 Favored 'General case' 0 N--CA 1.507 2.389 0 C-N-CA 119.446 -0.902 . . . . 0.0 109.552 179.318 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.68 -39.91 86.1 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.16 -0.962 . . . . 0.0 109.936 179.78 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -60.93 -40.02 91.67 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.148 -0.97 . . . . 0.0 109.964 179.781 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -62.19 -41.92 98.8 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.201 -0.937 . . . . 0.0 109.872 179.797 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.558 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -61.37 -41.6 97.34 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.215 -0.928 . . . . 0.0 109.886 179.955 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 6.9 mmt85 -59.65 -38.55 81.72 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.143 -0.973 . . . . 0.0 109.991 179.658 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 13.9 mttp -61.63 -35.68 78.61 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.18 -0.95 . . . . 0.0 110.567 -179.902 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -105.45 21.68 16.77 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.007 -1.058 . . . . 0.0 111.836 -179.913 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.39 46.06 58.14 Favored Glycine 0 N--CA 1.498 2.812 0 O-C-N 120.641 -1.287 . . . . 0.0 110.773 179.315 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.558 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 9.5 t -138.74 -165.31 1.8 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.113 -1.228 . . . . 0.0 110.189 179.747 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.4 mp0 -133.34 167.72 19.88 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.188 -0.945 . . . . 0.0 110.471 -179.896 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.478 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.6 p -159.82 161.14 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.041 0 O-C-N 121.336 -0.853 . . . . 0.0 110.646 -179.981 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 38.8 t -169.05 113.92 0.57 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.18 -0.95 . . . . 0.0 111.256 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.71 ' CE1' HG23 ' A' ' 121' ' ' ILE . 85.1 t80 -102.97 158.79 16.04 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.234 -0.916 . . . . 0.0 110.156 179.586 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 15.2 m80 -137.17 -61.54 0.65 Allowed 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.822 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -148.01 149.33 31.93 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.576 -0.702 . . . . 0.0 109.247 178.81 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 145' ' ' CYS . . . . . 0.462 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 26.3 p -93.67 155.24 17.37 Favored 'General case' 0 N--CA 1.505 2.275 0 C-N-CA 119.038 -1.065 . . . . 0.0 110.813 -179.485 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.9 p -71.86 -25.15 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.493 0 O-C-N 121.287 -0.883 . . . . 0.0 111.77 -179.252 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 61.2 m170 -50.25 -59.78 3.62 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 120.832 -1.168 . . . . 0.0 110.171 -179.898 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.498 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.8 p -126.95 -165.11 1.42 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.213 -0.929 . . . . 0.0 110.491 179.424 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 149' ' ' GLY . . . . . 0.441 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.51 60.99 0.65 Allowed Glycine 0 N--CA 1.492 2.38 0 N-CA-C 107.945 -2.062 . . . . 0.0 107.945 178.3 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 16.9 t -99.15 138.69 35.9 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.353 -1.087 . . . . 0.0 109.64 -179.182 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.63 49.45 1.03 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.23 -0.919 . . . . 0.0 109.882 179.398 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 75.16 93.58 0.16 Allowed Glycine 0 N--CA 1.488 2.156 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 179.757 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.4 p -104.83 127.25 52.58 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.237 -1.154 . . . . 0.0 109.665 179.107 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 154' ' ' ALA . . . . . 0.473 ' HB1' ' HB3' ' A' ' 125' ' ' PRO . . . -153.98 149.51 27.31 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.052 -1.03 . . . . 0.0 110.554 -179.057 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.502 2.141 0 O-C-N 121.269 -0.895 . . . . 0.0 110.422 179.949 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.737 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.503 2.212 0 CA-C-O 120.466 0.174 . . . . 0.0 110.62 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -74.02 161.11 41.79 Favored 'Trans proline' 0 N--CA 1.485 1.0 0 O-C-N 123.192 1.101 . . . . 0.0 110.611 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -49.15 -31.81 8.97 Favored 'General case' 0 N--CA 1.515 2.815 0 O-C-N 121.431 -0.793 . . . . 0.0 111.318 -179.82 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.2 -33.37 45.42 Favored Glycine 0 N--CA 1.499 2.851 0 O-C-N 121.031 -1.043 . . . . 0.0 110.635 179.855 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -54.18 -32.01 54.32 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 120.962 -1.317 . . . . 0.0 110.766 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -54.93 -37.34 66.29 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 121.037 -1.04 . . . . 0.0 110.242 179.868 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.8 mtpp -57.68 -35.39 70.52 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.152 -0.968 . . . . 0.0 110.359 179.588 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.726 HD12 HD11 ' A' ' 23' ' ' LEU . 3.1 pt -116.26 36.73 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.15 -0.969 . . . . 0.0 110.428 179.592 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.441 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -82.53 -43.03 0.95 Allowed Pre-proline 0 N--CA 1.508 2.459 0 O-C-N 121.078 -1.014 . . . . 0.0 113.003 -179.436 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.441 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.2 Cg_endo -76.14 -34.73 2.74 Favored 'Trans proline' 0 N--CA 1.486 1.07 0 O-C-N 122.571 0.774 . . . . 0.0 111.875 -178.366 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.959 HG21 ' CE2' ' A' ' 62' ' ' TYR . 91.4 m -61.3 -47.99 83.41 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.885 -1.135 . . . . 0.0 109.833 -179.762 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.726 HD11 HD12 ' A' ' 19' ' ' ILE . 7.8 mt -62.07 -40.21 95.03 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.465 179.555 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.426 ' O ' HD12 ' A' ' 28' ' ' ILE . 7.7 m -57.56 -35.41 70.31 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.155 -0.966 . . . . 0.0 110.187 179.229 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -56.72 -37.9 71.62 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.041 -1.037 . . . . 0.0 110.128 179.691 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.59 ' CD2' HD22 ' A' ' 55' ' ' LEU . 14.1 m-85 -58.69 -39.05 79.64 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.101 -1.0 . . . . 0.0 110.284 179.965 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -59.81 -40.14 87.38 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.17 -0.956 . . . . 0.0 110.362 -179.512 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.429 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.2 mp -65.65 -42.07 91.94 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.376 0 C-N-CA 119.12 -1.032 . . . . 0.0 108.668 179.48 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.7 tp60 -68.03 -50.99 51.99 Favored 'General case' 0 N--CA 1.506 2.337 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 178.494 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.11 HD11 HG23 ' A' ' 52' ' ' ILE . 5.6 tp -59.09 -36.28 74.84 Favored 'General case' 0 N--CA 1.509 2.516 0 C-N-CA 119.546 -0.861 . . . . 0.0 109.471 178.403 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.6 mtt85 -57.93 -37.79 74.73 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.124 -0.985 . . . . 0.0 110.333 179.675 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -62.74 -50.42 71.14 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.094 -1.003 . . . . 0.0 109.748 -179.636 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.544 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -71.46 -40.0 70.58 Favored 'General case' 0 N--CA 1.503 2.188 0 C-N-CA 118.829 -1.149 . . . . 0.0 108.827 178.796 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -62.1 -32.7 73.28 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.21 -0.931 . . . . 0.0 110.246 179.207 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.3 mtpt -96.42 -35.85 11.02 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 120.934 -1.104 . . . . 0.0 111.065 -179.818 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 . . . . . 0 N--CA 1.511 2.612 0 O-C-N 120.955 -1.09 . . . . 0.0 110.359 179.975 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 5.6 m . . . . . 0 N--CA 1.503 2.187 0 CA-C-O 120.525 0.202 . . . . 0.0 110.578 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.417 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 34.7 m120 -60.28 -45.03 94.75 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.126 -0.984 . . . . 0.0 109.828 179.937 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -60.16 -44.89 94.65 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.144 -0.973 . . . . 0.0 109.708 179.867 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.56 -43.78 92.85 Favored 'General case' 0 N--CA 1.506 2.375 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.272 179.29 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 20.6 mt -61.46 -35.65 78.21 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.332 -0.855 . . . . 0.0 110.185 179.818 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.51 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 49.4 m0 -58.7 -39.28 80.31 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 120.962 -1.086 . . . . 0.0 109.742 179.762 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -62.16 -31.25 71.72 Favored 'General case' 0 N--CA 1.504 2.257 0 C-N-CA 119.144 -1.022 . . . . 0.0 109.715 178.409 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 1.11 HG23 HD11 ' A' ' 30' ' ' LEU . 17.8 mt -71.81 -58.19 5.68 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.145 0 O-C-N 120.93 -1.106 . . . . 0.0 109.157 179.298 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.0 ptm -61.48 -29.58 70.06 Favored 'General case' 0 N--CA 1.508 2.458 0 C-N-CA 118.57 -1.252 . . . . 0.0 109.787 178.81 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -69.11 -38.17 78.78 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 120.793 -1.192 . . . . 0.0 109.009 178.078 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.59 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.1 mt -53.34 -32.05 47.33 Favored 'General case' 0 N--CA 1.513 2.681 0 O-C-N 120.951 -1.093 . . . . 0.0 110.163 178.963 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.467 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 67.6 t60 -56.19 -38.9 71.6 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.061 -1.025 . . . . 0.0 110.24 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.405 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 7.4 m170 -60.13 -47.99 83.61 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.103 -0.998 . . . . 0.0 109.449 179.361 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -60.38 -35.88 76.77 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.262 -0.899 . . . . 0.0 109.651 178.974 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.441 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -64.97 -49.11 71.61 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.045 -1.034 . . . . 0.0 109.615 179.385 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.7 p -62.77 -38.56 91.09 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.139 -0.976 . . . . 0.0 109.409 179.329 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 19.5 ttt85 -63.13 -40.31 97.22 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.064 -1.022 . . . . 0.0 109.342 179.281 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.959 ' CE2' HG21 ' A' ' 22' ' ' THR . 43.0 t80 -62.35 -50.87 69.86 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.181 -0.949 . . . . 0.0 109.379 179.506 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.748 HD12 ' HB2' ' A' ' 87' ' ' ALA . 86.9 mt -69.5 -39.53 78.67 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.345 0 C-N-CA 119.271 -0.972 . . . . 0.0 109.126 179.351 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 9.5 t80 -64.48 -42.39 95.92 Favored 'General case' 0 N--CA 1.503 2.216 0 C-N-CA 119.409 -0.917 . . . . 0.0 109.055 179.022 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.417 ' HA ' ' CD ' ' A' ' 69' ' ' LYS . 87.4 m -60.89 -42.01 97.14 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.055 -1.028 . . . . 0.0 110.5 -179.575 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.581 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.29 -33.16 26.03 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 118.923 -1.111 . . . . 0.0 112.759 -178.766 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.498 ' N ' HD12 ' A' ' 66' ' ' LEU . 51.0 t80 -86.32 -32.43 21.04 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 120.599 -1.313 . . . . 0.0 111.734 -179.363 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -98.38 -16.75 19.17 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 120.827 -1.171 . . . . 0.0 112.713 -178.872 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.417 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 4.8 mttt -124.15 -59.31 1.5 Allowed 'General case' 0 N--CA 1.501 2.114 0 O-C-N 120.46 -1.4 . . . . 0.0 111.008 179.79 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.413 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 4.8 tpt180 -61.87 -30.21 70.71 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.147 -0.971 . . . . 0.0 110.825 -179.649 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.2 tttp 57.87 42.05 23.75 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 120.754 -1.216 . . . . 0.0 110.093 -179.592 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.38 35.72 3.88 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.369 -0.832 . . . . 0.0 109.952 179.303 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.825 HG13 HD23 ' A' ' 77' ' ' LEU . 14.0 tt -154.64 162.37 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 O-C-N 121.214 -0.929 . . . . 0.0 109.905 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.8 m -110.02 147.82 32.83 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.172 -0.955 . . . . 0.0 110.18 179.791 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.9 ttmt -45.42 -32.27 2.06 Favored 'General case' 0 N--CA 1.516 2.835 0 O-C-N 121.401 -0.812 . . . . 0.0 111.656 -179.971 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -62.25 -50.99 69.54 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 120.938 -1.101 . . . . 0.0 109.3 179.559 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.825 HD23 HG13 ' A' ' 73' ' ' ILE . 50.1 tp -65.63 -46.03 80.82 Favored 'General case' 0 N--CA 1.505 2.306 0 C-N-CA 119.106 -1.038 . . . . 0.0 108.481 178.959 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.434 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 18.8 t80 -59.8 -38.98 83.47 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.276 -0.89 . . . . 0.0 109.545 179.224 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -72.73 -42.14 64.41 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.112 -0.993 . . . . 0.0 108.971 178.933 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.737 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 83.0 t90 -57.48 -37.27 72.64 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.218 -0.927 . . . . 0.0 109.717 179.091 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.777 HD22 ' CD2' ' A' ' 86' ' ' TYR . 62.9 mt -68.5 -48.12 65.22 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.19 -0.944 . . . . 0.0 108.981 179.149 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.456 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 34.4 mm -56.01 -33.36 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.56 0 O-C-N 121.206 -0.934 . . . . 0.0 109.941 179.374 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -89.29 -16.23 31.65 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.004 -1.06 . . . . 0.0 112.082 179.929 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.451 ' HB2' ' CE1' ' A' ' 86' ' ' TYR . 8.4 mm-40 -102.88 21.61 15.29 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.547 -1.345 . . . . 0.0 112.05 -179.829 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 17.1 tttp 75.54 72.04 0.09 Allowed 'General case' 0 N--CA 1.511 2.599 0 O-C-N 121.201 -0.937 . . . . 0.0 111.735 179.443 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.777 ' CD2' HD22 ' A' ' 81' ' ' LEU . 33.9 m-85 -134.2 -62.89 0.74 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.519 -0.738 . . . . 0.0 109.119 179.267 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.748 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -129.09 160.15 33.72 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.507 -0.745 . . . . 0.0 109.4 179.243 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.467 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 8.2 t70 -107.61 115.25 29.82 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.035 -1.041 . . . . 0.0 110.346 -179.866 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -58.64 -37.22 75.47 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.255 -0.903 . . . . 0.0 110.03 179.668 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.482 HD23 HD22 ' A' ' 106' ' ' LEU . 7.1 tp -60.79 -38.79 86.5 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.124 -0.985 . . . . 0.0 109.601 179.504 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.598 HD12 ' CZ3' ' A' ' 95' ' ' TRP . 0.3 OUTLIER -65.13 -55.54 18.1 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.094 -1.004 . . . . 0.0 108.856 179.155 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 57.7 mt -61.67 -36.97 76.75 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.41 0 C-N-CA 119.401 -0.919 . . . . 0.0 109.038 178.974 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.74 -39.3 90.99 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.164 -0.96 . . . . 0.0 109.428 178.891 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.43 ' HD2' ' CE1' ' A' ' 100' ' ' TYR . 12.8 mmtm -59.36 -43.94 92.78 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.115 -0.99 . . . . 0.0 109.635 179.543 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.598 ' CZ3' HD12 ' A' ' 91' ' ' LEU . 2.9 m0 -63.86 -33.86 76.65 Favored 'General case' 0 N--CA 1.51 2.526 0 C-N-CA 119.311 -0.956 . . . . 0.0 110.343 179.461 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.54 -30.49 29.69 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.043 -1.036 . . . . 0.0 110.993 179.722 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -54.15 -176.57 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.68 0 O-C-N 120.912 -1.118 . . . . 0.0 110.601 179.87 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -104.16 136.54 43.59 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.16 -0.962 . . . . 0.0 109.874 179.296 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 94.09 13.17 55.28 Favored Glycine 0 N--CA 1.494 2.501 0 C-N-CA 120.295 -0.955 . . . . 0.0 110.938 -179.418 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.584 ' HB3' HD23 ' A' ' 103' ' ' LEU . 49.6 m-85 -120.14 71.34 0.9 Allowed 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 119.322 1.561 . . . . 0.0 110.003 179.748 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -92.84 -36.66 12.71 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.08 -1.012 . . . . 0.0 110.474 179.89 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.28 76.94 1.52 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.051 -1.031 . . . . 0.0 110.698 -179.854 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.584 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.2 pp -122.58 147.34 46.52 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.06 -1.025 . . . . 0.0 109.957 179.536 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.405 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.6 p -111.58 -32.06 6.8 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 119.491 -0.884 . . . . 0.0 112.988 -179.447 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.617 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.1 m -142.22 -168.15 2.65 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 120.26 -1.525 . . . . 0.0 110.156 179.246 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.482 HD22 HD23 ' A' ' 90' ' ' LEU . 44.2 mt -95.97 -38.26 10.31 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.153 -0.967 . . . . 0.0 110.021 179.018 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 18.0 ttt85 -102.46 30.83 4.37 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.958 -1.089 . . . . 0.0 109.721 178.109 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.617 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.311 1.8 t -130.51 20.07 5.19 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.168 -0.958 . . . . 0.0 108.746 -179.429 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.492 HG22 ' HD3' ' A' ' 123' ' ' ARG . 2.1 pt -156.63 38.17 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 O-C-N 120.938 -1.101 . . . . 0.0 110.107 -178.574 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.784 ' C ' HG23 ' A' ' 119' ' ' THR . 31.0 mt-30 . . . . . 0 N--CA 1.508 2.474 0 O-C-N 120.953 -1.092 . . . . 0.0 110.869 -178.639 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.784 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.6 m . . . . . 0 N--CA 1.5 2.03 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.439 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 43.0 t -70.27 153.23 43.3 Favored 'General case' 0 N--CA 1.501 2.087 0 C-N-CA 118.895 -1.122 . . . . 0.0 108.244 178.527 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.941 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -70.41 -31.74 47.78 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.391 0 O-C-N 121.072 -1.017 . . . . 0.0 111.523 -178.667 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.5 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.4 p -60.95 -35.98 78.18 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 120.701 -1.249 . . . . 0.0 110.28 -179.8 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.492 ' HD3' HG22 ' A' ' 109' ' ' ILE . 23.5 tpt85 -57.31 -36.93 71.71 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 120.905 -1.122 . . . . 0.0 109.603 178.539 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 49.1 t -75.13 119.5 77.23 Favored Pre-proline 0 N--CA 1.505 2.302 0 O-C-N 121.204 -0.935 . . . . 0.0 109.85 179.718 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -64.43 178.9 1.43 Allowed 'Trans proline' 0 N--CA 1.488 1.188 0 O-C-N 123.133 1.07 . . . . 0.0 110.768 179.584 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.7 mmm-85 -74.99 -37.53 61.85 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.193 -0.942 . . . . 0.0 110.596 -179.784 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.46 -40.61 83.14 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.071 -1.018 . . . . 0.0 109.968 -179.867 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -69.92 -41.49 74.56 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 119.382 -0.927 . . . . 0.0 109.266 179.246 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.501 HD11 HD11 ' A' ' 121' ' ' ILE . 11.1 mt -65.34 -38.69 90.87 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.272 -0.893 . . . . 0.0 109.576 179.188 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -60.98 -38.75 87.07 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.179 -0.951 . . . . 0.0 109.924 179.653 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.26 -36.21 72.91 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.148 -0.97 . . . . 0.0 110.416 179.845 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -63.77 -49.42 73.02 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.182 -0.949 . . . . 0.0 109.807 179.973 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.496 ' HB1' ' CA ' ' A' ' 139' ' ' GLN . . . -61.25 -38.25 86.01 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.122 -0.986 . . . . 0.0 109.84 179.733 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 15.6 mtp85 -61.69 -36.24 80.32 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.114 -0.991 . . . . 0.0 110.12 179.562 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 6.7 mttm -87.13 -34.96 18.9 Favored 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.029 -1.044 . . . . 0.0 110.747 179.798 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -82.48 -35.99 26.92 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 120.987 -1.07 . . . . 0.0 110.667 179.776 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.87 34.78 8.09 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.804 -1.319 . . . . 0.0 109.804 -179.861 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.9 t -131.17 23.14 4.85 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.992 -1.299 . . . . 0.0 111.531 179.702 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 139' ' ' GLN . . . . . 0.496 ' CA ' ' HB1' ' A' ' 133' ' ' ALA . 5.2 mt-30 48.62 -179.06 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.862 -1.149 . . . . 0.0 111.928 179.462 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.7 p -174.07 159.28 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.307 0 O-C-N 121.051 -1.031 . . . . 0.0 110.698 -179.841 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 41.5 t -171.98 92.5 0.13 Allowed 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.219 -0.926 . . . . 0.0 110.939 179.787 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.941 ' CD1' HD12 ' A' ' 121' ' ' ILE . 80.8 t80 -99.79 158.9 15.46 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.24 -0.912 . . . . 0.0 110.724 -179.881 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -139.46 -61.33 0.55 Allowed 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 178.615 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 1.6 pm0 -137.67 150.81 47.65 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.49 -0.756 . . . . 0.0 108.972 178.621 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 145' ' ' CYS . . . . . 0.411 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.4 p -91.99 153.88 19.16 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.973 -1.08 . . . . 0.0 111.034 -179.735 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.3 p -72.4 -23.4 21.21 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.416 0 C-N-CA 119.733 -0.787 . . . . 0.0 111.51 -179.76 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 59.0 m170 -51.55 -60.6 2.96 Favored 'General case' 0 N--CA 1.514 2.746 0 O-C-N 120.711 -1.243 . . . . 0.0 110.044 179.921 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.51 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 21.6 p -125.8 -164.11 1.28 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.265 -0.897 . . . . 0.0 110.395 179.327 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -101.64 61.53 0.55 Allowed Glycine 0 N--CA 1.492 2.384 0 N-CA-C 107.958 -2.057 . . . . 0.0 107.958 178.202 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 18.9 t -100.32 146.38 27.02 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.293 -1.122 . . . . 0.0 109.866 -179.13 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 6.7 ttm-85 -100.42 45.65 0.97 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.254 -0.904 . . . . 0.0 109.566 179.349 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 74.08 97.03 0.1 OUTLIER Glycine 0 N--CA 1.486 2.015 0 N-CA-C 109.806 -1.318 . . . . 0.0 109.806 179.993 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 26.3 p -109.47 125.74 52.77 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.275 -1.132 . . . . 0.0 110.133 179.606 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -144.79 144.93 31.41 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.088 -1.008 . . . . 0.0 110.181 -179.414 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.503 2.18 0 O-C-N 121.235 -0.916 . . . . 0.0 111.025 -179.824 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.655 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.514 2.728 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -70.97 160.43 49.38 Favored 'Trans proline' 0 C--N 1.316 -1.152 0 O-C-N 123.314 1.165 . . . . 0.0 110.831 -179.538 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -48.72 -32.06 7.87 Favored 'General case' 0 N--CA 1.515 2.816 0 O-C-N 121.384 -0.822 . . . . 0.0 111.403 -179.718 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.63 -33.27 41.12 Favored Glycine 0 N--CA 1.498 2.773 0 O-C-N 121.011 -1.055 . . . . 0.0 110.653 179.751 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.445 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 16.6 t80 -55.3 -34.23 63.96 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 120.939 -1.33 . . . . 0.0 110.701 179.888 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -55.17 -37.22 66.74 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 121.05 -1.031 . . . . 0.0 110.239 179.727 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.3 mtpt -57.65 -35.51 70.62 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.237 -0.915 . . . . 0.0 110.319 179.604 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.894 HD12 HD11 ' A' ' 23' ' ' LEU . 3.2 pt -115.25 36.33 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 O-C-N 121.186 -0.947 . . . . 0.0 110.328 179.548 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.445 ' HD2' ' CE2' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -84.98 -42.93 0.67 Allowed Pre-proline 0 N--CA 1.511 2.59 0 O-C-N 121.149 -0.969 . . . . 0.0 113.509 -179.143 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.8 Cg_endo -75.06 -37.23 2.09 Favored 'Trans proline' 0 N--CA 1.488 1.188 0 O-C-N 122.63 0.805 . . . . 0.0 111.921 -177.828 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.756 HG21 ' CE2' ' A' ' 62' ' ' TYR . 70.6 m -61.32 -43.38 98.96 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.019 -1.051 . . . . 0.0 110.139 -179.569 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.894 HD11 HD12 ' A' ' 19' ' ' ILE . 34.1 mt -65.07 -40.18 94.32 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.219 -0.926 . . . . 0.0 109.58 179.746 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -34.17 69.2 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.107 -0.995 . . . . 0.0 110.276 179.337 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -56.72 -36.36 69.62 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.004 -1.06 . . . . 0.0 110.288 179.628 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.742 ' CD1' HD22 ' A' ' 55' ' ' LEU . 26.2 m-85 -57.2 -39.89 76.33 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.098 -1.001 . . . . 0.0 110.325 179.866 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -60.06 -23.63 63.92 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.316 -0.865 . . . . 0.0 111.483 -179.461 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.568 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.7 mp -81.19 -34.72 13.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.426 0 O-C-N 120.767 -1.208 . . . . 0.0 109.727 179.623 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.429 ' OE1' HD21 ' A' ' 55' ' ' LEU . 25.3 tt0 -82.53 -36.21 26.56 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 120.951 -1.093 . . . . 0.0 109.179 178.543 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.726 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -74.18 -31.65 62.75 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.134 -0.979 . . . . 0.0 110.054 178.864 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -69.56 -36.71 76.57 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 120.808 -1.183 . . . . 0.0 109.911 179.419 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -64.19 -42.09 96.82 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.104 -1.038 . . . . 0.0 109.168 179.277 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.589 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -68.43 -41.95 79.59 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.272 -0.893 . . . . 0.0 109.096 178.964 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -59.41 -35.13 73.4 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.226 -0.922 . . . . 0.0 110.218 179.579 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -82.79 -39.73 21.39 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.009 -1.057 . . . . 0.0 110.147 179.818 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.6 t0 . . . . . 0 N--CA 1.509 2.49 0 O-C-N 121.214 -0.929 . . . . 0.0 109.959 179.681 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.0 m . . . . . 0 N--CA 1.497 1.888 0 CA-C-O 120.676 0.274 . . . . 0.0 110.501 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -56.25 -38.36 71.02 Favored 'General case' 0 N--CA 1.511 2.599 0 O-C-N 121.138 -0.976 . . . . 0.0 110.06 179.884 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -62.01 -40.84 97.05 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.211 -0.931 . . . . 0.0 109.804 179.773 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 48.9 tp60 -62.21 -40.49 96.26 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.183 -0.948 . . . . 0.0 109.782 179.805 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.442 HD23 ' HA ' ' A' ' 49' ' ' LEU . 12.6 mt -59.32 -39.28 82.61 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.142 -0.974 . . . . 0.0 110.092 179.87 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.482 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.8 m0 -61.17 -36.22 79.24 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.114 -0.991 . . . . 0.0 110.149 179.86 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.96 -31.21 68.52 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.988 -1.07 . . . . 0.0 110.107 178.871 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.726 HG23 ' CG ' ' A' ' 30' ' ' LEU . 79.6 mt -72.08 -60.29 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.286 0 O-C-N 120.921 -1.112 . . . . 0.0 108.816 179.148 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 5.6 ptm -61.67 -29.32 70.0 Favored 'General case' 0 N--CA 1.508 2.443 0 C-N-CA 118.771 -1.171 . . . . 0.0 109.685 178.568 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -70.39 -38.32 74.65 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.832 -1.168 . . . . 0.0 109.001 178.307 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.742 HD22 ' CD1' ' A' ' 26' ' ' PHE . 11.7 mt -53.72 -33.39 55.42 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.057 -1.027 . . . . 0.0 110.067 178.959 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.471 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 38.4 t60 -54.63 -38.79 67.28 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 120.961 -1.087 . . . . 0.0 109.943 179.816 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.427 ' CD2' HD21 ' A' ' 91' ' ' LEU . 5.2 m170 -59.15 -46.14 89.14 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.152 -0.967 . . . . 0.0 109.321 179.354 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 -61.64 -37.36 83.71 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.406 -0.917 . . . . 0.0 109.272 178.93 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.442 ' HG2' ' CE1' ' A' ' 26' ' ' PHE . 3.5 mmm-85 -64.51 -50.46 67.29 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.125 -0.984 . . . . 0.0 109.216 178.999 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 89.4 p -62.82 -40.11 96.39 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.197 -0.939 . . . . 0.0 109.193 179.455 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 12.5 ttm-85 -64.72 -38.25 90.34 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.127 -0.983 . . . . 0.0 109.399 178.995 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.756 ' CE2' HG21 ' A' ' 22' ' ' THR . 37.7 t80 -60.61 -48.69 80.66 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.094 -1.004 . . . . 0.0 109.583 179.542 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.728 HD12 ' HB2' ' A' ' 87' ' ' ALA . 84.7 mt -76.51 -42.25 35.32 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.338 0 O-C-N 121.222 -0.924 . . . . 0.0 108.875 179.119 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.463 ' CE1' HG23 ' A' ' 92' ' ' ILE . 44.4 t80 -61.44 -22.74 65.31 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.402 -0.811 . . . . 0.0 110.507 178.824 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 86.9 m -90.73 -36.0 14.56 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.609 -1.307 . . . . 0.0 110.503 179.955 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.548 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.6 pp -82.9 -32.3 27.37 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.898 -1.126 . . . . 0.0 112.343 -179.179 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.491 ' N ' HD12 ' A' ' 66' ' ' LEU . 34.3 t80 -86.21 -37.87 18.21 Favored 'General case' 0 N--CA 1.512 2.648 0 O-C-N 120.738 -1.226 . . . . 0.0 111.299 -179.375 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.408 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 12.9 m-85 -89.68 -21.63 22.64 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.977 -1.077 . . . . 0.0 112.548 -178.647 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.6 mttm -119.87 -60.71 1.68 Allowed 'General case' 0 N--CA 1.501 2.104 0 O-C-N 120.489 -1.382 . . . . 0.0 111.153 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.41 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 31.8 ttt85 -60.38 -30.33 69.51 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.079 -1.013 . . . . 0.0 110.92 -179.464 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.1 tttt 57.5 42.04 25.03 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.859 -1.15 . . . . 0.0 110.025 -179.462 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -111.93 35.31 3.76 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.342 -0.849 . . . . 0.0 109.87 179.219 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.781 HG13 HD23 ' A' ' 77' ' ' LEU . 13.6 tt -156.14 162.1 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.214 -0.929 . . . . 0.0 109.913 -179.956 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 40.5 m -108.78 149.56 28.88 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.117 -0.989 . . . . 0.0 110.211 179.967 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.0 tttt -46.83 -32.08 3.48 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.307 -0.871 . . . . 0.0 111.462 -179.972 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.19 -50.6 71.14 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 120.893 -1.129 . . . . 0.0 109.39 179.521 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.781 HD23 HG13 ' A' ' 73' ' ' ILE . 38.0 tp -66.9 -44.3 81.17 Favored 'General case' 0 N--CA 1.505 2.301 0 C-N-CA 119.108 -1.037 . . . . 0.0 108.488 178.856 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.653 ' HA ' HD12 ' A' ' 81' ' ' LEU . 17.5 t80 -60.24 -38.64 84.05 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.305 -0.872 . . . . 0.0 109.425 178.933 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -72.75 -42.7 63.78 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.04 -1.037 . . . . 0.0 108.656 178.495 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.655 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 75.0 t90 -57.68 -37.13 72.91 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.271 -0.893 . . . . 0.0 109.576 178.825 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.653 HD12 ' HA ' ' A' ' 78' ' ' TYR . 12.7 mt -67.6 -51.44 50.27 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.18 -0.95 . . . . 0.0 109.113 179.178 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 36.3 mm -57.34 -31.64 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.507 0 O-C-N 121.246 -0.909 . . . . 0.0 110.228 179.559 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -89.26 -13.13 38.81 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 120.907 -1.12 . . . . 0.0 112.222 -179.804 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.441 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 76.4 mm-40 -108.84 23.12 15.0 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 120.535 -1.353 . . . . 0.0 111.977 -179.879 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.65 74.18 0.11 Allowed 'General case' 0 N--CA 1.512 2.671 0 O-C-N 121.188 -0.945 . . . . 0.0 111.71 179.227 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.496 ' HE2' HD13 ' A' ' 23' ' ' LEU . 32.0 m-85 -134.05 -62.94 0.75 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.512 -0.743 . . . . 0.0 109.22 179.433 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.728 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -131.2 163.06 28.56 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.472 -0.768 . . . . 0.0 109.418 179.315 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.471 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 8.3 t0 -107.93 108.65 19.89 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.091 -1.006 . . . . 0.0 110.417 -179.911 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -58.7 -37.54 76.32 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.249 -0.907 . . . . 0.0 110.19 179.742 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.626 HD23 HD13 ' A' ' 106' ' ' LEU . 18.4 tp -59.03 -39.01 80.63 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.102 -0.999 . . . . 0.0 110.19 -179.973 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.587 ' HA ' HD21 ' A' ' 106' ' ' LEU . 58.4 tp -71.02 -45.5 63.8 Favored 'General case' 0 N--CA 1.505 2.29 0 C-N-CA 119.123 -1.031 . . . . 0.0 108.884 179.318 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.463 HG23 ' CE1' ' A' ' 64' ' ' TYR . 20.6 mt -60.91 -39.09 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.384 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 178.358 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.77 -39.88 95.57 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.116 -0.99 . . . . 0.0 109.355 178.741 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.552 ' HB3' HD22 ' A' ' 103' ' ' LEU . 13.5 mmtm -59.54 -47.73 84.4 Favored 'General case' 0 N--CA 1.51 2.575 0 O-C-N 121.137 -0.977 . . . . 0.0 109.287 179.455 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.6 m0 -59.68 -35.18 73.96 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.364 -0.835 . . . . 0.0 110.244 179.549 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.429 ' HD2' ' OH ' ' A' ' 64' ' ' TYR . 8.9 mtp85 -81.94 -33.02 30.53 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.112 -0.992 . . . . 0.0 110.757 179.76 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 7.9 mmtt -51.82 178.01 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.782 0 O-C-N 121.007 -1.058 . . . . 0.0 110.851 -179.855 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 28.5 m -105.38 140.43 38.5 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.252 -0.905 . . . . 0.0 109.395 179.188 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.88 -22.85 37.84 Favored Glycine 0 N--CA 1.494 2.534 0 C-N-CA 119.709 -1.234 . . . . 0.0 110.465 -179.26 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.649 ' HB3' HD23 ' A' ' 103' ' ' LEU . 70.0 m-85 -91.22 58.43 3.68 Favored 'General case' 0 N--CA 1.505 2.277 0 CA-C-N 119.181 1.49 . . . . 0.0 110.056 179.831 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -66.6 -36.08 81.75 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.076 -1.015 . . . . 0.0 110.272 179.891 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.1 mmmt -127.95 97.36 4.77 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.054 -1.029 . . . . 0.0 110.819 -179.708 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.649 HD23 ' HB3' ' A' ' 100' ' ' TYR . 2.2 pp -134.64 136.62 42.98 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.111 -0.993 . . . . 0.0 109.983 179.24 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.427 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.9 p -103.9 -28.42 11.6 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.193 -0.942 . . . . 0.0 112.337 -179.787 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.705 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 14.3 m -145.46 -166.63 2.48 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.301 -1.499 . . . . 0.0 109.547 178.955 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.626 HD13 HD23 ' A' ' 90' ' ' LEU . 25.6 mt -99.0 -45.84 5.81 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.111 -0.993 . . . . 0.0 109.63 178.613 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 61.8 ttt-85 -93.42 -1.67 55.5 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 120.977 -1.077 . . . . 0.0 111.498 178.911 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.705 ' HB2' ' HB2' ' A' ' 105' ' ' CYS . 1.6 t -83.04 -48.13 10.94 Favored 'General case' 0 N--CA 1.512 2.635 0 N-CA-C 105.331 -2.1 . . . . 0.0 105.331 178.61 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.787 ' O ' HG21 ' A' ' 119' ' ' THR . 14.4 pt -76.13 -25.21 16.69 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.553 0 O-C-N 121.208 -0.933 . . . . 0.0 110.83 177.568 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.469 ' C ' HG23 ' A' ' 119' ' ' THR . 7.1 mt-30 . . . . . 0 N--CA 1.494 1.744 0 O-C-N 121.004 -1.06 . . . . 0.0 110.127 -179.767 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.787 HG21 ' O ' ' A' ' 109' ' ' ILE . 0.3 OUTLIER . . . . . 0 N--CA 1.495 1.804 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 . . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.408 ' HB3' ' O ' ' A' ' 108' ' ' CYS . 34.3 t -58.72 153.91 15.76 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.172 -0.955 . . . . 0.0 109.87 179.802 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.799 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -72.87 -34.53 46.78 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.394 0 O-C-N 121.126 -0.984 . . . . 0.0 111.217 -179.207 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.493 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 12.3 p -55.64 -33.82 64.39 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 120.817 -1.177 . . . . 0.0 111.165 -178.788 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 6.6 ttp85 -59.56 -35.15 73.7 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 120.882 -1.136 . . . . 0.0 109.55 178.382 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 58.7 t -79.95 125.19 82.43 Favored Pre-proline 0 N--CA 1.503 2.18 0 O-C-N 121.121 -0.987 . . . . 0.0 109.653 179.468 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.595 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.3 Cg_endo -65.12 177.12 2.66 Favored 'Trans proline' 0 N--CA 1.488 1.155 0 O-C-N 123.104 1.055 . . . . 0.0 110.814 179.734 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 3.8 tpp85 -75.01 -38.12 61.64 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.257 -0.902 . . . . 0.0 110.529 -179.818 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.18 -40.67 82.08 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.066 -1.021 . . . . 0.0 110.031 -179.946 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 14.8 tm0? -69.94 -42.28 73.46 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.21 -0.931 . . . . 0.0 109.17 179.25 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.595 HD12 ' O ' ' A' ' 125' ' ' PRO . 8.2 mt -65.5 -38.44 89.72 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 119.526 -0.869 . . . . 0.0 109.464 179.08 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -59.81 -38.53 82.22 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.113 -0.992 . . . . 0.0 110.013 179.563 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -58.44 -37.29 75.11 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.133 -0.98 . . . . 0.0 110.379 179.895 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -60.19 -43.38 95.96 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.091 -1.006 . . . . 0.0 110.041 -179.969 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.682 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -61.91 -45.79 92.16 Favored 'General case' 0 N--CA 1.509 2.487 0 C-N-CA 119.305 -0.958 . . . . 0.0 109.726 179.875 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 3.3 mmt85 -58.19 -34.28 70.18 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.207 -0.933 . . . . 0.0 110.373 179.618 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -76.73 -31.42 57.13 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.116 -0.99 . . . . 0.0 110.914 179.919 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 42.0 mttt -98.73 23.93 8.16 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 120.812 -1.18 . . . . 0.0 111.642 -179.9 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.71 47.02 53.68 Favored Glycine 0 N--CA 1.5 2.905 0 O-C-N 120.696 -1.252 . . . . 0.0 110.717 179.212 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.682 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.7 t -153.47 -171.06 3.78 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.087 -1.243 . . . . 0.0 110.726 179.822 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -123.65 176.77 6.03 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.232 -0.917 . . . . 0.0 110.241 -179.831 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.2 p -158.89 161.17 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.193 -0.942 . . . . 0.0 110.765 -179.953 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 31.6 t -166.3 97.62 0.6 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.325 -0.859 . . . . 0.0 110.971 -179.999 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.728 ' CG ' HD12 ' A' ' 121' ' ' ILE . 59.4 t80 -101.08 158.65 15.85 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.295 -0.878 . . . . 0.0 110.483 -179.87 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -137.59 -60.51 0.65 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.437 -0.789 . . . . 0.0 109.102 179.04 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -138.0 149.13 45.82 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.374 -0.829 . . . . 0.0 109.139 178.793 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 145' ' ' CYS . . . . . 0.425 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.3 p -88.88 154.98 19.81 Favored 'General case' 0 N--CA 1.507 2.397 0 C-N-CA 119.112 -1.035 . . . . 0.0 111.033 -179.553 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.1 p -74.89 -23.78 17.71 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.327 0 O-C-N 121.318 -0.864 . . . . 0.0 111.678 -179.382 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 62.7 m170 -52.01 -61.5 2.22 Favored 'General case' 0 N--CA 1.515 2.791 0 O-C-N 120.659 -1.276 . . . . 0.0 110.115 -179.933 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.482 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.9 p -125.61 -167.12 1.65 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.224 -0.923 . . . . 0.0 110.404 179.711 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -97.79 66.93 0.8 Allowed Glycine 0 N--CA 1.493 2.47 0 N-CA-C 108.076 -2.009 . . . . 0.0 108.076 178.54 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 36.7 t -102.97 144.18 31.58 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.305 -1.115 . . . . 0.0 110.111 -179.165 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 32.5 mtp85 -99.29 48.39 0.95 Allowed 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.156 -0.965 . . . . 0.0 109.38 178.993 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.17 96.39 0.05 OUTLIER Glycine 0 N--CA 1.486 1.994 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 -179.814 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 22.8 p -109.17 127.88 54.57 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.151 -1.205 . . . . 0.0 110.339 179.72 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -141.96 141.99 32.96 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.115 -0.991 . . . . 0.0 109.863 -179.734 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.499 1.98 0 O-C-N 121.252 -0.905 . . . . 0.0 110.563 -179.801 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.655 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.5 2.071 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -68.36 164.24 33.35 Favored 'Trans proline' 0 C--N 1.317 -1.131 0 O-C-N 123.282 1.148 . . . . 0.0 110.94 -179.772 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -48.11 -31.65 5.85 Favored 'General case' 0 N--CA 1.516 2.825 0 O-C-N 121.484 -0.76 . . . . 0.0 111.544 -179.739 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.76 -36.15 40.3 Favored Glycine 0 N--CA 1.498 2.8 0 O-C-N 120.898 -1.126 . . . . 0.0 110.548 179.887 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.601 ' HB2' HD11 ' A' ' 77' ' ' LEU . 23.0 t80 -57.48 -34.18 68.76 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.983 -1.304 . . . . 0.0 110.504 179.76 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -52.58 -36.64 56.47 Favored 'General case' 0 N--CA 1.513 2.697 0 O-C-N 120.912 -1.117 . . . . 0.0 110.212 179.743 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.9 mtmt -58.56 -36.09 73.37 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.216 -0.927 . . . . 0.0 110.259 179.534 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.865 HD12 HD11 ' A' ' 23' ' ' LEU . 1.7 pt -120.7 35.01 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 O-C-N 121.109 -0.995 . . . . 0.0 110.77 179.881 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.436 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.7 OUTLIER -83.7 -43.33 0.8 Allowed Pre-proline 0 N--CA 1.51 2.557 0 O-C-N 121.031 -1.043 . . . . 0.0 113.313 -179.085 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.436 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.5 Cg_endo -75.37 -35.24 3.0 Favored 'Trans proline' 0 N--CA 1.486 1.044 0 O-C-N 122.6 0.789 . . . . 0.0 111.903 -178.094 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.732 HG21 ' CE2' ' A' ' 62' ' ' TYR . 88.6 m -60.16 -43.26 95.94 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 120.95 -1.094 . . . . 0.0 110.1 -179.738 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.865 HD11 HD12 ' A' ' 19' ' ' ILE . 5.9 mt -65.95 -41.16 91.61 Favored 'General case' 0 N--CA 1.507 2.418 0 C-N-CA 119.472 -0.891 . . . . 0.0 109.355 179.512 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.17 -34.63 72.34 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.259 -0.9 . . . . 0.0 110.077 179.277 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -58.49 -36.72 74.19 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.145 -0.972 . . . . 0.0 110.349 179.869 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.693 ' CD2' HD22 ' A' ' 55' ' ' LEU . 11.6 m-85 -55.78 -41.47 74.11 Favored 'General case' 0 N--CA 1.512 2.634 0 O-C-N 120.905 -1.122 . . . . 0.0 109.869 179.56 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -58.24 -25.98 62.35 Favored 'General case' 0 N--CA 1.506 2.352 0 C-N-CA 119.302 -0.959 . . . . 0.0 110.501 179.05 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 15.2 mm -68.41 -52.23 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.342 0 O-C-N 120.923 -1.111 . . . . 0.0 109.162 179.488 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -66.89 -42.47 85.45 Favored 'General case' 0 N--CA 1.508 2.451 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.018 179.31 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.686 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -64.69 -35.53 81.35 Favored 'General case' 0 N--CA 1.506 2.358 0 C-N-CA 119.44 -0.904 . . . . 0.0 109.106 178.744 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.71 -40.38 83.54 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.082 -1.011 . . . . 0.0 109.997 179.582 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -62.55 -47.74 82.57 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.202 -0.937 . . . . 0.0 109.717 -179.957 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.652 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -69.05 -40.24 78.65 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.164 -0.96 . . . . 0.0 109.278 179.213 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 41.4 mm-40 -67.57 -31.69 71.93 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.248 -0.907 . . . . 0.0 110.398 179.465 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.2 mmmt -92.89 -34.66 13.72 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 120.861 -1.149 . . . . 0.0 110.736 179.965 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 . . . . . 0 N--CA 1.51 2.572 0 O-C-N 121.017 -1.052 . . . . 0.0 110.153 179.836 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.9 t . . . . . 0 N--CA 1.496 1.852 0 CA-C-O 120.694 0.283 . . . . 0.0 110.508 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.7 m-20 -55.12 -38.29 68.0 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.094 -1.004 . . . . 0.0 110.036 179.763 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -59.8 -38.31 81.58 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.274 -0.891 . . . . 0.0 110.144 179.708 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -64.47 -40.71 96.22 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.113 -0.992 . . . . 0.0 109.925 179.947 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.463 HD23 HD12 ' A' ' 52' ' ' ILE . 24.8 mt -67.85 -35.78 79.17 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.223 -0.923 . . . . 0.0 110.344 179.899 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 47.1 m0 -58.79 -37.82 77.16 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.003 -1.06 . . . . 0.0 110.019 179.879 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -62.96 -32.17 73.44 Favored 'General case' 0 N--CA 1.504 2.235 0 C-N-CA 119.074 -1.05 . . . . 0.0 109.494 178.425 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.686 HG23 ' CG ' ' A' ' 30' ' ' LEU . 68.6 mt -71.83 -59.04 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.232 0 O-C-N 120.91 -1.119 . . . . 0.0 108.999 179.216 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -60.69 -29.11 69.12 Favored 'General case' 0 N--CA 1.511 2.605 0 C-N-CA 118.483 -1.287 . . . . 0.0 109.918 178.9 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.4 mm-40 -68.75 -37.9 79.72 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 120.846 -1.159 . . . . 0.0 109.138 178.215 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.693 HD22 ' CD2' ' A' ' 26' ' ' PHE . 10.9 mt -53.74 -32.18 51.22 Favored 'General case' 0 N--CA 1.511 2.6 0 O-C-N 120.92 -1.112 . . . . 0.0 110.375 179.026 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.444 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 17.6 t60 -56.62 -37.0 70.09 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.004 -1.06 . . . . 0.0 110.302 179.91 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.495 ' NE2' HD21 ' A' ' 91' ' ' LEU . 5.5 m170 -61.41 -51.13 70.04 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.141 -0.974 . . . . 0.0 109.458 179.407 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -57.98 -35.92 71.88 Favored 'General case' 0 N--CA 1.509 2.478 0 C-N-CA 119.377 -0.929 . . . . 0.0 109.715 179.206 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.435 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -65.48 -50.27 65.95 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.102 -0.999 . . . . 0.0 109.353 179.272 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 60.7 p -62.24 -39.12 91.77 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.097 -1.002 . . . . 0.0 109.209 179.24 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -63.78 -37.39 87.2 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.292 -0.963 . . . . 0.0 109.416 179.001 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.732 ' CE2' HG21 ' A' ' 22' ' ' THR . 36.0 t80 -61.0 -50.6 72.71 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.154 -0.966 . . . . 0.0 109.344 179.504 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.64 HD12 ' HB2' ' A' ' 87' ' ' ALA . 92.0 mt -74.5 -41.91 49.23 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 C-N-CA 119.329 -0.949 . . . . 0.0 108.872 179.193 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.435 ' OH ' ' NH1' ' A' ' 96' ' ' ARG . 58.6 t80 -59.77 -36.21 76.21 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.3 -0.875 . . . . 0.0 109.821 179.032 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 76.2 m -75.04 -38.77 61.34 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.943 -1.098 . . . . 0.0 110.356 180.0 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.529 ' C ' HD12 ' A' ' 66' ' ' LEU . 3.5 pp -83.23 -31.47 26.99 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.85 -1.156 . . . . 0.0 112.142 -179.275 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.472 ' HD2' HG23 ' A' ' 73' ' ' ILE . 40.8 t80 -86.4 -41.47 14.44 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 120.658 -1.277 . . . . 0.0 111.874 -179.575 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -90.39 -26.36 19.94 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 120.89 -1.131 . . . . 0.0 112.818 -177.723 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.42 ' HE2' ' CD2' ' A' ' 64' ' ' TYR . 0.7 OUTLIER -109.11 -58.2 2.06 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.673 -1.267 . . . . 0.0 110.668 -179.988 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.418 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 8.1 tpt180 -58.32 -33.58 69.66 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.015 -1.053 . . . . 0.0 110.364 179.721 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.7 tttp 59.26 47.21 11.8 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 120.896 -1.128 . . . . 0.0 110.37 179.903 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.8 -58.1 2.2 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.378 -0.826 . . . . 0.0 109.507 179.339 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.705 HG13 HD23 ' A' ' 77' ' ' LEU . 14.8 tt -54.91 162.39 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.601 0 O-C-N 121.366 -0.834 . . . . 0.0 110.224 179.55 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.0 t -110.53 147.36 34.32 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.188 -0.945 . . . . 0.0 109.805 178.975 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -43.15 -33.83 0.98 Allowed 'General case' 0 N--CA 1.52 3.04 0 O-C-N 121.376 -0.828 . . . . 0.0 111.986 -179.594 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.6 -48.04 83.52 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 120.956 -1.09 . . . . 0.0 109.474 179.556 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.705 HD23 HG13 ' A' ' 73' ' ' ILE . 23.9 tp -70.52 -41.79 72.12 Favored 'General case' 0 N--CA 1.504 2.233 0 C-N-CA 119.236 -0.986 . . . . 0.0 108.705 178.611 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.54 ' HA ' HD12 ' A' ' 81' ' ' LEU . 26.2 t80 -61.71 -36.56 81.29 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.27 -0.894 . . . . 0.0 109.478 178.821 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -71.96 -43.77 64.63 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.024 -1.048 . . . . 0.0 108.905 179.047 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.655 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 72.8 t90 -59.42 -37.97 79.42 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.227 -0.921 . . . . 0.0 109.428 178.979 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.54 HD12 ' HA ' ' A' ' 78' ' ' TYR . 18.8 mt -65.74 -49.77 67.21 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.247 -0.908 . . . . 0.0 109.55 179.531 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.527 HD12 ' HG3' ' A' ' 89' ' ' LYS . 39.7 mm -59.6 -33.16 50.92 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.515 0 O-C-N 121.258 -0.901 . . . . 0.0 110.164 179.68 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.13 -6.3 57.11 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 120.909 -1.119 . . . . 0.0 112.379 -179.802 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.42 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 7.6 mm-40 -114.46 21.81 14.24 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.537 -1.352 . . . . 0.0 111.899 -179.941 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.01 77.74 0.12 Allowed 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.014 -1.054 . . . . 0.0 111.433 179.371 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.578 ' HE2' HD13 ' A' ' 23' ' ' LEU . 33.0 m-85 -136.7 -63.46 0.62 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.499 -0.75 . . . . 0.0 109.418 179.653 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.64 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -125.6 -174.26 3.03 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.431 -0.793 . . . . 0.0 109.293 179.342 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.444 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 5.4 t0 -121.67 102.76 8.43 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.098 -1.001 . . . . 0.0 110.343 -179.956 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.527 ' HG3' HD12 ' A' ' 82' ' ' ILE . 19.5 mtpt -60.37 -40.38 90.6 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.143 -0.973 . . . . 0.0 109.874 179.618 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.581 HD23 HD13 ' A' ' 106' ' ' LEU . 30.9 tp -59.97 -42.78 94.88 Favored 'General case' 0 N--CA 1.508 2.425 0 C-N-CA 119.408 -0.917 . . . . 0.0 109.67 179.711 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.746 ' HA ' HD21 ' A' ' 106' ' ' LEU . 37.0 tp -64.97 -50.44 66.34 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.168 -0.957 . . . . 0.0 108.927 179.529 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 55.9 mt -59.25 -36.04 61.19 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.413 0 O-C-N 121.188 -0.945 . . . . 0.0 108.797 178.593 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -64.53 -44.93 89.29 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.135 -0.978 . . . . 0.0 109.341 178.726 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.507 ' HD3' HD23 ' A' ' 106' ' ' LEU . 8.7 mttp -59.66 -44.68 93.46 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.087 -1.008 . . . . 0.0 109.862 179.163 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.5 m0 -59.04 -35.49 73.4 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.158 -0.964 . . . . 0.0 110.105 179.262 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.435 ' NH1' ' OH ' ' A' ' 64' ' ' TYR . 13.2 mtp85 -85.04 -30.4 24.16 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.07 -1.019 . . . . 0.0 110.513 179.269 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.43 -176.93 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.719 0 O-C-N 120.987 -1.07 . . . . 0.0 110.697 179.865 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 12.0 m -102.23 135.11 44.4 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.208 -0.933 . . . . 0.0 109.594 179.012 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 97.04 10.42 54.92 Favored Glycine 0 N--CA 1.494 2.522 0 O-C-N 121.132 -0.98 . . . . 0.0 111.081 -179.345 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.579 ' HB3' HD23 ' A' ' 103' ' ' LEU . 48.5 m-85 -118.35 71.87 0.85 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 119.339 1.57 . . . . 0.0 109.641 179.576 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -94.62 -33.75 12.88 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.158 -0.964 . . . . 0.0 110.871 -179.804 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.68 77.08 1.77 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.99 -1.069 . . . . 0.0 110.997 -179.49 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.579 HD23 ' HB3' ' A' ' 100' ' ' TYR . 2.3 pp -125.44 159.36 32.1 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.031 -1.043 . . . . 0.0 109.83 179.042 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.441 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.6 p -120.3 -33.06 3.98 Favored 'General case' 0 N--CA 1.501 2.101 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -178.709 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.636 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.3 m -140.27 -168.04 2.45 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 120.056 -1.653 . . . . 0.0 110.254 179.573 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.746 HD21 ' HA ' ' A' ' 91' ' ' LEU . 46.1 mt -95.65 -39.45 9.9 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.166 -0.959 . . . . 0.0 110.069 179.134 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.86 28.26 5.36 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 120.934 -1.104 . . . . 0.0 110.042 178.006 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.636 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.8 t -126.32 15.55 7.75 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.093 -1.004 . . . . 0.0 108.855 -179.669 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.497 HG22 ' HG3' ' A' ' 123' ' ' ARG . 1.2 pt -157.81 36.86 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.292 0 O-C-N 120.803 -1.185 . . . . 0.0 110.55 -178.776 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.599 ' O ' HG23 ' A' ' 119' ' ' THR . 3.5 tt0 . . . . . 0 N--CA 1.501 2.09 0 O-C-N 120.73 -1.231 . . . . 0.0 111.824 -178.071 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.599 HG23 ' O ' ' A' ' 110' ' ' GLN . 1.5 m . . . . . 0 N--CA 1.509 2.493 0 N-CA-C 109.978 -0.378 . . . . 0.0 109.978 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 49.3 t -95.2 154.13 17.33 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 119.555 -0.858 . . . . 0.0 109.186 178.913 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.803 HD12 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -71.56 -37.18 62.85 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.441 0 O-C-N 121.115 -0.99 . . . . 0.0 110.987 -179.053 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.455 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 10.8 p -53.97 -34.35 59.49 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 120.932 -1.105 . . . . 0.0 111.127 -178.703 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.497 ' HG3' HG22 ' A' ' 109' ' ' ILE . 10.9 ttp85 -59.53 -34.88 73.18 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 120.966 -1.084 . . . . 0.0 109.542 178.38 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 49.5 t -79.9 124.75 83.07 Favored Pre-proline 0 N--CA 1.505 2.29 0 O-C-N 121.14 -0.975 . . . . 0.0 109.925 179.614 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.628 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.0 Cg_endo -65.13 178.7 1.81 Allowed 'Trans proline' 0 N--CA 1.488 1.205 0 O-C-N 123.113 1.06 . . . . 0.0 110.804 179.517 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.2 mmt85 -75.05 -37.73 61.61 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.233 -0.917 . . . . 0.0 110.489 -179.803 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.64 -42.81 89.18 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.043 -1.035 . . . . 0.0 109.971 -179.752 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -68.79 -41.65 78.44 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.281 -0.968 . . . . 0.0 109.128 179.256 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.628 HD12 ' O ' ' A' ' 125' ' ' PRO . 5.6 mt -64.17 -38.57 91.54 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.172 -0.955 . . . . 0.0 109.701 179.166 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -60.61 -40.15 90.81 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.095 -1.003 . . . . 0.0 109.853 179.765 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -59.62 -37.07 77.64 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.12 -0.987 . . . . 0.0 110.16 179.739 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -60.67 -45.15 95.23 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.114 -0.991 . . . . 0.0 109.843 179.859 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.458 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -62.13 -46.41 89.12 Favored 'General case' 0 N--CA 1.507 2.389 0 C-N-CA 119.337 -0.945 . . . . 0.0 109.687 179.759 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.79 -35.2 74.16 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.192 -0.943 . . . . 0.0 110.11 179.559 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -73.89 -32.64 63.69 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.101 -1.0 . . . . 0.0 110.773 179.887 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 1.4 ttmt -98.87 23.32 9.0 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.944 -1.098 . . . . 0.0 111.685 179.996 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.92 46.73 55.06 Favored Glycine 0 N--CA 1.499 2.873 0 O-C-N 120.69 -1.256 . . . . 0.0 110.702 179.288 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.458 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.8 t -148.79 -165.15 2.2 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.154 -1.204 . . . . 0.0 110.468 179.848 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -131.62 153.52 49.84 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.214 -0.929 . . . . 0.0 110.186 -179.874 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.447 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.1 p -131.55 160.66 42.2 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 O-C-N 121.193 -0.942 . . . . 0.0 110.349 179.964 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 47.7 t -168.57 86.68 0.19 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.232 -0.917 . . . . 0.0 110.744 179.99 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.803 ' CG ' HD12 ' A' ' 121' ' ' ILE . 57.8 t80 -102.47 161.72 13.49 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.181 -0.949 . . . . 0.0 110.821 -179.483 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 3.3 m170 -139.5 -60.96 0.55 Allowed 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 178.995 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -134.86 150.17 50.42 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.339 -0.85 . . . . 0.0 108.774 178.47 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 28.3 p -92.65 154.09 18.58 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.096 -1.042 . . . . 0.0 111.117 -179.42 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.9 p -73.31 -25.19 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 O-C-N 121.39 -0.819 . . . . 0.0 111.475 -179.603 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 61.9 m170 -49.73 -55.79 12.61 Favored 'General case' 0 N--CA 1.516 2.835 0 O-C-N 120.828 -1.17 . . . . 0.0 110.231 -179.875 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 23.1 p -131.55 -163.41 1.32 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.218 -0.926 . . . . 0.0 110.226 179.651 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -102.23 63.47 0.48 Allowed Glycine 0 N--CA 1.492 2.394 0 N-CA-C 108.015 -2.034 . . . . 0.0 108.015 178.4 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 31.6 t -104.01 141.48 36.11 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.362 -1.081 . . . . 0.0 110.162 -178.993 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 6.0 ttt-85 -96.33 53.26 1.31 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.303 -0.873 . . . . 0.0 109.423 178.995 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.23 96.87 0.03 OUTLIER Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.714 -1.355 . . . . 0.0 109.714 -179.857 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.2 p -107.24 127.21 53.33 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.165 -1.197 . . . . 0.0 110.34 179.608 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -152.99 148.82 27.53 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.167 -0.958 . . . . 0.0 110.355 -179.546 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.501 2.096 0 O-C-N 121.191 -0.943 . . . . 0.0 110.759 -179.727 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.663 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.51 2.566 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -72.45 160.41 46.85 Favored 'Trans proline' 0 C--N 1.317 -1.116 0 O-C-N 123.346 1.182 . . . . 0.0 110.722 -179.823 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -49.37 -31.55 9.67 Favored 'General case' 0 N--CA 1.515 2.789 0 O-C-N 121.394 -0.816 . . . . 0.0 111.361 -179.869 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.55 -33.4 40.76 Favored Glycine 0 N--CA 1.498 2.798 0 O-C-N 120.941 -1.099 . . . . 0.0 110.686 179.888 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -55.21 -33.08 62.75 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 120.938 -1.331 . . . . 0.0 110.665 179.939 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -54.16 -37.71 64.73 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 120.981 -1.074 . . . . 0.0 110.325 179.776 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.3 mtpp -59.74 -36.94 77.64 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.227 -0.921 . . . . 0.0 110.201 179.545 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.846 ' O ' HD12 ' A' ' 23' ' ' LEU . 1.6 pt -114.96 33.85 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 O-C-N 121.129 -0.982 . . . . 0.0 110.702 179.759 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.427 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 1.1 ttpt -83.81 -43.21 0.79 Allowed Pre-proline 0 N--CA 1.508 2.469 0 O-C-N 121.005 -1.059 . . . . 0.0 113.102 -179.356 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.3 Cg_endo -75.7 -35.14 2.82 Favored 'Trans proline' 0 N--CA 1.487 1.103 0 O-C-N 122.592 0.785 . . . . 0.0 111.563 -178.448 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.778 HG21 ' CE2' ' A' ' 62' ' ' TYR . 90.5 m -58.48 -41.86 86.21 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 120.948 -1.095 . . . . 0.0 110.05 -179.926 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.846 HD12 ' O ' ' A' ' 19' ' ' ILE . 5.0 mt -68.18 -41.3 81.64 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.514 -0.874 . . . . 0.0 109.297 179.398 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.3 m -60.42 -33.95 73.26 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.168 -0.958 . . . . 0.0 109.845 178.926 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -55.57 -34.96 65.24 Favored 'General case' 0 N--CA 1.511 2.579 0 O-C-N 121.01 -1.056 . . . . 0.0 110.198 179.465 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.714 ' CD2' HD22 ' A' ' 55' ' ' LEU . 15.7 m-85 -55.32 -35.79 65.52 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.103 -0.998 . . . . 0.0 110.516 179.704 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -57.16 -38.19 73.2 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.095 -1.003 . . . . 0.0 110.647 -179.628 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.427 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.2 mp -66.36 -40.81 87.66 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 C-N-CA 119.316 -0.954 . . . . 0.0 109.158 179.725 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -70.32 -46.87 63.35 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.125 -0.985 . . . . 0.0 108.784 178.97 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.141 HD11 HG23 ' A' ' 52' ' ' ILE . 2.2 tp -62.07 -35.54 78.94 Favored 'General case' 0 N--CA 1.507 2.419 0 C-N-CA 119.377 -0.929 . . . . 0.0 109.305 178.555 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.92 -36.08 69.78 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.106 -0.996 . . . . 0.0 110.391 179.699 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -62.88 -52.4 63.23 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.054 -1.029 . . . . 0.0 109.458 -179.883 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.535 ' HB1' ' HG2' ' A' ' 48' ' ' GLN . . . -68.91 -41.96 77.48 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 119.042 -1.063 . . . . 0.0 108.589 178.809 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -60.45 -32.42 71.36 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.22 -0.925 . . . . 0.0 110.187 179.309 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 41.8 mtpt -93.6 -30.16 15.1 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 120.939 -1.1 . . . . 0.0 111.037 179.952 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.0 t0 . . . . . 0 N--CA 1.513 2.677 0 O-C-N 120.861 -1.15 . . . . 0.0 110.407 -179.947 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.503 2.213 0 CA-C-O 120.497 0.189 . . . . 0.0 110.616 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -61.34 -40.88 95.89 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.112 -0.992 . . . . 0.0 109.66 179.99 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -61.03 -39.45 89.81 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.217 -0.927 . . . . 0.0 109.788 179.455 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.535 ' HG2' ' HB1' ' A' ' 33' ' ' ALA . 0.3 OUTLIER -59.44 -44.59 92.9 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.187 -0.946 . . . . 0.0 109.53 179.694 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.466 HD23 ' HA ' ' A' ' 49' ' ' LEU . 20.8 mt -59.41 -35.97 74.97 Favored 'General case' 0 N--CA 1.508 2.449 0 C-N-CA 119.318 -0.953 . . . . 0.0 110.296 -179.736 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.536 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.1 m0 -54.0 -38.62 65.28 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 120.885 -1.135 . . . . 0.0 109.52 179.195 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -67.83 -37.27 81.71 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.328 -0.857 . . . . 0.0 109.553 178.817 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 1.141 HG23 HD11 ' A' ' 30' ' ' LEU . 16.6 mt -66.97 -42.84 89.27 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.329 0 O-C-N 121.038 -1.039 . . . . 0.0 109.42 179.604 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.457 ' CE ' ' HB3' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -68.68 -29.44 67.9 Favored 'General case' 0 N--CA 1.502 2.166 0 C-N-CA 118.66 -1.216 . . . . 0.0 109.864 179.285 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.427 ' N ' ' HG3' ' A' ' 53' ' ' MET . 23.4 mt-30 -66.24 -37.69 86.12 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.997 -1.065 . . . . 0.0 109.282 178.896 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.714 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.6 mt -52.77 -32.83 45.68 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.013 -1.054 . . . . 0.0 109.959 179.187 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.435 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 8.4 t60 -56.93 -37.27 71.25 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.058 -1.026 . . . . 0.0 109.966 179.247 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.44 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 5.5 m170 -59.42 -49.35 78.15 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.097 -1.002 . . . . 0.0 109.103 179.215 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -58.78 -35.99 73.69 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.305 -0.872 . . . . 0.0 109.43 178.856 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.459 ' HD3' ' CD1' ' A' ' 26' ' ' PHE . 32.6 mmm-85 -62.81 -51.98 64.97 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.159 -0.963 . . . . 0.0 109.078 178.978 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.443 ' HA ' ' HB1' ' A' ' 87' ' ' ALA . 92.9 p -63.7 -39.23 93.79 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.237 -0.914 . . . . 0.0 109.127 179.262 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 58.7 ttt-85 -64.48 -37.88 89.06 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 121.094 -1.004 . . . . 0.0 109.634 179.195 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.778 ' CE2' HG21 ' A' ' 22' ' ' THR . 48.3 t80 -62.3 -49.54 75.22 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.075 -1.016 . . . . 0.0 109.485 179.528 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.905 HD12 ' HB2' ' A' ' 87' ' ' ALA . 86.9 mt -75.43 -40.62 42.25 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.328 0 O-C-N 121.168 -0.957 . . . . 0.0 109.313 179.382 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.481 ' CE1' HG23 ' A' ' 92' ' ' ILE . 38.6 t80 -63.03 -22.06 66.59 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.202 -0.937 . . . . 0.0 110.551 178.758 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 87.4 m -90.78 -35.51 14.81 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 120.665 -1.272 . . . . 0.0 110.39 179.751 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.531 ' C ' HD12 ' A' ' 66' ' ' LEU . 3.7 pp -82.87 -31.95 27.67 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.917 -1.114 . . . . 0.0 112.207 -179.246 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.467 ' N ' HD12 ' A' ' 66' ' ' LEU . 40.3 t80 -86.13 -38.01 18.18 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 120.657 -1.277 . . . . 0.0 111.271 -179.477 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.403 ' CD2' ' CD1' ' A' ' 64' ' ' TYR . 17.2 m-85 -89.65 -21.93 22.53 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.896 -1.128 . . . . 0.0 112.614 -178.663 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.7 mttm -119.58 -61.07 1.66 Allowed 'General case' 0 N--CA 1.501 2.093 0 O-C-N 120.466 -1.396 . . . . 0.0 111.211 -179.671 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.408 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 0.2 OUTLIER -58.81 -30.65 67.78 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.113 -0.992 . . . . 0.0 110.808 -179.502 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.0 ttmm 57.28 41.59 26.48 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 120.852 -1.155 . . . . 0.0 110.023 -179.498 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.14 35.64 3.87 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.425 -0.797 . . . . 0.0 109.871 179.288 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.81 HG13 HD23 ' A' ' 77' ' ' LEU . 14.1 tt -155.29 162.14 1.89 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.197 -0.939 . . . . 0.0 109.918 -179.975 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.1 148.92 30.09 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.105 -0.997 . . . . 0.0 110.245 179.966 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -46.38 -32.29 3.12 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 121.35 -0.843 . . . . 0.0 111.553 179.97 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -62.02 -50.55 71.57 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 120.843 -1.16 . . . . 0.0 109.349 179.427 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.81 HD23 HG13 ' A' ' 73' ' ' ILE . 54.4 tp -66.37 -45.4 80.25 Favored 'General case' 0 N--CA 1.506 2.336 0 C-N-CA 119.141 -1.024 . . . . 0.0 108.465 178.818 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.588 ' HA ' HD12 ' A' ' 81' ' ' LEU . 18.4 t80 -59.78 -38.26 81.36 Favored 'General case' 0 N--CA 1.506 2.331 0 C-N-CA 119.694 -0.802 . . . . 0.0 109.551 179.112 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -73.75 -42.43 61.11 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.102 -0.999 . . . . 0.0 108.764 178.726 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.663 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 72.1 t90 -57.88 -36.12 71.93 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.228 -0.92 . . . . 0.0 109.772 178.943 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.588 HD12 ' HA ' ' A' ' 78' ' ' TYR . 11.9 mt -69.56 -50.28 46.29 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.119 -0.988 . . . . 0.0 108.84 179.213 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.448 HG21 ' HG3' ' A' ' 89' ' ' LYS . 35.5 mm -57.16 -30.88 35.88 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.639 0 O-C-N 121.205 -0.934 . . . . 0.0 110.117 179.362 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -89.18 -20.87 23.68 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 120.886 -1.134 . . . . 0.0 112.159 -179.549 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.45 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 77.9 mm-40 -101.63 22.19 13.17 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 120.659 -1.276 . . . . 0.0 112.08 -179.767 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 73.46 77.75 0.13 Allowed 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.05 -1.031 . . . . 0.0 111.659 179.079 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.516 ' HE2' HD13 ' A' ' 23' ' ' LEU . 29.0 m-85 -134.64 -64.71 0.66 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.553 -0.717 . . . . 0.0 109.468 179.721 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.905 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -120.63 -174.06 2.72 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.378 -0.826 . . . . 0.0 109.513 179.336 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.435 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 5.9 t0 -124.7 102.86 7.8 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.165 -0.96 . . . . 0.0 110.348 -179.878 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.448 ' HG3' HG21 ' A' ' 82' ' ' ILE . 4.2 mmmt -60.22 -40.28 89.6 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.226 -0.921 . . . . 0.0 109.806 179.646 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.2 tp -60.33 -37.85 81.89 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 121.204 -0.935 . . . . 0.0 110.045 179.829 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.689 HD21 ' CH2' ' A' ' 95' ' ' TRP . 45.2 tp -70.63 -49.3 49.01 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.078 -1.014 . . . . 0.0 108.813 179.179 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.481 HG23 ' CE1' ' A' ' 64' ' ' TYR . 34.5 mt -59.0 -34.03 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 121.255 -0.903 . . . . 0.0 109.098 178.556 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.12 -46.64 76.84 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.089 -1.007 . . . . 0.0 109.356 178.933 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.512 ' HD3' HD23 ' A' ' 106' ' ' LEU . 10.9 mttp -60.5 -44.36 96.06 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.129 -0.982 . . . . 0.0 109.804 179.32 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.689 ' CH2' HD21 ' A' ' 91' ' ' LEU . 3.3 m0 -58.66 -28.66 65.92 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.086 -1.009 . . . . 0.0 109.966 178.926 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.405 ' CD ' ' OH ' ' A' ' 64' ' ' TYR . 0.0 OUTLIER -99.69 22.53 10.81 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 120.939 -1.101 . . . . 0.0 110.886 178.676 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -109.41 -174.28 2.47 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.732 -1.23 . . . . 0.0 109.851 179.366 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 29.2 m -104.6 137.8 41.9 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.214 -0.929 . . . . 0.0 109.441 179.149 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 102.2 -25.77 26.6 Favored Glycine 0 N--CA 1.493 2.496 0 C-N-CA 119.815 -1.184 . . . . 0.0 110.2 -179.004 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.679 ' HB3' HD23 ' A' ' 103' ' ' LEU . 73.4 m-85 -92.37 58.63 3.25 Favored 'General case' 0 N--CA 1.504 2.258 0 CA-C-N 119.009 1.404 . . . . 0.0 109.994 179.771 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -72.88 -37.64 67.26 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.006 -1.059 . . . . 0.0 110.2 179.909 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.87 82.67 2.1 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.039 -1.038 . . . . 0.0 110.47 179.949 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.679 HD23 ' HB3' ' A' ' 100' ' ' TYR . 0.6 OUTLIER -119.71 148.36 43.48 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.168 -0.958 . . . . 0.0 110.349 179.759 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.44 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.1 p -113.03 -26.66 8.37 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.163 -0.96 . . . . 0.0 113.374 -179.516 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.671 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 11.4 m -143.48 -167.31 2.54 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 120.068 -1.645 . . . . 0.0 109.642 179.065 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.512 HD23 ' HD3' ' A' ' 94' ' ' LYS . 14.4 mt -97.15 -38.28 9.78 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.103 -0.998 . . . . 0.0 110.306 179.224 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 22.7 ttt85 -102.98 31.83 4.02 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 120.893 -1.129 . . . . 0.0 109.678 178.153 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.671 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.308 1.7 t -127.71 16.53 6.93 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.154 -0.966 . . . . 0.0 108.953 -179.257 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.491 HG22 ' HG3' ' A' ' 123' ' ' ARG . 1.1 pt -159.25 38.06 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 120.947 -1.095 . . . . 0.0 110.628 -178.545 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.511 ' C ' HG23 ' A' ' 119' ' ' THR . 1.5 mm-40 . . . . . 0 N--CA 1.502 2.133 0 O-C-N 120.749 -1.22 . . . . 0.0 111.321 -178.49 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.511 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.9 OUTLIER . . . . . 0 N--CA 1.494 1.773 0 CA-C-O 120.704 0.288 . . . . 0.0 110.26 . . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.415 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 48.9 t -106.7 155.02 20.11 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.405 -0.81 . . . . 0.0 109.531 179.231 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.783 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -72.74 -35.72 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.395 0 O-C-N 121.081 -1.012 . . . . 0.0 111.255 -179.172 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.491 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 11.0 p -54.21 -31.86 54.2 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.805 -1.185 . . . . 0.0 111.298 -178.861 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.491 ' HG3' HG22 ' A' ' 109' ' ' ILE . 6.7 ttp85 -58.22 -32.86 68.71 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 120.929 -1.107 . . . . 0.0 109.798 178.375 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 60.8 t -81.87 125.24 78.21 Favored Pre-proline 0 N--CA 1.506 2.328 0 O-C-N 121.124 -0.985 . . . . 0.0 109.923 179.68 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.541 ' HD3' ' HB1' ' A' ' 154' ' ' ALA . 39.0 Cg_endo -66.65 178.99 2.35 Favored 'Trans proline' 0 N--CA 1.488 1.152 0 O-C-N 123.097 1.051 . . . . 0.0 110.551 179.407 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -75.17 -37.77 61.15 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.184 -0.948 . . . . 0.0 110.513 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.06 -41.12 82.64 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.001 -1.062 . . . . 0.0 110.097 -179.732 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -66.91 -41.78 86.5 Favored 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.319 179.494 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.572 HD11 HD11 ' A' ' 121' ' ' ILE . 2.4 mt -63.27 -39.97 96.09 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.226 -0.922 . . . . 0.0 109.693 179.561 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -60.1 -38.31 82.58 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.19 -0.943 . . . . 0.0 109.993 179.782 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -57.79 -36.12 71.75 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.072 -1.018 . . . . 0.0 110.381 179.802 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.36 -49.56 73.39 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.072 -1.017 . . . . 0.0 109.754 179.902 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.704 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -62.11 -38.95 90.85 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.148 -0.97 . . . . 0.0 109.797 179.754 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 43.4 ttp85 -66.78 -35.53 80.31 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.155 -0.966 . . . . 0.0 110.452 179.771 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 25.4 mttm -86.84 -35.04 19.28 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.048 -1.032 . . . . 0.0 110.479 179.86 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 16.8 mttm -80.96 -22.55 39.46 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.086 -1.009 . . . . 0.0 111.472 179.692 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.83 32.91 9.48 Favored Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.673 -1.371 . . . . 0.0 109.673 -179.537 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.704 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.1 t -135.9 -161.22 1.13 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.054 -1.262 . . . . 0.0 109.792 179.946 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -130.85 143.08 50.47 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.07 -1.018 . . . . 0.0 109.959 179.944 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.491 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.1 p -129.85 160.2 41.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.216 -0.927 . . . . 0.0 110.373 -179.981 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 43.6 t -169.94 87.83 0.15 Allowed 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.261 -0.9 . . . . 0.0 111.031 179.96 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.748 ' CG ' HD12 ' A' ' 121' ' ' ILE . 62.3 t80 -99.68 159.81 14.77 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.187 -0.945 . . . . 0.0 110.491 -179.882 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -138.26 -59.76 0.63 Allowed 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 179.015 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -139.47 151.07 45.9 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.341 -0.849 . . . . 0.0 109.05 178.778 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 29.7 p -91.73 154.49 18.93 Favored 'General case' 0 N--CA 1.505 2.282 0 C-N-CA 119.05 -1.06 . . . . 0.0 111.093 -179.502 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.9 p -72.58 -26.26 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 O-C-N 121.379 -0.826 . . . . 0.0 111.57 -179.455 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -51.05 -51.74 50.23 Favored 'General case' 0 N--CA 1.516 2.839 0 O-C-N 120.764 -1.21 . . . . 0.0 110.195 -179.955 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.536 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 31.8 p -135.0 -169.03 2.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.237 -0.914 . . . . 0.0 111.121 179.764 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -98.39 60.97 0.9 Allowed Glycine 0 N--CA 1.491 2.329 0 N-CA-C 107.756 -2.138 . . . . 0.0 107.756 178.366 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 20.8 t -100.98 143.24 31.36 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.39 -1.065 . . . . 0.0 109.971 -179.021 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 50.5 mtm-85 -97.16 51.94 1.12 Allowed 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.237 -0.914 . . . . 0.0 109.308 179.046 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.41 96.72 0.03 OUTLIER Glycine 0 N--CA 1.487 2.095 0 N-CA-C 109.746 -1.342 . . . . 0.0 109.746 -179.726 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.0 p -106.65 125.24 50.76 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.19 -1.182 . . . . 0.0 110.258 179.67 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 154' ' ' ALA . . . . . 0.541 ' HB1' ' HD3' ' A' ' 125' ' ' PRO . . . -149.28 151.3 33.97 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.199 -0.938 . . . . 0.0 110.162 -179.622 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 4.9 m . . . . . 0 N--CA 1.5 2.074 0 O-C-N 121.326 -0.859 . . . . 0.0 110.48 -179.892 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.66 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.504 2.273 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.403 ' HG2' HD13 ' A' ' 77' ' ' LEU . 45.0 Cg_endo -71.49 162.52 42.0 Favored 'Trans proline' 0 C--N 1.317 -1.081 0 O-C-N 123.273 1.144 . . . . 0.0 110.801 -179.611 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -48.96 -31.76 7.95 Favored 'General case' 0 N--CA 1.515 2.803 0 O-C-N 121.433 -0.792 . . . . 0.0 111.318 -179.874 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.0 -35.11 39.96 Favored Glycine 0 N--CA 1.499 2.873 0 O-C-N 120.951 -1.093 . . . . 0.0 110.388 179.801 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -54.88 -32.44 60.86 Favored 'General case' 0 N--CA 1.512 2.664 0 O-C-N 121.013 -1.286 . . . . 0.0 110.617 179.626 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -54.11 -37.86 64.76 Favored 'General case' 0 N--CA 1.512 2.662 0 O-C-N 121.01 -1.056 . . . . 0.0 110.244 179.823 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.6 mmtp -58.86 -37.93 77.61 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.28 -0.887 . . . . 0.0 110.107 179.59 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.887 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.0 pt -114.4 33.51 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 O-C-N 121.237 -0.914 . . . . 0.0 110.544 179.458 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.423 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 5.7 tmtt? -83.6 -43.57 0.81 Allowed Pre-proline 0 N--CA 1.508 2.466 0 O-C-N 121.005 -1.059 . . . . 0.0 113.019 -179.171 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.4 Cg_endo -76.63 -35.6 1.98 Allowed 'Trans proline' 0 N--CA 1.486 1.069 0 O-C-N 122.545 0.76 . . . . 0.0 111.434 -178.485 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.773 HG21 ' CE2' ' A' ' 62' ' ' TYR . 91.5 m -59.22 -42.32 90.71 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 120.98 -1.075 . . . . 0.0 110.042 -179.752 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.887 HD12 ' O ' ' A' ' 19' ' ' ILE . 4.3 mt -65.73 -40.51 92.23 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.225 -0.922 . . . . 0.0 109.574 179.516 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -59.58 -35.87 75.13 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.145 -0.972 . . . . 0.0 110.048 179.287 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -56.49 -36.4 69.1 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 121.019 -1.05 . . . . 0.0 110.315 179.707 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.52 ' CE1' HD12 ' A' ' 55' ' ' LEU . 12.1 m-85 -57.39 -35.76 70.42 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.162 -0.961 . . . . 0.0 110.877 -179.964 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -61.62 -38.56 88.1 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.092 -1.005 . . . . 0.0 111.006 -179.145 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.414 ' H ' HD12 ' A' ' 28' ' ' ILE . 2.9 mp -62.82 -39.36 84.63 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.499 0 C-N-CA 119.038 -1.065 . . . . 0.0 109.35 -179.989 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.5 tp60 -68.82 -54.63 14.69 Favored 'General case' 0 N--CA 1.506 2.366 0 C-N-CA 119.106 -1.037 . . . . 0.0 108.661 178.9 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.833 HD21 HG23 ' A' ' 52' ' ' ILE . 0.1 OUTLIER -58.72 -33.96 70.8 Favored 'General case' 0 N--CA 1.511 2.616 0 O-C-N 121.193 -0.942 . . . . 0.0 109.342 178.407 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -57.8 -41.94 83.17 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.004 -1.06 . . . . 0.0 109.98 179.655 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 -63.18 -49.91 72.41 Favored 'General case' 0 N--CA 1.508 2.453 0 C-N-CA 119.135 -1.026 . . . . 0.0 109.411 -179.982 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.486 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -64.78 -40.22 94.91 Favored 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 119.306 -0.958 . . . . 0.0 109.179 179.051 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -58.38 -34.16 70.41 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.238 -0.914 . . . . 0.0 110.348 179.707 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 17.5 mmtm -93.59 -38.68 11.24 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.048 -1.032 . . . . 0.0 110.45 179.879 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.7 t0 . . . . . 0 N--CA 1.51 2.571 0 O-C-N 121.139 -0.976 . . . . 0.0 110.531 179.992 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 43.1 m . . . . . 0 N--CA 1.497 1.912 0 CA-C-O 120.64 0.257 . . . . 0.0 110.364 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.402 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 85.8 m-20 -56.82 -39.79 74.82 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.169 -0.957 . . . . 0.0 109.951 179.739 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -60.15 -39.29 85.83 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.243 -0.911 . . . . 0.0 109.98 179.633 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 35.5 tp60 -63.76 -46.56 84.74 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.146 -0.971 . . . . 0.0 109.788 179.858 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.522 HD23 HD12 ' A' ' 52' ' ' ILE . 51.0 mt -60.88 -35.08 75.69 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.188 -0.945 . . . . 0.0 110.339 179.94 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.441 ' CE3' ' HA2' ' A' ' 149' ' ' GLY . 41.2 m0 -58.31 -39.64 79.93 Favored 'General case' 0 N--CA 1.511 2.579 0 O-C-N 120.973 -1.079 . . . . 0.0 109.675 179.623 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.813 ' O ' HD22 ' A' ' 55' ' ' LEU . 21.6 tt0 -63.62 -33.15 74.98 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 119.165 -1.014 . . . . 0.0 109.334 178.186 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.833 HG23 HD21 ' A' ' 30' ' ' LEU . 66.9 mt -70.6 -58.52 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.247 0 O-C-N 121.054 -1.029 . . . . 0.0 109.301 179.303 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.01 -25.18 63.44 Favored 'General case' 0 N--CA 1.511 2.616 0 C-N-CA 118.309 -1.356 . . . . 0.0 110.15 178.77 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.4 mm-40 -65.6 -38.84 90.62 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.795 -1.191 . . . . 0.0 109.396 178.495 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.813 HD22 ' O ' ' A' ' 51' ' ' GLU . 0.2 OUTLIER -54.86 -32.56 60.86 Favored 'General case' 0 N--CA 1.512 2.675 0 O-C-N 120.952 -1.093 . . . . 0.0 110.084 179.308 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.437 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 13.7 t60 -57.5 -40.83 79.54 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.013 -1.054 . . . . 0.0 110.052 -179.666 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.55 ' NE2' HD21 ' A' ' 91' ' ' LEU . 4.8 m170 -64.23 -53.17 53.3 Favored 'General case' 0 N--CA 1.508 2.444 0 C-N-CA 119.338 -0.945 . . . . 0.0 109.342 179.33 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 5.2 tp60 -57.24 -35.08 69.26 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.265 -0.897 . . . . 0.0 109.878 179.547 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.449 ' HG2' ' CE1' ' A' ' 26' ' ' PHE . 1.1 mmt85 -66.44 -49.25 67.32 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.179 -0.951 . . . . 0.0 109.28 179.157 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 84.0 p -64.26 -40.3 95.72 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.187 -0.945 . . . . 0.0 109.152 179.216 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.42 ' O ' ' OG1' ' A' ' 65' ' ' THR . 11.8 ttt85 -62.4 -39.65 93.94 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.155 -0.966 . . . . 0.0 109.413 179.076 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.773 ' CE2' HG21 ' A' ' 22' ' ' THR . 34.2 t80 -62.14 -51.2 68.81 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.094 -1.003 . . . . 0.0 109.431 179.403 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.992 HD12 ' HB2' ' A' ' 87' ' ' ALA . 79.5 mt -70.3 -36.98 69.56 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.341 0 O-C-N 121.18 -0.95 . . . . 0.0 109.449 179.342 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.441 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 10.2 t80 -67.09 -42.26 84.91 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.03 -1.044 . . . . 0.0 108.933 178.97 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.42 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 89.4 m -60.72 -41.08 94.56 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.177 -0.952 . . . . 0.0 110.181 179.91 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.617 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.8 pp -83.1 -36.72 24.61 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.997 -1.064 . . . . 0.0 112.407 -179.081 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.608 ' N ' HD12 ' A' ' 66' ' ' LEU . 51.6 t80 -86.7 -35.06 19.5 Favored 'General case' 0 N--CA 1.512 2.641 0 O-C-N 120.519 -1.363 . . . . 0.0 111.817 -179.508 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.441 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 6.9 m-85 -98.3 -3.51 37.07 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 120.851 -1.155 . . . . 0.0 113.2 -178.474 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.91 -58.98 0.61 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.326 -1.484 . . . . 0.0 110.762 179.502 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.412 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 9.5 ttt85 -62.89 -29.54 70.84 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.048 -1.032 . . . . 0.0 110.722 179.987 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.7 mttt 60.16 43.71 13.77 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.801 -1.187 . . . . 0.0 109.966 -179.569 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.16 37.47 3.67 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.322 -0.861 . . . . 0.0 109.806 179.322 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.769 HG13 HD23 ' A' ' 77' ' ' LEU . 14.4 tt -156.95 162.64 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.165 -0.959 . . . . 0.0 110.221 -179.821 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -110.82 147.97 33.38 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.19 -0.944 . . . . 0.0 110.09 179.554 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -45.17 -32.68 1.95 Allowed 'General case' 0 N--CA 1.517 2.878 0 O-C-N 121.361 -0.837 . . . . 0.0 111.7 -179.779 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -62.14 -49.82 74.34 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 120.978 -1.076 . . . . 0.0 109.494 179.685 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.769 HD23 HG13 ' A' ' 73' ' ' ILE . 31.3 tp -66.54 -46.44 76.1 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.14 -1.024 . . . . 0.0 108.688 179.052 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.443 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 18.9 t80 -60.65 -37.26 80.94 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.3 -0.875 . . . . 0.0 109.535 179.143 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -72.78 -42.76 63.62 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.06 -1.025 . . . . 0.0 108.936 178.986 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.66 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 79.8 t90 -58.48 -36.43 73.72 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.312 -0.867 . . . . 0.0 109.757 179.094 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.678 HD22 ' CD2' ' A' ' 86' ' ' TYR . 30.7 mt -69.28 -47.45 64.56 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.079 -1.013 . . . . 0.0 109.037 179.45 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.2 mm -57.68 -32.91 43.67 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.588 0 O-C-N 121.18 -0.95 . . . . 0.0 110.151 179.231 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.33 -22.33 28.54 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 120.951 -1.093 . . . . 0.0 111.747 -179.886 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.439 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 10.5 mm-40 -100.35 20.29 15.08 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 120.752 -1.217 . . . . 0.0 112.046 179.956 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 71.3 tttt 72.7 83.06 0.13 Allowed 'General case' 0 N--CA 1.51 2.536 0 O-C-N 120.974 -1.079 . . . . 0.0 111.29 179.393 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.678 ' CD2' HD22 ' A' ' 81' ' ' LEU . 28.0 m-85 -139.32 -63.69 0.51 Allowed 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.509 -0.745 . . . . 0.0 110.117 -179.385 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.992 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -114.68 -171.77 1.99 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.395 -0.815 . . . . 0.0 110.147 179.877 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.437 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 21.2 t0 -123.17 102.88 8.21 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.158 -0.964 . . . . 0.0 110.263 -179.839 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.11 -40.41 74.92 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.159 -0.963 . . . . 0.0 109.892 179.753 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.695 HD23 HD13 ' A' ' 106' ' ' LEU . 20.7 tp -62.52 -46.6 87.67 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.156 -0.965 . . . . 0.0 109.611 179.71 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.581 ' HA ' HD21 ' A' ' 106' ' ' LEU . 65.9 tp -65.81 -44.88 84.33 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.261 -0.975 . . . . 0.0 108.947 179.216 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 54.1 mt -58.28 -36.5 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.508 0 O-C-N 121.149 -0.969 . . . . 0.0 108.74 178.654 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.65 -40.21 96.29 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.086 -1.009 . . . . 0.0 109.269 178.733 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.441 ' HD2' ' CZ ' ' A' ' 100' ' ' TYR . 5.2 mmtm -59.15 -47.97 83.34 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.085 -1.009 . . . . 0.0 109.393 179.295 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.9 m0 -59.13 -33.19 70.59 Favored 'General case' 0 N--CA 1.508 2.466 0 C-N-CA 119.542 -0.863 . . . . 0.0 110.301 179.591 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.36 -30.68 30.17 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.053 -1.03 . . . . 0.0 110.851 179.547 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.1 mmtt -53.69 -176.95 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.738 0 O-C-N 120.959 -1.088 . . . . 0.0 110.674 -179.972 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -103.36 134.71 46.28 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.126 -0.984 . . . . 0.0 109.699 179.207 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 95.77 11.19 55.64 Favored Glycine 0 N--CA 1.493 2.475 0 C-N-CA 120.172 -1.013 . . . . 0.0 111.094 -179.465 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.603 ' HB3' HD23 ' A' ' 103' ' ' LEU . 47.8 m-85 -117.82 71.22 0.81 Allowed 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 119.405 1.602 . . . . 0.0 109.876 179.738 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -95.21 -36.16 11.56 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.129 -0.982 . . . . 0.0 110.666 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.65 72.88 1.09 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.025 -1.047 . . . . 0.0 110.736 -179.577 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.603 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.0 OUTLIER -122.24 154.73 37.13 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.032 -1.043 . . . . 0.0 109.945 179.449 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.435 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.7 p -116.11 -31.45 5.68 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -179.15 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.614 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.6 m -141.71 -167.87 2.53 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 120.119 -1.613 . . . . 0.0 109.961 179.257 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.695 HD13 HD23 ' A' ' 90' ' ' LEU . 20.1 mt -95.92 -38.99 10.02 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.12 -0.987 . . . . 0.0 109.929 179.139 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -101.86 28.48 5.66 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 120.969 -1.082 . . . . 0.0 109.999 178.055 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.614 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.297 1.8 t -126.96 15.02 7.4 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.086 -1.009 . . . . 0.0 109.351 -179.631 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.474 HG23 ' O ' ' A' ' 108' ' ' CYS . 1.0 OUTLIER -159.48 37.54 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.375 0 O-C-N 120.832 -1.167 . . . . 0.0 111.018 -178.71 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.564 ' O ' HG23 ' A' ' 119' ' ' THR . 0.8 OUTLIER . . . . . 0 N--CA 1.501 2.12 0 O-C-N 120.643 -1.285 . . . . 0.0 111.652 -178.987 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.564 HG23 ' O ' ' A' ' 110' ' ' GLN . 2.4 m . . . . . 0 N--CA 1.493 1.718 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.438 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 49.5 t -100.67 155.09 18.08 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.2 -0.937 . . . . 0.0 109.526 179.262 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.804 HD12 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -71.4 -37.07 63.47 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.37 0 O-C-N 121.102 -0.999 . . . . 0.0 110.877 -179.444 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.46 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 11.2 p -53.57 -33.36 54.52 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 120.89 -1.131 . . . . 0.0 111.22 -178.824 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.438 ' HG2' HG22 ' A' ' 109' ' ' ILE . 0.0 OUTLIER -60.61 -34.4 74.19 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.051 -1.031 . . . . 0.0 109.539 178.35 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 47.2 t -80.64 125.34 80.78 Favored Pre-proline 0 N--CA 1.504 2.271 0 O-C-N 121.131 -0.98 . . . . 0.0 109.824 179.629 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.507 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.4 Cg_endo -65.41 175.13 4.42 Favored 'Trans proline' 0 N--CA 1.489 1.229 0 O-C-N 123.181 1.095 . . . . 0.0 110.803 179.516 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.12 -36.39 61.64 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.275 -0.891 . . . . 0.0 110.791 -179.721 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.56 -40.69 79.5 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 120.992 -1.067 . . . . 0.0 110.16 -179.657 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -70.07 -41.35 74.24 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.222 179.233 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.579 ' O ' HG11 ' A' ' 140' ' ' VAL . 2.9 mt -65.7 -38.78 90.16 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.579 179.148 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -61.23 -39.35 89.95 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.175 -0.953 . . . . 0.0 109.838 179.645 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -59.75 -38.57 82.11 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.131 -0.981 . . . . 0.0 110.143 179.825 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -60.8 -44.31 97.03 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.127 -0.983 . . . . 0.0 109.917 179.996 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.454 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -61.47 -44.42 97.13 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.168 -0.957 . . . . 0.0 109.833 179.854 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.93 -34.27 71.54 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.258 -0.901 . . . . 0.0 110.288 179.663 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 24.4 mttt -75.9 -31.96 59.42 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.045 -1.035 . . . . 0.0 110.934 179.997 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.14 23.77 8.7 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 120.926 -1.108 . . . . 0.0 111.681 -179.934 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.59 46.62 53.36 Favored Glycine 0 N--CA 1.5 2.945 0 O-C-N 120.663 -1.273 . . . . 0.0 110.722 179.257 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.454 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.9 t -147.61 -164.92 2.12 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.092 -1.24 . . . . 0.0 110.371 179.842 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.6 mp0 -136.27 150.83 49.11 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.227 -0.921 . . . . 0.0 110.285 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.579 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.0 p -130.72 160.93 41.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 121.203 -0.935 . . . . 0.0 110.034 179.79 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 31.9 t -167.98 81.18 0.18 Allowed 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.126 -0.984 . . . . 0.0 111.233 -179.964 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.804 ' CG ' HD12 ' A' ' 121' ' ' ILE . 42.7 t80 -93.86 161.39 14.33 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.197 -0.94 . . . . 0.0 110.099 179.761 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 4.5 m80 -139.47 -60.55 0.56 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.605 -0.684 . . . . 0.0 109.175 179.065 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -132.77 152.21 51.82 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.44 -0.787 . . . . 0.0 109.198 178.967 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 145' ' ' CYS . . . . . 0.401 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 25.7 p -97.08 156.56 16.32 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.13 -0.981 . . . . 0.0 110.803 -179.84 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 21.3 m -76.48 -24.4 15.88 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 O-C-N 121.315 -0.866 . . . . 0.0 111.859 -179.384 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 63.1 m170 -49.83 -53.69 23.9 Favored 'General case' 0 N--CA 1.515 2.822 0 O-C-N 120.728 -1.232 . . . . 0.0 110.42 -179.733 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 25.2 p -133.88 -163.05 1.31 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.308 -0.87 . . . . 0.0 110.387 179.851 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 149' ' ' GLY . . . . . 0.441 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.19 63.46 0.63 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 108.209 -1.956 . . . . 0.0 108.209 178.549 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 38.4 t -104.49 144.77 31.22 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.301 -1.117 . . . . 0.0 110.068 -179.175 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 19.0 mtt85 -101.59 44.63 1.0 Allowed 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.398 -0.813 . . . . 0.0 109.509 179.275 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 76.61 95.93 0.18 Allowed Glycine 0 N--CA 1.488 2.123 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 -179.823 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.3 p -109.02 126.26 52.94 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.093 -1.239 . . . . 0.0 110.435 179.842 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -148.68 150.37 33.09 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.16 -0.962 . . . . 0.0 110.27 -179.543 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.497 1.914 0 O-C-N 121.27 -0.894 . . . . 0.0 110.665 -179.747 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.627 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.507 2.424 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 . . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -71.8 166.84 28.29 Favored 'Trans proline' 0 C--N 1.317 -1.083 0 O-C-N 123.174 1.091 . . . . 0.0 110.696 -179.617 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -47.53 -32.61 5.48 Favored 'General case' 0 N--CA 1.516 2.838 0 O-C-N 121.549 -0.719 . . . . 0.0 111.404 -179.814 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.07 -32.31 42.35 Favored Glycine 0 N--CA 1.498 2.822 0 O-C-N 121.047 -1.033 . . . . 0.0 110.571 179.636 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.554 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 26.8 t80 -52.01 -33.2 37.3 Favored 'General case' 0 N--CA 1.514 2.741 0 O-C-N 120.935 -1.332 . . . . 0.0 110.44 179.758 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -53.55 -34.99 60.26 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.108 -0.995 . . . . 0.0 110.208 179.457 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.13 -39.77 83.36 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.264 -0.897 . . . . 0.0 110.034 179.574 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.809 HD12 HD11 ' A' ' 23' ' ' LEU . 2.1 pt -113.51 34.61 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.21 -0.931 . . . . 0.0 110.497 179.658 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.426 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 7.4 tmtt? -85.02 -43.31 0.67 Allowed Pre-proline 0 N--CA 1.51 2.539 0 O-C-N 121.07 -1.019 . . . . 0.0 113.441 -178.993 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.426 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.4 Cg_endo -75.73 -36.74 1.99 Allowed 'Trans proline' 0 N--CA 1.486 1.074 0 O-C-N 122.591 0.785 . . . . 0.0 111.699 -178.134 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.606 HG21 ' CE2' ' A' ' 62' ' ' TYR . 89.4 m -60.61 -42.83 97.59 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 120.942 -1.099 . . . . 0.0 109.934 -179.737 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.809 HD11 HD12 ' A' ' 19' ' ' ILE . 84.8 mt -65.35 -39.66 92.63 Favored 'General case' 0 N--CA 1.507 2.401 0 C-N-CA 119.477 -0.889 . . . . 0.0 109.554 179.51 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -58.39 -35.85 72.65 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.138 -0.976 . . . . 0.0 110.127 179.355 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -56.63 -36.0 68.97 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.058 -1.026 . . . . 0.0 110.368 179.647 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.761 ' CD2' HD22 ' A' ' 55' ' ' LEU . 22.2 m-85 -57.72 -38.78 75.89 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.04 -1.037 . . . . 0.0 110.479 -179.965 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -63.07 -23.35 67.4 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.214 -0.929 . . . . 0.0 111.82 -179.483 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.573 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.6 mp -81.21 -33.59 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.412 0 O-C-N 120.759 -1.213 . . . . 0.0 109.827 179.659 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -82.37 -36.31 26.92 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 120.997 -1.064 . . . . 0.0 109.28 178.557 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.772 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -74.29 -31.88 62.67 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.118 -0.989 . . . . 0.0 110.102 178.843 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -68.75 -35.73 77.47 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 120.842 -1.161 . . . . 0.0 110.01 179.479 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -65.87 -41.8 91.14 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.012 -1.055 . . . . 0.0 109.428 179.583 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.612 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -67.37 -41.94 84.22 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.215 -0.928 . . . . 0.0 109.223 179.142 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.0 mm100 -58.72 -34.39 71.29 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.352 -0.843 . . . . 0.0 110.365 179.812 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.2 mtmm -92.91 -38.88 11.47 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.029 -1.045 . . . . 0.0 110.372 179.887 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.51 2.55 0 O-C-N 121.204 -0.935 . . . . 0.0 110.011 179.847 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.504 2.232 0 CA-C-O 120.43 0.157 . . . . 0.0 110.747 . . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -58.71 -39.36 80.6 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.181 -0.949 . . . . 0.0 110.132 -179.889 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -60.39 -39.67 88.12 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.15 -0.969 . . . . 0.0 110.086 179.898 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 39.3 tp60 -60.85 -42.23 97.41 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.098 -1.001 . . . . 0.0 110.02 -179.948 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.661 HD23 HD12 ' A' ' 52' ' ' ILE . 12.4 mt -60.08 -38.1 81.9 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.162 -0.961 . . . . 0.0 110.436 179.988 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.51 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 52.6 m0 -57.05 -40.47 76.88 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.094 -1.003 . . . . 0.0 109.574 179.794 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -60.88 -35.47 76.7 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.321 -0.862 . . . . 0.0 109.799 179.007 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.772 HG23 ' CG ' ' A' ' 30' ' ' LEU . 73.8 mt -65.23 -51.45 65.08 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 121.109 -0.994 . . . . 0.0 109.394 179.585 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.443 ' HG3' ' N ' ' A' ' 54' ' ' GLN . 0.0 OUTLIER -64.8 -30.78 71.79 Favored 'General case' 0 N--CA 1.501 2.123 0 C-N-CA 118.65 -1.22 . . . . 0.0 109.692 179.307 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.443 ' N ' ' HG3' ' A' ' 53' ' ' MET . 5.0 mm100 -64.95 -36.79 85.52 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.089 -1.007 . . . . 0.0 109.358 178.733 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.761 HD22 ' CD2' ' A' ' 26' ' ' PHE . 13.9 mt -52.78 -33.71 50.0 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.081 -1.012 . . . . 0.0 109.928 179.217 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.43 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 19.6 t60 -56.71 -38.02 71.73 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.086 -1.009 . . . . 0.0 109.771 179.235 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.553 ' CD2' HD21 ' A' ' 91' ' ' LEU . 5.9 m170 -60.0 -49.64 76.88 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.027 -1.046 . . . . 0.0 109.048 178.999 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 26.2 tp60 -59.69 -38.17 80.82 Favored 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 119.634 -0.826 . . . . 0.0 109.427 179.134 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.441 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.86 -48.83 75.16 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.233 -0.987 . . . . 0.0 108.879 179.03 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.454 ' HA ' ' HB1' ' A' ' 87' ' ' ALA . 92.1 p -64.58 -42.14 95.81 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.148 -0.97 . . . . 0.0 108.763 178.834 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 46.8 ttt85 -62.54 -39.83 94.86 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.185 -0.947 . . . . 0.0 109.303 178.803 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.606 ' CE2' HG21 ' A' ' 22' ' ' THR . 44.2 t80 -61.96 -49.55 75.66 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.261 -0.9 . . . . 0.0 109.386 179.494 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.83 HD12 ' HB2' ' A' ' 87' ' ' ALA . 90.2 mt -71.76 -39.16 68.14 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.36 0 O-C-N 121.26 -0.9 . . . . 0.0 109.022 179.153 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.507 ' CE1' HG23 ' A' ' 92' ' ' ILE . 40.3 t80 -62.77 -41.17 99.11 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.136 -0.977 . . . . 0.0 109.005 178.901 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 51.8 m -67.1 -38.19 85.25 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.202 -0.936 . . . . 0.0 110.793 -179.825 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.661 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.17 -36.35 24.78 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 120.949 -1.094 . . . . 0.0 112.489 -178.875 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.611 ' N ' HD12 ' A' ' 66' ' ' LEU . 66.1 t80 -86.55 -35.4 19.53 Favored 'General case' 0 N--CA 1.512 2.652 0 O-C-N 120.54 -1.35 . . . . 0.0 111.907 -179.299 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.401 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 17.2 m-85 -98.35 -3.39 37.16 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 120.873 -1.142 . . . . 0.0 113.077 -178.649 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -139.25 -60.27 0.57 Allowed 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.383 -1.448 . . . . 0.0 111.04 179.698 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.423 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 6.9 tpt85 -59.66 -29.59 68.16 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.081 -1.012 . . . . 0.0 110.754 -179.749 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.8 tttt 59.68 43.44 15.58 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.866 -1.146 . . . . 0.0 109.947 -179.609 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -117.99 37.34 4.0 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.425 -0.797 . . . . 0.0 109.925 179.401 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.661 HG21 ' CD1' ' A' ' 66' ' ' LEU . 14.2 tt -157.19 162.27 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.19 -0.944 . . . . 0.0 110.345 -179.88 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.5 t -110.7 149.46 30.45 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.184 -0.948 . . . . 0.0 109.788 179.356 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.0 ttmt -45.31 -33.11 2.28 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.273 -0.892 . . . . 0.0 111.587 -179.78 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -62.36 -49.31 76.06 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 120.928 -1.108 . . . . 0.0 109.479 179.379 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.18 -47.62 76.32 Favored 'General case' 0 N--CA 1.507 2.395 0 C-N-CA 119.149 -1.02 . . . . 0.0 108.6 178.917 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.701 ' HA ' HD12 ' A' ' 81' ' ' LEU . 18.1 t80 -60.21 -38.72 84.18 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 119.661 -0.815 . . . . 0.0 109.692 179.436 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -69.59 -42.05 74.97 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.065 -1.022 . . . . 0.0 108.825 178.766 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.627 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 67.9 t90 -58.27 -38.88 77.83 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.243 -0.911 . . . . 0.0 109.595 179.116 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.701 HD12 ' HA ' ' A' ' 78' ' ' TYR . 9.5 mt -65.65 -52.11 54.28 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.234 -0.916 . . . . 0.0 109.282 179.425 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.401 HG21 ' HG3' ' A' ' 89' ' ' LYS . 35.6 mm -59.12 -32.73 48.58 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.521 0 O-C-N 121.23 -0.919 . . . . 0.0 110.098 179.466 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 20.0 tttp -85.84 -14.3 45.43 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 120.938 -1.101 . . . . 0.0 112.032 -179.913 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.433 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 22.3 mm-40 -108.53 21.39 17.35 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 120.554 -1.341 . . . . 0.0 112.076 -179.97 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 73.25 78.4 0.14 Allowed 'General case' 0 N--CA 1.511 2.576 0 O-C-N 120.981 -1.074 . . . . 0.0 111.418 179.278 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.671 ' HE2' HD13 ' A' ' 23' ' ' LEU . 25.9 m-85 -134.04 -65.0 0.68 Allowed 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.493 -0.755 . . . . 0.0 109.808 -179.869 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.83 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -121.16 -175.61 3.1 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.304 -0.873 . . . . 0.0 109.937 179.68 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.43 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 7.9 t0 -117.3 122.08 42.92 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.145 -0.972 . . . . 0.0 110.134 179.906 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.401 ' HG3' HG21 ' A' ' 82' ' ' ILE . 12.3 mtmt -74.71 -40.57 61.25 Favored 'General case' 0 N--CA 1.506 2.37 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.725 179.742 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.578 HD12 ' CD2' ' A' ' 106' ' ' LEU . 0.1 OUTLIER -62.16 -42.96 99.76 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.157 -0.964 . . . . 0.0 109.341 179.514 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.553 HD21 ' CD2' ' A' ' 57' ' ' HIS . 22.1 tp -63.73 -48.4 77.2 Favored 'General case' 0 N--CA 1.507 2.381 0 C-N-CA 119.289 -0.964 . . . . 0.0 109.14 179.737 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.507 HG23 ' CE1' ' A' ' 64' ' ' TYR . 49.0 mt -60.95 -37.14 76.37 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.447 0 O-C-N 121.081 -1.012 . . . . 0.0 108.336 178.198 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.79 -39.55 76.53 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.125 -0.984 . . . . 0.0 108.694 177.907 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.439 ' HD2' ' CZ ' ' A' ' 100' ' ' TYR . 5.7 mmtm -58.72 -45.32 89.86 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.175 -0.953 . . . . 0.0 109.295 178.933 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.0 m0 -64.12 -35.37 80.55 Favored 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 119.485 -0.886 . . . . 0.0 110.079 179.356 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.23 -29.66 34.41 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.064 -1.023 . . . . 0.0 110.71 179.369 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.8 mmtt -53.72 -176.85 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.681 0 O-C-N 121.0 -1.062 . . . . 0.0 110.607 179.802 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 36.8 m -103.66 131.83 50.46 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.137 -0.977 . . . . 0.0 109.687 179.175 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.27 9.55 50.82 Favored Glycine 0 N--CA 1.493 2.47 0 C-N-CA 120.242 -0.98 . . . . 0.0 111.053 -179.458 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.598 ' HB3' HD23 ' A' ' 103' ' ' LEU . 51.4 m-85 -118.22 71.13 0.82 Allowed 'General case' 0 N--CA 1.493 1.724 0 CA-C-N 119.459 1.629 . . . . 0.0 109.921 179.697 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -95.17 -32.41 13.07 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.087 -1.008 . . . . 0.0 110.872 179.979 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -126.55 68.42 1.23 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.923 -1.11 . . . . 0.0 110.883 -179.516 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.598 HD23 ' HB3' ' A' ' 100' ' ' TYR . 0.9 OUTLIER -116.53 155.12 29.22 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.907 -1.121 . . . . 0.0 109.85 179.225 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.432 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.8 p -115.96 -34.8 4.63 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.156 -0.965 . . . . 0.0 113.473 -178.852 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.64 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.0 m -139.59 -167.6 2.3 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 120.18 -1.575 . . . . 0.0 110.088 179.501 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.578 ' CD2' HD12 ' A' ' 90' ' ' LEU . 14.8 mt -96.65 -39.51 9.46 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.204 -0.935 . . . . 0.0 110.048 179.338 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -100.86 28.03 5.53 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 120.967 -1.083 . . . . 0.0 109.98 177.903 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.64 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.301 1.8 t -125.68 14.81 8.12 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.107 -0.995 . . . . 0.0 109.017 -179.707 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.472 HG22 ' HG3' ' A' ' 123' ' ' ARG . 1.1 pt -158.11 36.06 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.263 0 O-C-N 120.832 -1.168 . . . . 0.0 110.955 -178.492 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.579 ' O ' HG23 ' A' ' 119' ' ' THR . 60.7 tp60 . . . . . 0 N--CA 1.499 1.998 0 O-C-N 120.707 -1.246 . . . . 0.0 111.45 -178.671 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.579 HG23 ' O ' ' A' ' 110' ' ' GLN . 6.6 m . . . . . 0 N--CA 1.494 1.772 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 . . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.427 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 37.5 t -86.19 154.7 21.13 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.273 -0.892 . . . . 0.0 109.73 179.482 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.949 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -76.68 -29.85 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.383 0 O-C-N 121.139 -0.976 . . . . 0.0 111.593 -179.201 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.444 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.7 p -58.01 -35.38 71.17 Favored 'General case' 0 N--CA 1.511 2.607 0 O-C-N 120.655 -1.278 . . . . 0.0 110.659 -179.163 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.472 ' HG3' HG22 ' A' ' 109' ' ' ILE . 1.2 ttt-85 -55.84 -32.92 64.04 Favored 'General case' 0 N--CA 1.513 2.686 0 O-C-N 121.023 -1.048 . . . . 0.0 110.071 178.904 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.629 HG13 ' CD ' ' A' ' 128' ' ' GLN . 60.8 t -79.44 124.6 83.93 Favored Pre-proline 0 N--CA 1.504 2.243 0 O-C-N 121.119 -0.988 . . . . 0.0 109.936 179.729 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.21 178.76 2.3 Favored 'Trans proline' 0 N--CA 1.488 1.203 0 O-C-N 123.11 1.058 . . . . 0.0 110.81 179.71 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -75.21 -36.93 61.33 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.255 -0.903 . . . . 0.0 110.574 179.979 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.17 -40.54 77.52 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 120.981 -1.074 . . . . 0.0 110.066 -179.761 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 128' ' ' GLN . . . . . 0.629 ' CD ' HG13 ' A' ' 124' ' ' VAL . 53.6 tt0 -69.48 -42.32 74.98 Favored 'General case' 0 N--CA 1.505 2.301 0 C-N-CA 119.402 -0.919 . . . . 0.0 109.075 179.247 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.685 HD11 HD11 ' A' ' 121' ' ' ILE . 2.9 mt -64.41 -38.79 92.25 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.52 -0.872 . . . . 0.0 109.476 179.184 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -60.13 -39.39 86.12 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.16 -0.962 . . . . 0.0 109.929 179.728 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -58.89 -38.55 79.11 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.187 -0.946 . . . . 0.0 110.263 179.903 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -63.48 -39.76 95.3 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.144 -0.973 . . . . 0.0 109.993 179.783 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.84 -41.95 97.71 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 121.211 -0.931 . . . . 0.0 109.82 179.891 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -60.21 -38.1 82.33 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.158 -0.964 . . . . 0.0 109.823 179.515 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -58.0 -35.37 71.13 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.132 -0.98 . . . . 0.0 110.555 179.859 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -105.08 16.63 25.51 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 120.963 -1.085 . . . . 0.0 112.061 -179.993 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 58.01 44.44 94.59 Favored Glycine 0 N--CA 1.497 2.731 0 O-C-N 120.635 -1.291 . . . . 0.0 110.174 179.448 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 7.4 t -137.83 -162.7 1.33 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.136 -1.214 . . . . 0.0 110.028 179.957 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -136.97 147.11 46.12 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.104 -0.997 . . . . 0.0 110.29 179.963 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.599 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.5 p -133.67 161.62 40.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.165 -0.959 . . . . 0.0 110.288 -179.858 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 45.6 t -164.06 111.16 1.1 Allowed 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.302 -0.874 . . . . 0.0 110.926 179.948 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.949 ' CD1' HD12 ' A' ' 121' ' ' ILE . 81.7 t80 -104.83 137.24 42.92 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.226 -0.921 . . . . 0.0 110.869 -179.783 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 11.3 m-70 -111.93 -56.76 2.35 Favored 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 178.122 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -151.71 156.03 39.5 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.5 -0.75 . . . . 0.0 109.574 179.115 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 145' ' ' CYS . . . . . 0.438 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 27.3 p -95.0 155.24 16.81 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.07 -1.019 . . . . 0.0 111.036 -179.553 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.9 p -72.38 -24.09 21.8 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.461 0 O-C-N 121.391 -0.818 . . . . 0.0 111.696 -179.528 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 60.3 m170 -51.79 -53.08 43.9 Favored 'General case' 0 N--CA 1.513 2.714 0 O-C-N 120.749 -1.219 . . . . 0.0 110.182 -179.918 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.51 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 28.3 p -135.41 -164.94 1.61 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.208 -0.932 . . . . 0.0 111.026 -179.997 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.39 59.42 0.71 Allowed Glycine 0 N--CA 1.491 2.315 0 N-CA-C 107.9 -2.08 . . . . 0.0 107.9 178.539 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 21.0 t -100.59 138.34 37.78 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.401 -1.058 . . . . 0.0 109.809 -179.228 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -96.44 51.58 1.19 Allowed 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.233 -0.917 . . . . 0.0 109.623 179.108 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 72.0 99.37 0.06 OUTLIER Glycine 0 N--CA 1.487 2.071 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 179.761 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 p -110.73 127.16 55.23 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.261 -1.14 . . . . 0.0 110.099 179.38 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -152.03 148.9 28.25 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.061 -1.024 . . . . 0.0 110.479 -179.391 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.495 1.785 0 O-C-N 121.135 -0.978 . . . . 0.0 110.261 -179.891 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.743 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.509 2.5 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 . . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -70.91 161.79 44.89 Favored 'Trans proline' 0 C--N 1.316 -1.175 0 O-C-N 123.374 1.197 . . . . 0.0 110.63 -179.928 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -48.51 -31.93 7.16 Favored 'General case' 0 N--CA 1.515 2.799 0 O-C-N 121.366 -0.833 . . . . 0.0 111.441 -179.761 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.21 -34.13 46.92 Favored Glycine 0 N--CA 1.499 2.845 0 O-C-N 120.95 -1.094 . . . . 0.0 110.588 179.939 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -54.57 -31.03 55.96 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 120.913 -1.346 . . . . 0.0 110.879 179.818 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -54.09 -37.61 64.45 Favored 'General case' 0 N--CA 1.512 2.664 0 O-C-N 120.984 -1.073 . . . . 0.0 110.169 179.756 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.2 mptt -59.11 -36.4 75.12 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.154 -0.966 . . . . 0.0 110.224 179.492 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.666 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.7 pt -116.9 36.04 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.973 0 O-C-N 121.089 -1.007 . . . . 0.0 110.527 179.705 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.434 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.6 OUTLIER -83.97 -42.71 0.77 Allowed Pre-proline 0 N--CA 1.509 2.499 0 O-C-N 121.095 -1.003 . . . . 0.0 113.264 -179.092 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.434 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.7 Cg_endo -75.95 -38.57 1.17 Allowed 'Trans proline' 0 N--CA 1.487 1.126 0 O-C-N 122.596 0.787 . . . . 0.0 111.631 -178.292 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.735 HG21 ' CE2' ' A' ' 62' ' ' TYR . 68.2 m -60.27 -43.86 95.81 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 120.991 -1.068 . . . . 0.0 109.99 -179.768 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.666 HD12 ' O ' ' A' ' 19' ' ' ILE . 2.2 mt -62.88 -37.92 88.8 Favored 'General case' 0 N--CA 1.507 2.387 0 C-N-CA 119.331 -0.947 . . . . 0.0 109.689 179.435 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 4.1 m -57.5 -37.51 73.1 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.101 -0.999 . . . . 0.0 110.24 179.627 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -58.01 -38.64 76.55 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.075 -1.015 . . . . 0.0 109.997 179.699 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.763 ' CD2' HD22 ' A' ' 55' ' ' LEU . 13.9 m-85 -57.76 -39.32 77.14 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.178 -0.951 . . . . 0.0 110.26 179.821 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.64 -22.53 65.35 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.199 -0.938 . . . . 0.0 111.668 -179.554 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.54 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.7 mp -80.22 -34.12 14.69 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.469 0 O-C-N 120.842 -1.161 . . . . 0.0 109.978 179.931 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 40.4 tt0 -81.29 -34.11 32.19 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.908 -1.12 . . . . 0.0 109.514 178.786 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.748 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -76.64 -32.7 58.17 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.062 -1.024 . . . . 0.0 109.841 178.769 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -68.76 -34.94 76.44 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 120.969 -1.082 . . . . 0.0 109.878 179.307 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.74 -41.07 79.47 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.047 -1.033 . . . . 0.0 109.647 179.564 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.468 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -65.57 -40.98 93.37 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.181 -0.95 . . . . 0.0 109.499 179.342 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 -58.33 -34.64 70.84 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.212 -0.93 . . . . 0.0 110.507 -179.996 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.37 -39.17 10.16 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 120.939 -1.101 . . . . 0.0 110.678 -179.904 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 N--CA 1.511 2.576 0 O-C-N 121.128 -0.982 . . . . 0.0 110.139 -179.963 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 67.1 m . . . . . 0 N--CA 1.496 1.856 0 CA-C-O 120.64 0.257 . . . . 0.0 110.393 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -55.1 -36.87 66.15 Favored 'General case' 0 N--CA 1.512 2.652 0 O-C-N 121.19 -0.944 . . . . 0.0 110.069 179.628 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -58.98 -39.99 83.46 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.124 -0.985 . . . . 0.0 109.985 179.651 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.2 tp60 -61.49 -40.27 93.97 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.121 -0.987 . . . . 0.0 109.82 179.695 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.43 HD23 HD12 ' A' ' 52' ' ' ILE . 94.3 mt -66.51 -34.63 78.35 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.213 -0.929 . . . . 0.0 110.371 179.783 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.488 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 37.3 m0 -58.52 -36.83 74.45 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.037 -1.039 . . . . 0.0 109.449 179.703 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -66.66 -33.7 76.23 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.757 -1.214 . . . . 0.0 109.227 177.96 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.748 HG23 ' CG ' ' A' ' 30' ' ' LEU . 75.5 mt -70.33 -54.61 17.77 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 O-C-N 120.986 -1.071 . . . . 0.0 109.323 179.285 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.501 ' CE ' ' HB2' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -60.71 -32.64 71.87 Favored 'General case' 0 N--CA 1.508 2.465 0 C-N-CA 118.61 -1.236 . . . . 0.0 109.54 178.868 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.38 -39.59 87.82 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 120.875 -1.14 . . . . 0.0 109.398 179.022 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.763 HD22 ' CD2' ' A' ' 26' ' ' PHE . 21.2 mt -54.59 -34.31 61.77 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.097 -1.002 . . . . 0.0 110.012 179.242 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.453 ' CE1' ' HB2' ' A' ' 88' ' ' ASP . 82.2 t60 -56.46 -40.23 74.49 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 120.991 -1.068 . . . . 0.0 109.626 179.184 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.43 ' CD2' HD21 ' A' ' 91' ' ' LEU . 7.5 m170 -61.23 -49.1 78.49 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.206 -0.934 . . . . 0.0 108.991 178.966 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -62.72 -41.01 98.95 Favored 'General case' 0 N--CA 1.504 2.249 0 C-N-CA 119.417 -0.913 . . . . 0.0 108.87 178.747 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.456 ' HD2' ' CD2' ' A' ' 26' ' ' PHE . 2.5 mtp85 -61.18 -45.9 92.7 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.247 -0.908 . . . . 0.0 109.302 179.087 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 93.2 p -65.9 -40.02 91.13 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.231 -0.918 . . . . 0.0 109.194 179.226 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 24.0 ttt85 -65.17 -38.73 91.48 Favored 'General case' 0 N--CA 1.508 2.452 0 C-N-CA 119.212 -0.995 . . . . 0.0 109.453 179.082 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.735 ' CE2' HG21 ' A' ' 22' ' ' THR . 43.0 t80 -61.21 -48.3 82.14 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.124 -0.985 . . . . 0.0 109.52 179.507 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.707 HD12 ' HB2' ' A' ' 87' ' ' ALA . 86.9 mt -76.77 -41.66 33.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.3 0 O-C-N 121.217 -0.927 . . . . 0.0 109.216 179.399 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.443 ' OH ' ' NH1' ' A' ' 96' ' ' ARG . 46.8 t80 -59.54 -31.14 69.13 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.253 -0.904 . . . . 0.0 109.831 178.71 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 59.7 m -80.67 -37.52 30.7 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 120.917 -1.115 . . . . 0.0 110.364 179.837 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.608 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -82.96 -32.44 27.1 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 120.942 -1.099 . . . . 0.0 112.512 -179.061 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.487 ' N ' HD12 ' A' ' 66' ' ' LEU . 62.1 t80 -86.52 -35.31 19.64 Favored 'General case' 0 N--CA 1.512 2.654 0 O-C-N 120.696 -1.253 . . . . 0.0 111.916 -179.207 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -98.37 -23.83 15.44 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.851 -1.156 . . . . 0.0 112.8 -178.29 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.421 ' HE2' ' CD2' ' A' ' 64' ' ' TYR . 0.7 OUTLIER -114.8 -56.45 2.38 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.617 -1.302 . . . . 0.0 111.26 -179.311 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.424 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 6.6 ttt85 -67.67 -30.65 70.24 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.067 -1.02 . . . . 0.0 110.63 -179.906 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 tttm 59.08 44.72 15.67 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 120.829 -1.169 . . . . 0.0 110.164 -179.817 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -114.24 37.05 3.47 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.307 -0.871 . . . . 0.0 109.716 179.181 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.809 HG13 HD23 ' A' ' 77' ' ' LEU . 14.6 tt -157.83 162.65 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.253 -0.904 . . . . 0.0 110.14 -179.694 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -108.74 148.89 29.81 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.098 -1.001 . . . . 0.0 110.226 179.759 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.7 tttm -46.6 -32.26 3.36 Favored 'General case' 0 N--CA 1.516 2.864 0 O-C-N 121.392 -0.818 . . . . 0.0 111.495 -179.859 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.29 -51.76 66.38 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.869 -1.145 . . . . 0.0 109.253 179.478 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.809 HD23 HG13 ' A' ' 73' ' ' ILE . 44.8 tp -65.34 -44.16 88.6 Favored 'General case' 0 N--CA 1.505 2.292 0 C-N-CA 119.19 -1.004 . . . . 0.0 108.504 178.812 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.686 ' HA ' HD12 ' A' ' 81' ' ' LEU . 18.0 t80 -59.57 -40.61 87.91 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.397 -0.814 . . . . 0.0 109.36 178.979 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -72.68 -42.95 63.7 Favored 'General case' 0 N--CA 1.504 2.249 0 C-N-CA 119.369 -0.932 . . . . 0.0 108.687 178.603 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.743 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 85.9 t90 -56.86 -35.76 69.25 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.228 -0.92 . . . . 0.0 109.432 178.462 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.686 HD12 ' HA ' ' A' ' 78' ' ' TYR . 13.9 mt -66.89 -59.43 3.53 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.159 -0.963 . . . . 0.0 108.963 178.898 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mt -56.83 -27.02 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.614 0 O-C-N 120.938 -1.101 . . . . 0.0 109.99 179.577 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 6.3 mmtm -82.53 -18.54 41.12 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.793 -1.192 . . . . 0.0 111.105 178.669 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.444 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 72.4 mm-40 -108.72 23.32 14.7 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.731 -1.23 . . . . 0.0 111.968 179.983 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.413 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 2.6 tptp 76.51 71.2 0.07 Allowed 'General case' 0 N--CA 1.514 2.76 0 O-C-N 121.198 -0.939 . . . . 0.0 111.827 179.326 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.625 ' HE2' HD13 ' A' ' 23' ' ' LEU . 26.4 m-85 -133.13 -62.43 0.8 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.45 -0.781 . . . . 0.0 109.202 179.354 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.707 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -131.09 162.38 29.99 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.495 -0.753 . . . . 0.0 109.738 179.736 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.453 ' HB2' ' CE1' ' A' ' 56' ' ' HIS . 9.8 t70 -115.12 112.93 23.31 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.109 -0.995 . . . . 0.0 110.093 179.7 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 11.2 mttt -58.07 -37.17 73.94 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.212 -0.93 . . . . 0.0 110.286 -179.975 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.621 HD23 HD22 ' A' ' 106' ' ' LEU . 11.2 tp -60.61 -37.12 80.37 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.122 -0.986 . . . . 0.0 110.385 -179.734 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.43 HD21 ' CD2' ' A' ' 57' ' ' HIS . 55.2 tp -71.42 -49.11 45.07 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.998 -1.064 . . . . 0.0 108.835 179.343 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.415 ' CG2' ' CE1' ' A' ' 64' ' ' TYR . 51.7 mt -62.02 -38.93 81.99 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.307 0 O-C-N 121.124 -0.985 . . . . 0.0 108.347 178.245 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.32 -37.74 83.8 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.179 -0.95 . . . . 0.0 109.157 178.333 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.415 ' HB3' ' CD2' ' A' ' 103' ' ' LEU . 7.2 mmtm -57.89 -42.42 84.58 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.062 -1.024 . . . . 0.0 109.754 179.469 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.9 m0 -67.01 -31.65 72.35 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.231 -0.918 . . . . 0.0 110.869 -179.778 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.443 ' NH1' ' OH ' ' A' ' 64' ' ' TYR . 0.0 OUTLIER -77.39 -32.62 54.96 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.926 -1.109 . . . . 0.0 110.426 178.89 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 15.6 mmtt -54.98 -176.57 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.677 0 O-C-N 120.935 -1.103 . . . . 0.0 110.367 179.575 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 68.1 m -106.56 139.71 40.58 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.238 -0.914 . . . . 0.0 109.658 179.37 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.99 -22.05 41.98 Favored Glycine 0 N--CA 1.494 2.507 0 C-N-CA 119.83 -1.176 . . . . 0.0 110.735 -179.365 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -92.35 58.17 3.16 Favored 'General case' 0 N--CA 1.504 2.248 0 CA-C-N 119.254 1.527 . . . . 0.0 110.193 179.909 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -78.39 -38.61 41.31 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.076 -1.015 . . . . 0.0 109.865 179.39 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -113.99 79.66 1.28 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.095 -1.003 . . . . 0.0 109.753 179.664 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.953 HD13 HD13 ' A' ' 109' ' ' ILE . 14.3 tp -115.9 137.1 52.41 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.217 -0.927 . . . . 0.0 109.991 -179.49 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.423 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.9 p -108.39 -38.76 5.63 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.262 -0.899 . . . . 0.0 112.025 179.81 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.859 ' O ' HD11 ' A' ' 103' ' ' LEU . 5.4 m -139.29 -170.31 2.86 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 120.36 -1.463 . . . . 0.0 109.718 178.881 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.621 HD22 HD23 ' A' ' 90' ' ' LEU . 12.4 mt -97.88 -35.58 10.45 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 120.896 -1.128 . . . . 0.0 110.84 179.32 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 -102.49 33.69 3.06 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.819 -1.176 . . . . 0.0 109.264 177.819 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.665 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.313 1.7 t -128.48 16.42 6.52 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.186 -0.946 . . . . 0.0 108.988 -179.017 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.953 HD13 HD13 ' A' ' 103' ' ' LEU . 1.3 pt -157.91 35.94 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 120.68 -1.263 . . . . 0.0 111.114 -178.732 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.728 ' C ' HG23 ' A' ' 119' ' ' THR . 6.1 mt-30 . . . . . 0 N--CA 1.501 2.111 0 O-C-N 120.637 -1.29 . . . . 0.0 111.558 -178.743 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.728 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.2 OUTLIER . . . . . 0 N--CA 1.5 2.073 0 CA-C-O 121.105 0.478 . . . . 0.0 110.938 . . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.427 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 46.0 t -113.71 156.53 23.61 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.509 -0.744 . . . . 0.0 109.251 179.466 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.721 HG23 ' CE1' ' A' ' 142' ' ' PHE . 15.4 tt -75.0 -29.88 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.338 0 C-N-CA 119.097 -1.041 . . . . 0.0 111.708 -179.517 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.505 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 12.3 p -55.14 -33.56 63.02 Favored 'General case' 0 N--CA 1.514 2.746 0 O-C-N 120.444 -1.41 . . . . 0.0 109.875 -179.902 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 7.5 tpt180 -59.49 -34.01 72.05 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.042 -1.036 . . . . 0.0 108.698 176.885 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.3 t -68.7 116.55 41.9 Favored Pre-proline 0 N--CA 1.507 2.389 0 O-C-N 121.147 -0.971 . . . . 0.0 109.801 179.271 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -66.11 179.48 1.89 Allowed 'Trans proline' 0 N--CA 1.488 1.189 0 O-C-N 123.015 1.008 . . . . 0.0 110.597 179.1 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.9 tpt180 -75.1 -40.26 60.08 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.259 -0.901 . . . . 0.0 110.154 179.979 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.96 -41.4 91.85 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.141 -0.975 . . . . 0.0 109.945 -179.929 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -63.72 -40.82 97.7 Favored 'General case' 0 N--CA 1.507 2.394 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.724 179.761 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.449 HD22 HG21 ' A' ' 140' ' ' VAL . 12.3 mt -62.19 -40.92 97.67 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.174 -0.954 . . . . 0.0 109.696 179.665 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -57.71 -37.52 73.67 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.132 -0.98 . . . . 0.0 110.219 179.853 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -58.21 -37.49 74.92 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.045 -1.034 . . . . 0.0 110.42 179.86 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -68.37 -40.08 81.55 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.204 -0.935 . . . . 0.0 109.848 179.798 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.59 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -68.09 -38.24 82.12 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.112 -0.993 . . . . 0.0 109.968 179.59 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 29.9 mtp85 -68.07 -32.03 72.07 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.107 -0.996 . . . . 0.0 110.586 179.59 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 4.3 mtmp? -79.62 -31.19 41.63 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 120.99 -1.069 . . . . 0.0 110.992 -179.934 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 2.6 mmtt -100.57 22.94 11.04 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 120.884 -1.135 . . . . 0.0 111.761 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.08 46.92 42.03 Favored Glycine 0 N--CA 1.501 2.969 0 O-C-N 120.745 -1.222 . . . . 0.0 110.998 179.201 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.59 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.7 t -146.46 -167.65 2.8 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.095 -1.239 . . . . 0.0 110.5 179.855 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -123.61 171.11 9.79 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.304 -0.872 . . . . 0.0 110.357 -179.913 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.449 HG21 HD22 ' A' ' 129' ' ' LEU . 9.1 p -157.99 161.0 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 O-C-N 121.359 -0.838 . . . . 0.0 110.672 -179.926 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 29.4 t -169.9 100.99 0.3 Allowed 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.137 -0.977 . . . . 0.0 111.074 179.859 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.721 ' CE1' HG23 ' A' ' 121' ' ' ILE . 87.8 t80 -97.85 156.72 16.46 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.231 -0.918 . . . . 0.0 110.203 179.643 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 20.3 m80 -136.23 -61.74 0.69 Allowed 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.782 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -145.84 147.67 32.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.563 -0.711 . . . . 0.0 109.373 178.896 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 145' ' ' CYS . . . . . 0.436 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 29.5 p -88.33 157.04 18.85 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.074 -1.016 . . . . 0.0 111.152 -179.344 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.2 p -74.91 -24.1 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.403 0 O-C-N 121.319 -0.863 . . . . 0.0 111.753 -179.488 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 62.5 m170 -52.73 -44.89 66.7 Favored 'General case' 0 N--CA 1.516 2.836 0 O-C-N 120.715 -1.241 . . . . 0.0 109.274 179.559 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.501 ' HB2' ' CE ' ' A' ' 53' ' ' MET . 29.4 p -142.66 -178.89 6.0 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 121.451 -0.78 . . . . 0.0 110.564 179.619 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 149' ' ' GLY . . . . . 0.413 ' CA ' ' CE3' ' A' ' 50' ' ' TRP . . . -92.43 61.71 2.45 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 107.526 -2.23 . . . . 0.0 107.526 178.035 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 15.9 t -100.66 138.49 37.65 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.366 -1.079 . . . . 0.0 109.336 -179.053 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -93.27 56.43 2.48 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.163 -0.961 . . . . 0.0 109.648 179.468 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 63.17 96.71 0.01 OUTLIER Glycine 0 N--CA 1.487 2.041 0 N-CA-C 110.055 -1.218 . . . . 0.0 110.055 179.71 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 28.7 p -104.82 118.55 36.84 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.282 -1.128 . . . . 0.0 110.128 179.291 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -118.97 136.16 54.24 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.758 -1.214 . . . . 0.0 110.099 -179.433 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.492 1.635 0 O-C-N 121.269 -0.894 . . . . 0.0 110.285 -179.969 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.692 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.5 2.036 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 . . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.4 ' HG2' HD13 ' A' ' 77' ' ' LEU . 44.5 Cg_endo -69.97 160.0 51.24 Favored 'Trans proline' 0 C--N 1.316 -1.166 0 O-C-N 123.353 1.186 . . . . 0.0 110.95 -179.727 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -48.96 -31.92 8.23 Favored 'General case' 0 N--CA 1.515 2.804 0 O-C-N 121.411 -0.805 . . . . 0.0 111.254 -179.821 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.94 -32.81 35.04 Favored Glycine 0 N--CA 1.498 2.819 0 O-C-N 120.997 -1.064 . . . . 0.0 110.711 179.782 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -55.24 -33.64 63.31 Favored 'General case' 0 N--CA 1.511 2.596 0 O-C-N 120.876 -1.367 . . . . 0.0 110.709 179.861 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -54.09 -37.17 63.97 Favored 'General case' 0 N--CA 1.512 2.639 0 O-C-N 121.048 -1.033 . . . . 0.0 110.313 179.772 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.5 mttt -58.58 -36.44 73.97 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.234 -0.917 . . . . 0.0 110.279 179.592 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.875 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.3 pt -116.5 36.73 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.066 -1.022 . . . . 0.0 110.524 179.747 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.427 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -83.75 -44.3 0.8 Allowed Pre-proline 0 N--CA 1.509 2.507 0 O-C-N 121.119 -0.988 . . . . 0.0 113.161 -179.087 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.0 Cg_endo -75.97 -36.36 2.05 Favored 'Trans proline' 0 N--CA 1.486 1.069 0 O-C-N 122.606 0.792 . . . . 0.0 111.872 -178.016 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.809 HG21 ' CE2' ' A' ' 62' ' ' TYR . 89.9 m -59.51 -41.35 89.71 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 120.926 -1.109 . . . . 0.0 110.044 -179.691 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.875 HD12 ' O ' ' A' ' 19' ' ' ILE . 4.9 mt -66.34 -40.85 90.11 Favored 'General case' 0 N--CA 1.508 2.428 0 C-N-CA 119.351 -0.94 . . . . 0.0 109.364 179.318 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.08 -34.9 70.64 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.214 -0.929 . . . . 0.0 110.221 179.4 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -56.84 -36.53 70.12 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 121.069 -1.019 . . . . 0.0 110.327 179.691 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.598 ' CD1' HD22 ' A' ' 55' ' ' LEU . 11.3 m-85 -57.84 -38.35 75.48 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.117 -0.989 . . . . 0.0 110.527 179.882 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -58.54 -34.7 71.3 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.156 -0.965 . . . . 0.0 110.648 -179.875 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.2 mp -70.14 -40.73 78.59 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.117 -0.989 . . . . 0.0 108.823 179.409 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 26.1 tp60 -69.06 -47.14 66.06 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.306 -0.958 . . . . 0.0 108.769 178.794 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.018 HD11 HG23 ' A' ' 52' ' ' ILE . 2.3 tp -60.52 -36.84 79.37 Favored 'General case' 0 N--CA 1.509 2.501 0 C-N-CA 119.401 -0.92 . . . . 0.0 109.525 178.759 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.1 -37.46 71.96 Favored 'General case' 0 N--CA 1.51 2.525 0 O-C-N 121.093 -1.004 . . . . 0.0 110.326 179.788 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -63.36 -50.36 70.23 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.194 -1.002 . . . . 0.0 109.662 -179.777 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.482 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -68.69 -40.36 80.11 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 119.058 -1.057 . . . . 0.0 109.057 178.944 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -60.94 -33.2 72.81 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.285 -0.884 . . . . 0.0 110.223 179.396 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.2 mmmt -93.83 -36.84 12.05 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.063 -1.023 . . . . 0.0 110.709 179.924 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.5 t70 . . . . . 0 N--CA 1.511 2.583 0 O-C-N 121.097 -1.002 . . . . 0.0 110.451 -179.945 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.494 1.762 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.3 m-80 -57.6 -40.0 78.11 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.239 -0.913 . . . . 0.0 109.752 179.611 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -60.81 -37.61 82.58 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.273 -0.892 . . . . 0.0 109.906 179.421 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.4 ' CG ' ' HA ' ' A' ' 33' ' ' ALA . 38.0 tp60 -60.15 -44.05 95.27 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 121.137 -0.977 . . . . 0.0 109.912 179.881 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 83.3 mt -60.19 -38.04 82.07 Favored 'General case' 0 N--CA 1.509 2.505 0 C-N-CA 119.368 -0.933 . . . . 0.0 109.98 179.731 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.505 ' O ' ' HE3' ' A' ' 53' ' ' MET . 39.6 m0 -58.98 -34.03 71.35 Favored 'General case' 0 N--CA 1.509 2.505 0 C-N-CA 119.338 -0.945 . . . . 0.0 109.469 179.548 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -66.6 -33.47 75.73 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 120.628 -1.295 . . . . 0.0 109.443 178.073 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 1.018 HG23 HD11 ' A' ' 30' ' ' LEU . 16.5 mt -70.47 -55.37 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.234 0 O-C-N 120.971 -1.081 . . . . 0.0 109.49 179.336 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.505 ' HE3' ' O ' ' A' ' 50' ' ' TRP . 0.0 OUTLIER -58.97 -32.2 69.43 Favored 'General case' 0 N--CA 1.509 2.475 0 C-N-CA 118.763 -1.175 . . . . 0.0 109.78 179.212 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -61.09 -40.39 93.55 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.886 -1.134 . . . . 0.0 109.267 178.96 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.598 HD22 ' CD1' ' A' ' 26' ' ' PHE . 30.4 mt -55.0 -31.95 61.41 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.206 -0.934 . . . . 0.0 110.117 179.084 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.446 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 23.6 t60 -58.04 -39.64 78.93 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 120.984 -1.073 . . . . 0.0 110.038 179.645 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.442 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 8.7 m170 -59.58 -47.12 86.8 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.066 -1.022 . . . . 0.0 109.224 179.329 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -62.77 -38.54 91.0 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.299 -0.876 . . . . 0.0 109.176 178.789 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.443 ' HG2' ' CE1' ' A' ' 26' ' ' PHE . 0.7 OUTLIER -62.07 -47.07 86.33 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.193 -0.942 . . . . 0.0 109.555 179.441 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 82.9 p -66.64 -40.31 88.65 Favored 'General case' 0 N--CA 1.501 2.125 0 C-N-CA 119.253 -0.979 . . . . 0.0 109.032 179.142 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -63.74 -37.65 88.16 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.261 -0.976 . . . . 0.0 109.427 178.883 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.809 ' CE2' HG21 ' A' ' 22' ' ' THR . 41.6 t80 -62.18 -52.37 64.07 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.093 -1.004 . . . . 0.0 109.372 179.522 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.841 HD12 ' HB2' ' A' ' 87' ' ' ALA . 81.1 mt -72.27 -38.64 62.41 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.38 0 C-N-CA 119.371 -0.932 . . . . 0.0 109.298 179.274 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.497 ' CD1' ' CD2' ' A' ' 68' ' ' TYR . 68.2 t80 -63.94 -37.49 87.6 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.257 -0.902 . . . . 0.0 109.645 179.001 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 80.0 m -72.06 -37.04 69.74 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 120.949 -1.094 . . . . 0.0 110.811 -179.74 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.573 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.6 pp -82.87 -31.03 28.17 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 120.894 -1.128 . . . . 0.0 112.144 -179.109 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.447 ' HD2' HG23 ' A' ' 73' ' ' ILE . 60.5 t80 -85.95 -33.97 21.0 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 120.674 -1.266 . . . . 0.0 111.663 -179.35 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.497 ' CD2' ' CD1' ' A' ' 64' ' ' TYR . 21.7 m-85 -95.97 -27.07 15.31 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.859 -1.151 . . . . 0.0 112.355 -178.77 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.2 mttt -111.92 -61.2 1.75 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.676 -1.265 . . . . 0.0 111.269 -179.626 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.407 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 0.3 OUTLIER -60.11 -31.79 70.38 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 121.037 -1.04 . . . . 0.0 110.708 -179.532 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.5 mttt 56.63 41.6 28.2 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.803 -1.186 . . . . 0.0 110.177 -179.61 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.25 36.12 3.68 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.411 -0.806 . . . . 0.0 109.882 179.123 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.703 HG13 HD23 ' A' ' 77' ' ' LEU . 14.2 tt -153.77 162.74 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.932 0 O-C-N 121.254 -0.904 . . . . 0.0 109.889 -179.825 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 4.3 m -108.15 146.96 31.96 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.064 -1.022 . . . . 0.0 110.273 179.941 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -46.7 -32.37 3.52 Favored 'General case' 0 N--CA 1.515 2.798 0 O-C-N 121.34 -0.85 . . . . 0.0 111.457 -179.938 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -61.69 -50.19 73.45 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.034 -1.041 . . . . 0.0 109.285 179.488 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.703 HD23 HG13 ' A' ' 73' ' ' ILE . 31.7 tp -67.51 -43.64 80.37 Favored 'General case' 0 N--CA 1.504 2.253 0 C-N-CA 119.091 -1.044 . . . . 0.0 108.505 178.774 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.44 ' CE1' HG22 ' A' ' 63' ' ' ILE . 13.3 t80 -60.58 -38.24 83.96 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.3 -0.875 . . . . 0.0 109.501 179.201 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.468 ' O ' HG22 ' A' ' 82' ' ' ILE . 13.6 t0 -76.17 -41.72 48.79 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.08 -1.013 . . . . 0.0 108.829 178.813 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.692 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 84.9 t90 -59.2 -38.99 81.23 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.202 -0.937 . . . . 0.0 109.226 178.795 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.509 HD11 ' HG ' ' A' ' 77' ' ' LEU . 16.5 mt -66.33 -55.56 15.37 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.198 -0.939 . . . . 0.0 109.147 179.04 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.62 HD12 ' HB3' ' A' ' 87' ' ' ALA . 0.9 OUTLIER -56.2 -27.24 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.517 0 O-C-N 121.115 -0.99 . . . . 0.0 110.644 -179.788 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.9 mttt -89.08 -20.33 24.47 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 120.917 -1.115 . . . . 0.0 111.54 179.259 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.452 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 10.5 mm-40 -101.53 23.46 11.1 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 120.764 -1.21 . . . . 0.0 111.928 179.985 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.406 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 7.3 ttmm 76.05 70.79 0.08 Allowed 'General case' 0 N--CA 1.512 2.638 0 O-C-N 121.12 -0.987 . . . . 0.0 111.872 179.347 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.503 ' HE2' HD13 ' A' ' 23' ' ' LEU . 30.3 m-85 -133.33 -62.86 0.78 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.454 -0.779 . . . . 0.0 109.075 179.214 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.841 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -128.98 -177.0 4.03 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.496 -0.752 . . . . 0.0 109.216 179.356 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.446 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 5.5 t0 -130.91 108.61 9.95 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.055 -1.028 . . . . 0.0 110.608 -179.849 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.505 ' N ' HD11 ' A' ' 82' ' ' ILE . 3.6 mtpm? -62.97 -38.09 89.72 Favored 'General case' 0 N--CA 1.508 2.425 0 C-N-CA 119.417 -0.913 . . . . 0.0 109.78 179.506 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.858 HD23 HD22 ' A' ' 106' ' ' LEU . 7.1 tp -58.57 -37.95 76.84 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.106 -0.996 . . . . 0.0 110.131 179.936 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.491 ' HA ' HD21 ' A' ' 106' ' ' LEU . 65.4 tp -71.66 -49.08 43.15 Favored 'General case' 0 N--CA 1.506 2.349 0 C-N-CA 119.148 -1.021 . . . . 0.0 108.651 179.043 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.439 HD13 ' CD1' ' A' ' 64' ' ' TYR . 61.5 mt -60.33 -36.15 67.06 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.435 0 C-N-CA 119.389 -0.924 . . . . 0.0 108.764 178.323 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.12 -38.89 75.71 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.084 -1.01 . . . . 0.0 109.01 178.283 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.427 ' HB3' ' CD2' ' A' ' 103' ' ' LEU . 6.0 mmtt -57.44 -41.75 81.07 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.079 -1.013 . . . . 0.0 109.535 179.272 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.5 m0 -68.63 -32.55 72.49 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.248 -0.907 . . . . 0.0 110.54 179.853 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.457 ' NE ' ' OH ' ' A' ' 64' ' ' TYR . 0.1 OUTLIER -82.62 -30.31 29.54 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.952 -1.092 . . . . 0.0 110.611 179.226 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.7 mmtp -54.16 -176.55 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.613 0 O-C-N 120.991 -1.068 . . . . 0.0 110.552 179.798 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -105.44 134.0 49.26 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.203 -0.935 . . . . 0.0 109.736 179.314 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.12 5.5 56.17 Favored Glycine 0 N--CA 1.493 2.456 0 C-N-CA 120.113 -1.041 . . . . 0.0 111.28 -179.54 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.412 ' CZ ' ' HD2' ' A' ' 94' ' ' LYS . 48.4 m-85 -112.83 49.86 0.91 Allowed 'General case' 0 N--CA 1.497 1.922 0 CA-C-N 119.594 1.697 . . . . 0.0 110.036 179.752 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -65.15 -39.85 93.56 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.062 -1.023 . . . . 0.0 110.027 -179.962 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.56 108.44 15.98 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.172 -0.955 . . . . 0.0 110.131 179.942 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.923 HD13 HD13 ' A' ' 109' ' ' ILE . 14.1 tp -143.65 136.09 27.05 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.187 -0.946 . . . . 0.0 110.037 -179.699 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.442 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.6 p -110.53 -38.61 5.15 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.322 -0.861 . . . . 0.0 112.093 179.876 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.853 ' O ' HD11 ' A' ' 103' ' ' LEU . 4.6 m -138.72 -171.6 3.11 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 120.333 -1.479 . . . . 0.0 109.405 178.817 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.858 HD22 HD23 ' A' ' 90' ' ' LEU . 12.5 mt -96.59 -35.51 11.04 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.982 -1.074 . . . . 0.0 110.586 179.401 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 12.0 ttt85 -102.51 33.59 3.1 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 120.899 -1.125 . . . . 0.0 109.19 177.919 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.678 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.303 1.7 t -128.98 17.74 6.15 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.283 -0.886 . . . . 0.0 109.256 -179.109 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.923 HD13 HD13 ' A' ' 103' ' ' LEU . 1.2 pt -158.57 38.39 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 O-C-N 120.897 -1.127 . . . . 0.0 110.369 -178.905 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.632 ' C ' HG23 ' A' ' 119' ' ' THR . 19.9 mt-30 . . . . . 0 N--CA 1.508 2.464 0 O-C-N 120.835 -1.165 . . . . 0.0 110.718 -179.14 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.632 HG23 ' C ' ' A' ' 110' ' ' GLN . 2.9 m . . . . . 0 N--CA 1.497 1.887 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 . . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.45 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 46.7 t -100.8 155.16 18.08 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.301 -0.875 . . . . 0.0 109.365 179.151 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.798 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -73.03 -36.26 50.5 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.324 0 O-C-N 121.105 -0.997 . . . . 0.0 110.853 -179.539 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.426 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 5.1 p -54.72 -33.03 60.5 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 120.773 -1.204 . . . . 0.0 110.989 -178.928 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -60.13 -36.64 77.93 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 120.858 -1.151 . . . . 0.0 109.414 178.368 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 57.1 t -78.53 124.9 85.28 Favored Pre-proline 0 N--CA 1.504 2.233 0 O-C-N 121.213 -0.929 . . . . 0.0 109.702 179.612 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.515 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.1 Cg_endo -64.98 175.06 4.08 Favored 'Trans proline' 0 N--CA 1.488 1.18 0 O-C-N 123.154 1.081 . . . . 0.0 110.712 179.623 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 11.1 tpp85 -75.07 -37.34 61.65 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.249 -0.907 . . . . 0.0 110.615 -179.679 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.05 -40.97 82.29 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 120.93 -1.106 . . . . 0.0 109.997 -179.704 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -68.79 -41.48 78.66 Favored 'General case' 0 N--CA 1.506 2.368 0 C-N-CA 119.325 -0.95 . . . . 0.0 109.259 179.252 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.596 HD11 HD11 ' A' ' 121' ' ' ILE . 2.8 mt -64.02 -39.18 93.53 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.295 -0.878 . . . . 0.0 109.633 179.233 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -60.98 -40.04 91.93 Favored 'General case' 0 N--CA 1.508 2.454 0 C-N-CA 119.408 -0.917 . . . . 0.0 109.929 179.765 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.93 -38.38 82.21 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.16 -0.962 . . . . 0.0 110.316 179.958 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -63.99 -43.39 95.84 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.123 -0.985 . . . . 0.0 109.981 179.937 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -64.03 -39.17 93.49 Favored 'General case' 0 N--CA 1.508 2.442 0 C-N-CA 119.373 -0.931 . . . . 0.0 109.943 179.846 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 3.8 ttt85 -68.03 -38.87 83.05 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.128 -0.982 . . . . 0.0 109.975 179.648 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 50.1 mmtt -70.9 -35.34 72.25 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.165 -0.959 . . . . 0.0 110.346 179.655 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 8.6 tttt -82.57 -17.2 45.72 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 120.994 -1.066 . . . . 0.0 111.726 179.714 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 91.5 31.22 9.71 Favored Glycine 0 N--CA 1.494 2.526 0 O-C-N 120.702 -1.249 . . . . 0.0 110.121 -179.744 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.6 t -140.94 -161.48 1.22 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.023 -1.28 . . . . 0.0 109.79 179.677 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -133.73 148.72 51.45 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.123 -0.985 . . . . 0.0 110.179 179.993 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.447 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.9 p -132.64 161.37 41.64 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.211 -0.931 . . . . 0.0 110.326 -179.879 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 31.2 t -166.62 87.87 0.33 Allowed 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.227 -0.921 . . . . 0.0 110.904 179.988 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.788 ' CG ' HD12 ' A' ' 121' ' ' ILE . 53.5 t80 -97.29 160.87 14.08 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.299 -0.875 . . . . 0.0 110.499 -179.823 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 4.5 m80 -137.61 -60.47 0.65 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.553 -0.717 . . . . 0.0 109.075 179.061 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -137.27 149.84 47.39 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.359 -0.838 . . . . 0.0 109.324 178.803 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 26.3 p -92.11 155.31 18.14 Favored 'General case' 0 N--CA 1.505 2.276 0 C-N-CA 119.219 -0.992 . . . . 0.0 110.929 -179.581 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.5 p -73.31 -26.01 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 O-C-N 121.368 -0.833 . . . . 0.0 111.539 -179.489 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 62.3 m170 -51.0 -45.84 61.31 Favored 'General case' 0 N--CA 1.516 2.849 0 O-C-N 120.784 -1.198 . . . . 0.0 109.736 179.895 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.496 ' HB2' ' CE ' ' A' ' 53' ' ' MET . 29.5 p -142.44 -179.52 6.33 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.341 -0.849 . . . . 0.0 110.766 179.733 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 149' ' ' GLY . . . . . 0.456 ' CA ' ' CE3' ' A' ' 50' ' ' TRP . . . -90.43 63.1 3.05 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 107.836 -2.106 . . . . 0.0 107.836 178.161 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 27.0 t -105.69 139.37 40.38 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.389 -1.065 . . . . 0.0 109.79 -178.986 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 20.4 mmt85 -92.37 56.9 2.87 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 121.165 -0.959 . . . . 0.0 109.556 179.344 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 60.51 95.22 0.01 OUTLIER Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 -179.852 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 p -103.27 126.88 50.67 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.305 -1.114 . . . . 0.0 110.33 179.693 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -142.19 141.67 32.6 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.153 -0.967 . . . . 0.0 109.919 -179.691 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.5 2.067 0 O-C-N 121.189 -0.944 . . . . 0.0 110.574 -179.952 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.728 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.503 2.188 0 N-CA-C 110.475 -0.195 . . . . 0.0 110.475 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.28 162.5 42.25 Favored 'Trans proline' 0 C--N 1.317 -1.109 0 O-C-N 123.225 1.118 . . . . 0.0 110.794 -179.794 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -48.87 -32.05 8.23 Favored 'General case' 0 N--CA 1.514 2.729 0 O-C-N 121.391 -0.818 . . . . 0.0 111.307 -179.784 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.83 -34.33 44.79 Favored Glycine 0 N--CA 1.499 2.88 0 O-C-N 120.994 -1.066 . . . . 0.0 110.53 179.84 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.441 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 18.0 t80 -55.06 -32.69 62.12 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 120.938 -1.33 . . . . 0.0 110.78 179.873 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -54.65 -37.84 66.19 Favored 'General case' 0 N--CA 1.513 2.69 0 O-C-N 120.933 -1.104 . . . . 0.0 110.21 179.71 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.19 -35.65 71.93 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.29 -0.882 . . . . 0.0 110.252 179.49 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.686 HD12 ' CD1' ' A' ' 23' ' ' LEU . 2.8 pt -115.7 36.05 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 121.068 -1.02 . . . . 0.0 110.563 179.65 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.441 ' HD2' ' CE2' ' A' ' 16' ' ' PHE . 3.5 tptm -82.64 -43.35 0.93 Allowed Pre-proline 0 N--CA 1.508 2.474 0 O-C-N 121.028 -1.045 . . . . 0.0 112.802 -179.506 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.435 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.4 Cg_endo -75.76 -37.66 1.59 Allowed 'Trans proline' 0 N--CA 1.486 1.039 0 O-C-N 122.479 0.726 . . . . 0.0 111.345 -178.393 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.865 HG21 ' CE2' ' A' ' 62' ' ' TYR . 72.4 m -61.39 -42.92 99.5 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.071 -1.018 . . . . 0.0 110.125 -179.788 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.686 ' CD1' HD12 ' A' ' 19' ' ' ILE . 3.1 mt -64.48 -41.2 96.62 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.192 -0.943 . . . . 0.0 109.747 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.11 -34.99 72.66 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.088 -1.008 . . . . 0.0 110.149 179.512 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -58.04 -35.46 71.35 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.067 -1.021 . . . . 0.0 110.22 179.505 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.755 ' CD2' HD12 ' A' ' 55' ' ' LEU . 6.7 m-85 -56.73 -44.17 81.39 Favored 'General case' 0 N--CA 1.513 2.687 0 O-C-N 120.972 -1.08 . . . . 0.0 109.999 179.297 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -57.56 -26.52 61.55 Favored 'General case' 0 N--CA 1.506 2.333 0 C-N-CA 119.317 -0.953 . . . . 0.0 110.527 179.419 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 16.6 mm -65.53 -48.61 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.314 0 O-C-N 120.954 -1.091 . . . . 0.0 109.119 179.426 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -67.39 -51.8 47.64 Favored 'General case' 0 N--CA 1.506 2.336 0 C-N-CA 119.251 -0.98 . . . . 0.0 108.72 179.027 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.807 HD21 HG23 ' A' ' 52' ' ' ILE . 0.1 OUTLIER -58.57 -32.37 68.86 Favored 'General case' 0 N--CA 1.508 2.432 0 C-N-CA 119.439 -0.905 . . . . 0.0 109.608 178.65 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.0 mtt-85 -59.82 -43.25 94.62 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 120.967 -1.083 . . . . 0.0 110.077 179.791 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -61.14 -46.04 92.2 Favored 'General case' 0 N--CA 1.508 2.443 0 C-N-CA 119.281 -0.968 . . . . 0.0 109.735 -179.69 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.504 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -70.26 -42.37 72.23 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 119.311 -0.956 . . . . 0.0 108.994 178.984 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.435 ' HG3' HD23 ' A' ' 30' ' ' LEU . 70.2 mt-30 -61.05 -32.22 71.85 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.28 -0.888 . . . . 0.0 110.158 179.341 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.1 mmmt -91.8 -33.94 14.78 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 120.98 -1.075 . . . . 0.0 110.745 179.894 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.8 t0 . . . . . 0 N--CA 1.512 2.645 0 O-C-N 121.032 -1.042 . . . . 0.0 110.278 -179.997 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 N--CA 1.502 2.164 0 CA-C-O 120.439 0.162 . . . . 0.0 110.632 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -58.17 -40.53 81.7 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.041 -1.037 . . . . 0.0 109.961 179.926 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.412 ' HA ' ' CE3' ' A' ' 50' ' ' TRP . 23.0 mt-10 -67.39 -43.81 80.42 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.166 -0.959 . . . . 0.0 109.268 179.368 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 46.6 tp60 -67.43 -41.17 85.25 Favored 'General case' 0 N--CA 1.505 2.285 0 C-N-CA 119.328 -0.949 . . . . 0.0 109.113 179.095 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.424 HD23 HD12 ' A' ' 52' ' ' ILE . 12.5 mt -60.22 -37.18 79.52 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.236 -0.915 . . . . 0.0 109.713 179.222 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.504 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 51.5 m0 -59.91 -36.03 76.14 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.116 -0.99 . . . . 0.0 109.898 179.474 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.489 ' O ' HD22 ' A' ' 55' ' ' LEU . 5.2 tp10 -62.25 -30.09 70.87 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.037 -1.04 . . . . 0.0 109.986 178.501 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.807 HG23 HD21 ' A' ' 30' ' ' LEU . 63.9 mt -72.25 -58.73 4.42 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.233 0 O-C-N 120.979 -1.076 . . . . 0.0 109.373 179.519 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.6 ptm -57.34 -26.67 61.32 Favored 'General case' 0 N--CA 1.512 2.662 0 C-N-CA 118.298 -1.361 . . . . 0.0 109.814 178.77 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.4 mm-40 -60.6 -36.82 79.51 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 120.753 -1.217 . . . . 0.0 109.314 177.915 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.755 HD12 ' CD2' ' A' ' 26' ' ' PHE . 0.6 OUTLIER -53.0 -34.5 56.53 Favored 'General case' 0 N--CA 1.514 2.771 0 O-C-N 120.981 -1.074 . . . . 0.0 109.522 178.84 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.474 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 33.2 t60 -51.23 -39.04 55.76 Favored 'General case' 0 N--CA 1.511 2.582 0 O-C-N 121.062 -1.024 . . . . 0.0 110.42 179.954 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.529 ' CD2' HD21 ' A' ' 91' ' ' LEU . 6.0 m170 -70.24 -53.21 17.95 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.114 -1.034 . . . . 0.0 109.181 178.945 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.437 ' HB3' ' CE2' ' A' ' 26' ' ' PHE . 35.1 tp60 -60.64 -29.92 69.56 Favored 'General case' 0 N--CA 1.504 2.24 0 C-N-CA 119.395 -0.922 . . . . 0.0 110.119 178.893 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.405 ' HD2' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -74.39 -46.65 38.99 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 120.99 -1.069 . . . . 0.0 109.009 179.163 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 86.8 p -67.05 -37.8 84.7 Favored 'General case' 0 N--CA 1.5 2.046 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.124 178.793 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 7.8 ttm-85 -64.27 -37.96 89.34 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 120.985 -1.072 . . . . 0.0 109.653 179.141 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.865 ' CE2' HG21 ' A' ' 22' ' ' THR . 60.9 t80 -63.4 -50.2 70.8 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.21 -0.931 . . . . 0.0 109.497 179.451 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.901 HD12 ' HB2' ' A' ' 87' ' ' ALA . 80.8 mt -72.82 -40.12 60.21 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.366 0 O-C-N 121.181 -0.949 . . . . 0.0 109.198 179.202 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.471 ' CE1' HG23 ' A' ' 92' ' ' ILE . 46.5 t80 -60.64 -31.19 70.41 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.233 -0.917 . . . . 0.0 109.989 178.878 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 48.6 m -80.87 -36.17 31.68 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.879 -1.138 . . . . 0.0 110.694 -179.904 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.638 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -82.92 -32.71 27.11 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 120.873 -1.142 . . . . 0.0 112.314 -179.078 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.501 ' N ' HD12 ' A' ' 66' ' ' LEU . 77.4 t80 -86.5 -35.75 19.41 Favored 'General case' 0 N--CA 1.511 2.61 0 O-C-N 120.624 -1.297 . . . . 0.0 111.901 -179.281 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -98.36 -21.5 16.58 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.859 -1.15 . . . . 0.0 112.882 -178.324 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.411 ' HE2' ' CD2' ' A' ' 64' ' ' TYR . 0.7 OUTLIER -117.7 -57.99 2.07 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.571 -1.331 . . . . 0.0 111.408 -179.262 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.42 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 1.0 OUTLIER -64.45 -30.81 71.84 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 121.005 -1.059 . . . . 0.0 110.71 -179.83 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp 58.45 43.6 19.34 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.769 -1.207 . . . . 0.0 110.127 -179.708 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.04 38.02 3.48 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.383 -0.823 . . . . 0.0 109.744 179.331 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.771 HG13 HD23 ' A' ' 77' ' ' LEU . 13.9 tt -156.47 162.7 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 O-C-N 121.22 -0.925 . . . . 0.0 110.227 -179.644 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 19.5 p -108.11 146.36 32.76 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.076 -1.015 . . . . 0.0 110.078 179.541 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.8 tttt -45.6 -32.82 2.5 Favored 'General case' 0 N--CA 1.516 2.831 0 O-C-N 121.33 -0.856 . . . . 0.0 111.661 -179.78 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -61.54 -49.98 74.49 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.002 -1.061 . . . . 0.0 109.31 179.535 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.771 HD23 HG13 ' A' ' 73' ' ' ILE . 36.6 tp -67.48 -43.09 81.83 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.19 -1.004 . . . . 0.0 108.538 178.765 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.442 ' HB2' ' CD1' ' A' ' 67' ' ' TYR . 17.8 t80 -60.98 -38.14 84.93 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.343 -0.848 . . . . 0.0 109.333 179.008 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.491 ' O ' HG22 ' A' ' 82' ' ' ILE . 9.9 t70 -75.48 -41.05 56.45 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.076 -1.015 . . . . 0.0 108.963 178.75 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.728 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 88.2 t90 -60.21 -38.37 83.1 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.073 -1.017 . . . . 0.0 109.178 178.758 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.468 HD11 ' HG ' ' A' ' 77' ' ' LEU . 16.1 mt -66.37 -54.8 20.27 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.236 -0.915 . . . . 0.0 109.328 179.072 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.491 HG22 ' O ' ' A' ' 79' ' ' ASP . 0.9 OUTLIER -56.03 -27.21 22.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.47 0 O-C-N 121.114 -0.991 . . . . 0.0 110.71 -179.724 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.75 -20.64 24.51 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.96 -1.088 . . . . 0.0 111.533 179.447 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.437 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 68.0 mm-40 -101.48 23.73 10.68 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 120.678 -1.264 . . . . 0.0 111.886 179.936 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.41 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 3.9 ttmm 75.85 71.76 0.08 Allowed 'General case' 0 N--CA 1.511 2.621 0 O-C-N 121.134 -0.979 . . . . 0.0 111.843 179.324 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.658 ' HE2' HD13 ' A' ' 23' ' ' LEU . 31.9 m-85 -134.42 -62.78 0.74 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.418 -0.801 . . . . 0.0 109.2 179.305 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.901 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -131.42 173.54 10.98 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.427 -0.796 . . . . 0.0 109.46 179.478 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.474 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.0 t70 -127.6 127.55 44.03 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.028 -1.045 . . . . 0.0 110.711 -179.872 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -73.65 -35.73 65.3 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 121.338 -0.851 . . . . 0.0 110.018 179.43 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.771 HD23 HD13 ' A' ' 106' ' ' LEU . 12.9 tp -60.3 -39.32 86.51 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.09 -1.006 . . . . 0.0 110.157 179.981 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.529 HD21 ' CD2' ' A' ' 57' ' ' HIS . 56.3 tp -72.81 -49.78 28.3 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.018 -1.051 . . . . 0.0 108.526 179.039 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.471 HG23 ' CE1' ' A' ' 64' ' ' TYR . 52.2 mt -59.12 -34.91 54.81 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.425 0 C-N-CA 119.189 -1.004 . . . . 0.0 108.783 178.16 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.81 -37.95 76.44 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.01 -1.057 . . . . 0.0 108.885 177.951 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.439 ' HD2' ' CZ ' ' A' ' 100' ' ' TYR . 5.2 mmtt -56.74 -42.49 79.36 Favored 'General case' 0 N--CA 1.51 2.561 0 O-C-N 121.001 -1.062 . . . . 0.0 109.41 179.17 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.3 m0 -66.7 -37.47 84.78 Favored 'General case' 0 N--CA 1.507 2.383 0 C-N-CA 119.404 -0.918 . . . . 0.0 109.824 179.441 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.37 -35.52 71.14 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.167 -0.958 . . . . 0.0 110.233 179.266 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.1 mmtp -54.21 -176.44 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.693 0 O-C-N 121.117 -0.989 . . . . 0.0 110.536 179.919 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.45 139.34 39.53 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.206 -0.934 . . . . 0.0 109.715 179.158 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 93.68 8.8 60.52 Favored Glycine 0 N--CA 1.495 2.574 0 C-N-CA 120.172 -1.013 . . . . 0.0 111.138 -179.436 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.55 ' HB3' HD23 ' A' ' 103' ' ' LEU . 45.0 m-85 -116.7 70.03 0.76 Allowed 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 119.486 1.643 . . . . 0.0 109.839 179.694 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -98.34 -35.83 10.19 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.163 -0.961 . . . . 0.0 111.091 -179.614 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.66 59.49 0.98 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.931 -1.106 . . . . 0.0 111.032 -179.448 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.55 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.2 pp -107.88 152.57 24.24 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.027 -1.046 . . . . 0.0 109.616 179.057 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.44 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.4 p -113.18 -27.04 8.14 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.113 -0.992 . . . . 0.0 113.628 -178.929 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.639 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 10.3 m -144.62 -167.71 2.72 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 120.137 -1.602 . . . . 0.0 109.877 179.18 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.771 HD13 HD23 ' A' ' 90' ' ' LEU . 12.5 mt -95.87 -39.87 9.6 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.091 -1.006 . . . . 0.0 109.915 178.88 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.9 ttm-85 -101.68 29.11 5.09 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.06 -1.025 . . . . 0.0 110.054 178.392 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.639 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.299 1.8 t -126.79 16.33 7.45 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.037 -1.039 . . . . 0.0 109.065 -179.661 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.479 HG23 ' O ' ' A' ' 108' ' ' CYS . 1.0 OUTLIER -159.31 39.31 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 O-C-N 120.969 -1.082 . . . . 0.0 110.184 -178.903 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.736 ' C ' HG23 ' A' ' 119' ' ' THR . 5.9 tt0 . . . . . 0 N--CA 1.503 2.2 0 O-C-N 120.918 -1.114 . . . . 0.0 111.19 -178.784 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.736 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.4 m . . . . . 0 N--CA 1.494 1.773 0 CA-C-O 120.676 0.274 . . . . 0.0 110.279 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.431 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 47.2 t -100.73 155.44 17.9 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.348 -0.845 . . . . 0.0 108.988 178.635 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.72 HG23 ' CE1' ' A' ' 142' ' ' PHE . 14.4 tt -77.8 -29.56 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.441 0 O-C-N 121.078 -1.014 . . . . 0.0 112.099 -179.063 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.487 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 14.1 p -55.05 -34.87 63.92 Favored 'General case' 0 N--CA 1.513 2.688 0 O-C-N 120.586 -1.321 . . . . 0.0 110.382 -179.136 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -27.7 64.01 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.066 -1.021 . . . . 0.0 109.586 177.53 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 49.5 t -73.03 118.75 71.13 Favored Pre-proline 0 N--CA 1.508 2.431 0 O-C-N 120.975 -1.078 . . . . 0.0 110.397 179.845 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.411 ' HB3' ' HB1' ' A' ' 154' ' ' ALA . 37.4 Cg_endo -64.57 171.88 7.59 Favored 'Trans proline' 0 N--CA 1.489 1.234 0 O-C-N 123.053 1.028 . . . . 0.0 110.591 178.646 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.11 -38.44 61.14 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.201 -0.937 . . . . 0.0 110.505 -179.85 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.41 -42.73 92.46 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.115 -0.99 . . . . 0.0 110.082 -179.789 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -64.15 -41.55 97.12 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.214 -0.929 . . . . 0.0 109.551 179.703 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.716 ' O ' HG11 ' A' ' 140' ' ' VAL . 9.4 mt -61.0 -39.76 90.94 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.273 -0.892 . . . . 0.0 109.827 179.662 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -59.32 -39.43 83.08 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.174 -0.954 . . . . 0.0 110.144 -179.929 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.97 -39.02 84.22 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.216 -0.927 . . . . 0.0 110.293 -179.975 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -64.51 -40.41 95.59 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.295 -0.878 . . . . 0.0 110.015 -179.935 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.454 ' HB1' ' HA ' ' A' ' 139' ' ' GLN . . . -67.12 -40.25 86.79 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.128 -0.982 . . . . 0.0 109.914 179.762 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 13.0 ttp85 -67.27 -33.56 75.57 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.166 -0.959 . . . . 0.0 110.403 179.526 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 18.6 mmtp -75.35 -31.6 60.61 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.025 -1.047 . . . . 0.0 111.04 -179.986 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -101.79 23.07 11.87 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 120.896 -1.127 . . . . 0.0 111.845 -179.917 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.84 47.0 48.47 Favored Glycine 0 N--CA 1.5 2.911 0 O-C-N 120.72 -1.238 . . . . 0.0 110.913 179.238 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.445 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 10.1 t -146.07 -162.31 1.49 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.137 -1.214 . . . . 0.0 110.254 179.884 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 139' ' ' GLN . . . . . 0.454 ' HA ' ' HB1' ' A' ' 133' ' ' ALA . 77.7 mt-30 -132.79 160.61 36.36 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.039 -1.038 . . . . 0.0 110.177 -179.925 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.716 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.8 p -147.56 161.21 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 O-C-N 121.16 -0.962 . . . . 0.0 110.473 -179.794 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 36.1 t -171.62 108.38 0.25 Allowed 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.126 -0.983 . . . . 0.0 111.039 179.727 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.72 ' CE1' HG23 ' A' ' 121' ' ' ILE . 87.0 t80 -104.15 157.07 17.37 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.106 -0.996 . . . . 0.0 110.649 179.906 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.09 -61.9 0.65 Allowed 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 178.662 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -146.43 148.68 32.54 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.54 -0.725 . . . . 0.0 109.164 178.676 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 145' ' ' CYS . . . . . 0.45 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.4 p -91.68 154.89 18.7 Favored 'General case' 0 N--CA 1.508 2.435 0 C-N-CA 119.011 -1.076 . . . . 0.0 110.983 -179.405 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.4 m -72.6 -25.28 22.48 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.5 0 O-C-N 121.367 -0.833 . . . . 0.0 111.735 -179.362 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 61.2 m170 -49.74 -59.0 4.22 Favored 'General case' 0 N--CA 1.517 2.88 0 O-C-N 120.879 -1.138 . . . . 0.0 110.219 -179.756 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.504 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.3 p -128.0 -163.91 1.32 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.218 -0.926 . . . . 0.0 110.319 179.356 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 149' ' ' GLY . . . . . 0.426 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -101.87 64.26 0.48 Allowed Glycine 0 N--CA 1.491 2.307 0 N-CA-C 107.784 -2.126 . . . . 0.0 107.784 178.278 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 27.6 t -98.95 143.9 28.73 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.36 -1.083 . . . . 0.0 109.724 -179.099 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -100.77 44.3 1.02 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.2 -0.937 . . . . 0.0 109.775 179.41 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 77.69 93.93 0.25 Allowed Glycine 0 N--CA 1.485 1.966 0 N-CA-C 109.872 -1.291 . . . . 0.0 109.872 179.897 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.1 p -108.18 129.01 55.2 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.191 -1.182 . . . . 0.0 110.069 179.67 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 154' ' ' ALA . . . . . 0.411 ' HB1' ' HB3' ' A' ' 125' ' ' PRO . . . -148.36 148.1 29.99 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.187 -0.946 . . . . 0.0 110.245 -179.316 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.495 1.807 0 O-C-N 121.199 -0.938 . . . . 0.0 110.37 179.994 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.784 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.513 2.721 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 . . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -71.91 163.25 39.42 Favored 'Trans proline' 0 C--N 1.318 -1.073 0 O-C-N 123.331 1.174 . . . . 0.0 110.719 -179.889 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -48.36 -32.13 7.09 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.465 -0.772 . . . . 0.0 111.399 -179.784 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.75 -33.35 42.17 Favored Glycine 0 N--CA 1.498 2.802 0 O-C-N 120.994 -1.067 . . . . 0.0 110.59 179.73 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -54.04 -32.43 54.43 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 120.884 -1.363 . . . . 0.0 110.723 179.783 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -54.03 -36.39 62.97 Favored 'General case' 0 N--CA 1.512 2.645 0 O-C-N 121.052 -1.03 . . . . 0.0 110.325 179.682 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.9 mtmt -57.12 -35.14 69.11 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.091 -1.005 . . . . 0.0 110.328 179.507 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.688 ' O ' HD12 ' A' ' 23' ' ' LEU . 3.5 pt -118.21 37.16 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 O-C-N 121.072 -1.018 . . . . 0.0 110.57 179.606 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -82.63 -43.58 0.93 Allowed Pre-proline 0 N--CA 1.508 2.46 0 O-C-N 121.063 -1.023 . . . . 0.0 112.989 -179.545 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.8 Cg_endo -75.44 -38.68 1.32 Allowed 'Trans proline' 0 N--CA 1.486 1.048 0 O-C-N 122.577 0.777 . . . . 0.0 111.529 -178.266 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.864 HG21 ' CE2' ' A' ' 62' ' ' TYR . 89.9 m -58.83 -41.77 87.7 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.025 -1.047 . . . . 0.0 109.808 179.898 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.688 HD12 ' O ' ' A' ' 19' ' ' ILE . 1.5 mt -65.24 -38.72 91.25 Favored 'General case' 0 N--CA 1.506 2.366 0 C-N-CA 119.466 -0.894 . . . . 0.0 109.508 179.216 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.2 m -58.3 -35.71 72.26 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.046 -1.034 . . . . 0.0 110.082 179.314 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -56.55 -34.57 67.22 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.098 -1.001 . . . . 0.0 110.427 179.563 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.726 ' CD2' HD12 ' A' ' 55' ' ' LEU . 8.8 m-85 -57.71 -36.18 71.64 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.088 -1.007 . . . . 0.0 110.432 179.829 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -56.64 -35.61 68.55 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.163 -0.961 . . . . 0.0 110.656 -179.638 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.418 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.1 mp -63.84 -42.17 94.98 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.423 0 O-C-N 120.969 -1.082 . . . . 0.0 108.716 179.372 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -67.69 -57.19 6.81 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 119.133 -1.027 . . . . 0.0 108.298 178.521 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.722 HD12 HD23 ' A' ' 55' ' ' LEU . 1.2 tp -54.74 -33.0 60.58 Favored 'General case' 0 N--CA 1.512 2.632 0 C-N-CA 119.363 -0.935 . . . . 0.0 109.75 178.318 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.05 -36.12 70.13 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.09 -1.006 . . . . 0.0 110.404 179.657 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.68 -52.77 61.99 Favored 'General case' 0 N--CA 1.507 2.381 0 C-N-CA 119.075 -1.05 . . . . 0.0 109.427 179.98 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.612 ' HB1' ' HG2' ' A' ' 48' ' ' GLN . . . -69.39 -42.13 75.54 Favored 'General case' 0 N--CA 1.504 2.236 0 C-N-CA 119.048 -1.061 . . . . 0.0 108.609 178.638 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -61.34 -33.65 73.97 Favored 'General case' 0 N--CA 1.503 2.22 0 C-N-CA 119.525 -0.87 . . . . 0.0 110.069 179.266 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 6.4 mtmt -87.79 -34.48 18.28 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.064 -1.022 . . . . 0.0 110.612 179.754 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 . . . . . 0 N--CA 1.511 2.609 0 O-C-N 120.938 -1.101 . . . . 0.0 110.262 179.692 . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.496 1.828 0 CA-C-O 120.694 0.283 . . . . 0.0 110.616 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.446 ' HB3' ' CZ2' ' A' ' 50' ' ' TRP . 74.1 m-80 -56.41 -39.38 72.92 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.124 -0.985 . . . . 0.0 110.014 179.853 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -60.81 -38.55 85.78 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.213 -0.929 . . . . 0.0 109.771 179.482 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.612 ' HG2' ' HB1' ' A' ' 33' ' ' ALA . 4.4 tt0 -57.87 -40.98 81.5 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.077 -1.014 . . . . 0.0 109.894 179.827 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.413 ' HA ' HD23 ' A' ' 49' ' ' LEU . 54.0 mt -75.04 -33.11 61.7 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.256 -0.902 . . . . 0.0 110.502 179.844 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.504 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 45.9 m0 -58.66 -38.85 79.05 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 120.905 -1.122 . . . . 0.0 109.738 179.566 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.45 ' O ' HD22 ' A' ' 55' ' ' LEU . 13.5 mt-10 -66.02 -32.39 73.83 Favored 'General case' 0 N--CA 1.502 2.136 0 C-N-CA 119.035 -1.066 . . . . 0.0 109.371 178.271 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.691 HG23 HD11 ' A' ' 30' ' ' LEU . 4.4 mt -72.44 -55.56 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.214 0 O-C-N 120.981 -1.075 . . . . 0.0 109.7 179.585 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.3 ptm -60.08 -24.36 64.53 Favored 'General case' 0 N--CA 1.509 2.492 0 C-N-CA 118.259 -1.376 . . . . 0.0 110.003 178.883 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -64.98 -35.41 81.08 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 120.756 -1.215 . . . . 0.0 109.76 178.369 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.726 HD12 ' CD2' ' A' ' 26' ' ' PHE . 0.8 OUTLIER -54.62 -35.8 63.8 Favored 'General case' 0 N--CA 1.514 2.73 0 O-C-N 120.846 -1.159 . . . . 0.0 109.834 179.387 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.458 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 26.2 t60 -52.22 -37.15 54.22 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 120.949 -1.095 . . . . 0.0 110.483 -179.746 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.451 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.4 m170 -67.95 -48.53 65.63 Favored 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 119.143 -1.023 . . . . 0.0 109.463 179.494 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -61.81 -37.04 82.93 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 119.286 -0.966 . . . . 0.0 109.594 179.154 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.408 ' HG3' ' CE2' ' A' ' 26' ' ' PHE . 3.0 mtt180 -66.27 -46.48 76.88 Favored 'General case' 0 N--CA 1.508 2.451 0 C-N-CA 119.29 -0.964 . . . . 0.0 109.641 179.364 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.5 p -62.25 -39.53 93.18 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.13 -0.981 . . . . 0.0 109.503 179.526 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 10.7 tpp85 -64.31 -42.61 96.26 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.103 -0.998 . . . . 0.0 109.101 179.307 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.864 ' CE2' HG21 ' A' ' 22' ' ' THR . 59.6 t80 -63.19 -49.04 75.81 Favored 'General case' 0 N--CA 1.507 2.389 0 C-N-CA 119.491 -0.884 . . . . 0.0 109.464 179.422 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.61 HD12 ' HB2' ' A' ' 87' ' ' ALA . 85.2 mt -69.31 -38.74 78.01 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.331 0 C-N-CA 119.305 -0.958 . . . . 0.0 109.238 179.538 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.43 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 9.0 t80 -66.57 -41.7 88.2 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.169 -0.957 . . . . 0.0 108.943 178.978 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.405 ' HA ' ' HD3' ' A' ' 69' ' ' LYS . 86.9 m -60.49 -41.28 93.92 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.126 -0.984 . . . . 0.0 110.366 -179.735 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.593 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.2 -34.8 25.83 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 118.825 -1.15 . . . . 0.0 112.528 -178.978 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.535 ' N ' HD12 ' A' ' 66' ' ' LEU . 32.9 t80 -86.49 -32.59 20.7 Favored 'General case' 0 N--CA 1.513 2.706 0 O-C-N 120.628 -1.295 . . . . 0.0 112.066 -179.184 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.43 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 7.5 m-85 -98.43 -8.84 26.11 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 120.787 -1.196 . . . . 0.0 113.178 -178.524 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.405 ' HD3' ' HA ' ' A' ' 65' ' ' THR . 5.1 mtpm? -127.8 -58.4 1.23 Allowed 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.373 -1.454 . . . . 0.0 110.69 179.693 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.41 ' HB2' ' HA ' ' A' ' 66' ' ' LEU . 67.7 mtp180 -69.84 -28.82 66.01 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.119 -0.988 . . . . 0.0 110.741 -179.802 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.0 ttmt 58.92 43.5 17.91 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.768 -1.207 . . . . 0.0 109.932 -179.451 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.71 34.47 3.96 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.366 -0.834 . . . . 0.0 109.897 179.288 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.708 HG13 HD23 ' A' ' 77' ' ' LEU . 13.9 tt -153.21 162.34 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.144 -0.973 . . . . 0.0 109.856 -179.962 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.6 p -108.61 147.48 31.77 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.103 -0.998 . . . . 0.0 110.128 179.844 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 24.8 ttmt -46.36 -31.7 2.76 Favored 'General case' 0 N--CA 1.514 2.733 0 O-C-N 121.333 -0.854 . . . . 0.0 111.653 -179.978 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -62.2 -51.3 68.33 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.944 -1.097 . . . . 0.0 109.412 179.566 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.708 HD23 HG13 ' A' ' 73' ' ' ILE . 32.4 tp -65.97 -44.36 85.17 Favored 'General case' 0 N--CA 1.504 2.273 0 C-N-CA 119.168 -1.013 . . . . 0.0 108.538 178.902 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 17.0 t80 -60.77 -39.2 87.91 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.369 -0.832 . . . . 0.0 109.344 179.169 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -72.47 -42.04 65.38 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.141 -0.975 . . . . 0.0 108.876 178.771 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.784 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 88.8 t90 -56.28 -36.65 68.86 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 121.195 -0.941 . . . . 0.0 109.734 178.926 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.782 HD22 ' CD2' ' A' ' 86' ' ' TYR . 62.8 mt -70.14 -46.77 64.07 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.177 -0.952 . . . . 0.0 108.897 178.954 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.427 HD13 ' O ' ' A' ' 87' ' ' ALA . 33.3 mm -55.68 -33.02 32.57 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.669 0 O-C-N 121.24 -0.913 . . . . 0.0 109.83 179.261 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.34 -15.11 34.14 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 120.99 -1.069 . . . . 0.0 112.261 -179.909 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.453 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 64.3 mm-40 -104.94 23.15 14.01 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 120.475 -1.391 . . . . 0.0 112.165 -179.609 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.4 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 7.5 tttt 75.99 68.42 0.07 Allowed 'General case' 0 N--CA 1.511 2.62 0 O-C-N 121.051 -1.031 . . . . 0.0 112.028 179.277 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.782 ' CD2' HD22 ' A' ' 81' ' ' LEU . 31.4 m-85 -131.87 -63.35 0.82 Allowed 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 178.784 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.61 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -137.41 162.07 34.62 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.482 -0.761 . . . . 0.0 109.07 178.914 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.458 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 21.8 t0 -113.71 117.07 30.5 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.084 -1.01 . . . . 0.0 110.403 -179.804 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 6.1 mtpt -58.51 -38.76 78.37 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.206 -0.934 . . . . 0.0 109.86 179.742 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 47.4 tp -59.65 -40.22 87.01 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.101 -0.999 . . . . 0.0 109.756 179.629 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.747 ' HA ' HD21 ' A' ' 106' ' ' LEU . 66.1 tp -67.09 -52.45 41.88 Favored 'General case' 0 N--CA 1.508 2.426 0 C-N-CA 119.271 -0.972 . . . . 0.0 108.643 179.227 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 54.6 mt -58.6 -32.53 46.29 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.396 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.103 178.409 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.48 -42.86 78.06 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.046 -1.034 . . . . 0.0 109.521 178.833 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.458 ' HD3' HD23 ' A' ' 106' ' ' LEU . 7.5 mttp -59.6 -41.22 89.82 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.119 -0.988 . . . . 0.0 110.14 179.465 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.3 m0 -65.1 -39.49 93.22 Favored 'General case' 0 N--CA 1.508 2.469 0 C-N-CA 119.125 -1.03 . . . . 0.0 109.836 179.569 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 3.2 mtp85 -75.95 -29.93 58.47 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.268 -0.895 . . . . 0.0 110.566 179.304 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.5 mmtm -54.18 -176.49 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.652 0 O-C-N 120.86 -1.15 . . . . 0.0 110.589 179.771 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 53.7 m -105.07 131.57 52.4 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.166 -0.959 . . . . 0.0 109.772 179.296 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.35 8.33 50.11 Favored Glycine 0 N--CA 1.493 2.489 0 C-N-CA 120.196 -1.002 . . . . 0.0 111.109 -179.449 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -114.75 68.17 0.7 Allowed 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 119.499 1.65 . . . . 0.0 109.946 179.672 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -84.54 -38.53 19.89 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.079 -1.013 . . . . 0.0 109.983 179.787 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.82 90.34 3.31 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.126 -0.984 . . . . 0.0 109.969 179.842 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.927 HD13 HD13 ' A' ' 109' ' ' ILE . 9.9 tp -126.99 134.68 50.31 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.279 -0.888 . . . . 0.0 109.664 -179.647 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.451 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.3 p -108.76 -37.93 5.76 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.201 -0.937 . . . . 0.0 112.356 -179.791 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.828 ' O ' HD11 ' A' ' 103' ' ' LEU . 7.5 m -139.92 -167.93 2.4 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.22 -1.55 . . . . 0.0 109.877 178.905 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.747 HD21 ' HA ' ' A' ' 91' ' ' LEU . 17.3 mt -98.22 -37.76 9.56 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.132 -0.98 . . . . 0.0 110.674 179.493 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 30.8 ttm-85 -102.52 33.33 3.2 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.949 -1.095 . . . . 0.0 109.311 178.055 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.66 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.312 1.7 t -128.61 17.12 6.41 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.322 -0.861 . . . . 0.0 108.838 -179.06 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.927 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -159.1 38.54 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 120.814 -1.179 . . . . 0.0 110.434 -178.904 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.779 ' C ' HG23 ' A' ' 119' ' ' THR . 12.7 mm-40 . . . . . 0 N--CA 1.503 2.194 0 O-C-N 120.74 -1.225 . . . . 0.0 110.913 -178.769 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.779 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.731 0 CA-C-O 120.883 0.373 . . . . 0.0 110.527 . . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.439 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 43.3 t -108.02 155.31 20.5 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.436 -0.79 . . . . 0.0 108.922 178.727 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.794 HD12 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -70.62 -37.15 68.48 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.425 0 O-C-N 121.027 -1.045 . . . . 0.0 110.633 -179.404 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.449 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 6.7 p -55.36 -33.6 63.56 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 120.818 -1.176 . . . . 0.0 110.752 -179.29 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.505 ' HG2' HG22 ' A' ' 109' ' ' ILE . 0.0 OUTLIER -58.92 -33.46 70.59 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 120.924 -1.11 . . . . 0.0 109.71 178.325 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 62.0 t -81.17 125.22 79.96 Favored Pre-proline 0 N--CA 1.504 2.269 0 O-C-N 121.163 -0.961 . . . . 0.0 109.725 179.688 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -65.73 170.26 11.63 Favored 'Trans proline' 0 N--CA 1.487 1.111 0 O-C-N 123.119 1.062 . . . . 0.0 110.659 179.582 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 5.9 tpt180 -75.12 -36.42 61.64 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.303 -0.873 . . . . 0.0 110.721 -179.753 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.76 -41.4 81.87 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 120.963 -1.085 . . . . 0.0 110.093 -179.8 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -68.33 -41.34 80.94 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.215 -0.928 . . . . 0.0 109.232 179.275 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.408 HD22 HG21 ' A' ' 140' ' ' VAL . 2.7 mt -63.63 -39.28 93.95 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.249 -0.907 . . . . 0.0 109.676 179.308 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -59.31 -39.66 83.76 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.13 -0.981 . . . . 0.0 109.924 179.716 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -59.88 -37.9 80.68 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.1 -1.0 . . . . 0.0 110.127 179.724 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -61.81 -46.43 89.55 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.178 -0.952 . . . . 0.0 109.869 179.904 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.544 ' HB1' ' HA ' ' A' ' 139' ' ' GLN . . . -61.07 -40.98 95.73 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.218 -0.926 . . . . 0.0 109.906 -179.998 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 19.9 ttt85 -64.98 -30.96 71.99 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.185 -0.947 . . . . 0.0 110.689 179.798 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.43 -29.03 23.16 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 120.95 -1.094 . . . . 0.0 111.361 -179.811 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 23.6 mttt -98.6 24.12 7.84 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 120.783 -1.198 . . . . 0.0 111.724 -179.909 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.16 46.74 42.73 Favored Glycine 0 N--CA 1.5 2.952 0 O-C-N 120.771 -1.205 . . . . 0.0 111.077 179.26 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.483 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 9.7 t -148.93 -164.18 1.96 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.069 -1.253 . . . . 0.0 110.533 179.846 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 139' ' ' GLN . . . . . 0.544 ' HA ' ' HB1' ' A' ' 133' ' ' ALA . 53.5 mt-30 -139.52 149.7 44.24 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.224 -0.923 . . . . 0.0 110.302 -179.867 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.408 HG21 HD22 ' A' ' 129' ' ' LEU . 7.4 p -132.66 161.0 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 O-C-N 121.221 -0.924 . . . . 0.0 110.2 -179.979 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 41.0 t -168.19 85.6 0.2 Allowed 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.167 -0.958 . . . . 0.0 111.099 -179.963 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.794 ' CG ' HD12 ' A' ' 121' ' ' ILE . 50.5 t80 -99.38 160.48 14.25 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.261 -0.899 . . . . 0.0 110.486 -179.926 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 -137.06 -61.29 0.66 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.509 -0.744 . . . . 0.0 109.02 178.967 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -134.69 152.04 51.47 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.428 -0.795 . . . . 0.0 108.95 178.669 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 31.5 p -92.85 152.77 19.23 Favored 'General case' 0 N--CA 1.504 2.267 0 C-N-CA 119.028 -1.069 . . . . 0.0 111.085 -179.552 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.9 m -70.61 -26.38 28.35 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.407 0 O-C-N 121.427 -0.795 . . . . 0.0 111.307 -179.522 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 63.8 m170 -50.49 -58.49 5.65 Favored 'General case' 0 N--CA 1.516 2.841 0 O-C-N 120.855 -1.153 . . . . 0.0 110.213 -179.993 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.504 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 26.0 p -127.59 -166.71 1.64 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.261 -0.899 . . . . 0.0 110.566 179.656 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 149' ' ' GLY . . . . . 0.44 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.06 57.66 0.8 Allowed Glycine 0 N--CA 1.493 2.442 0 N-CA-C 107.958 -2.057 . . . . 0.0 107.958 178.405 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 19.3 t -101.67 142.61 32.75 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.318 -1.107 . . . . 0.0 109.784 -179.305 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 57.5 mtp85 -95.9 52.45 1.32 Allowed 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.273 -0.892 . . . . 0.0 109.736 179.353 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.89 98.41 0.03 OUTLIER Glycine 0 N--CA 1.488 2.123 0 N-CA-C 109.866 -1.293 . . . . 0.0 109.866 179.956 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 22.6 p -110.44 131.08 55.36 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.266 -1.138 . . . . 0.0 110.356 179.552 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -142.32 141.38 32.37 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.096 -1.003 . . . . 0.0 110.038 -179.802 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.498 1.934 0 O-C-N 121.258 -0.901 . . . . 0.0 110.223 179.972 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.801 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.498 1.966 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 . . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -69.67 164.79 33.12 Favored 'Trans proline' 0 C--N 1.316 -1.134 0 O-C-N 123.377 1.199 . . . . 0.0 110.869 -179.682 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -47.66 -32.48 5.71 Favored 'General case' 0 N--CA 1.516 2.844 0 O-C-N 121.435 -0.791 . . . . 0.0 111.493 -179.743 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.61 -35.39 51.78 Favored Glycine 0 N--CA 1.498 2.812 0 N-CA-C 110.373 -1.091 . . . . 0.0 110.373 179.771 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.46 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 24.3 t80 -55.75 -33.58 64.42 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 120.948 -1.324 . . . . 0.0 110.681 179.713 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -54.99 -38.45 67.87 Favored 'General case' 0 N--CA 1.513 2.676 0 O-C-N 120.993 -1.067 . . . . 0.0 110.106 179.807 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.2 mmtm -58.81 -35.52 73.0 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.359 -0.838 . . . . 0.0 110.192 179.44 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.662 ' O ' HD12 ' A' ' 23' ' ' LEU . 3.2 pt -116.73 36.13 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.135 -0.978 . . . . 0.0 110.616 179.732 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 3.5 tmtt? -82.53 -43.38 0.95 Allowed Pre-proline 0 N--CA 1.509 2.484 0 O-C-N 121.003 -1.06 . . . . 0.0 112.941 -179.43 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 48.8 Cg_endo -76.95 -36.58 1.4 Allowed 'Trans proline' 0 N--CA 1.486 1.08 0 O-C-N 122.639 0.81 . . . . 0.0 111.527 -178.561 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.978 HG21 ' CE2' ' A' ' 62' ' ' TYR . 91.1 m -59.37 -43.45 92.87 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 120.932 -1.105 . . . . 0.0 110.083 -179.664 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.662 HD12 ' O ' ' A' ' 19' ' ' ILE . 1.0 OUTLIER -61.26 -36.33 79.7 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.263 -0.898 . . . . 0.0 110.021 179.642 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.45 -36.52 73.81 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 120.92 -1.112 . . . . 0.0 110.176 179.472 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -58.1 -34.31 70.06 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.049 -1.032 . . . . 0.0 110.379 179.601 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.769 ' CD2' HD12 ' A' ' 55' ' ' LEU . 8.8 m-85 -56.65 -42.49 79.01 Favored 'General case' 0 N--CA 1.512 2.65 0 O-C-N 120.911 -1.118 . . . . 0.0 110.008 179.54 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -57.81 -26.53 62.11 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.367 -0.933 . . . . 0.0 110.453 179.274 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 13.1 mm -67.12 -51.08 57.62 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.291 0 O-C-N 120.945 -1.097 . . . . 0.0 108.485 179.225 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.4 tp60 -64.23 -52.02 60.8 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.227 -0.92 . . . . 0.0 108.546 178.852 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.729 HD12 HD23 ' A' ' 55' ' ' LEU . 1.1 tp -57.03 -36.89 71.0 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.24 -0.913 . . . . 0.0 109.64 178.905 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -57.38 -37.62 72.95 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.084 -1.01 . . . . 0.0 110.123 179.784 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.61 -50.14 72.45 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.11 -0.993 . . . . 0.0 109.517 179.803 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.484 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -68.14 -42.86 79.49 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 119.016 -1.074 . . . . 0.0 108.89 178.96 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -61.3 -32.11 71.96 Favored 'General case' 0 N--CA 1.504 2.266 0 C-N-CA 119.576 -0.849 . . . . 0.0 110.213 179.374 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.5 mmpt? -96.28 -20.46 18.51 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 120.975 -1.078 . . . . 0.0 111.71 -179.96 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 20.4 t0 . . . . . 0 N--CA 1.513 2.681 0 O-C-N 120.672 -1.268 . . . . 0.0 110.534 -179.966 . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 63.2 m . . . . . 0 N--CA 1.498 1.931 0 CA-C-O 120.629 0.252 . . . . 0.0 110.482 . . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.408 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 18.0 m120 -57.29 -40.96 78.87 Favored 'General case' 0 N--CA 1.51 2.561 0 O-C-N 121.205 -0.934 . . . . 0.0 109.844 179.838 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -59.94 -38.67 83.09 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.219 -0.926 . . . . 0.0 109.941 179.62 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.437 ' HG2' ' HB1' ' A' ' 33' ' ' ALA . 0.5 OUTLIER -59.47 -40.23 86.25 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.17 -0.956 . . . . 0.0 110.265 179.985 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 91.4 mt -74.8 -31.69 61.79 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.227 -0.921 . . . . 0.0 110.716 -179.929 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.486 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 40.2 m0 -57.98 -39.69 78.81 Favored 'General case' 0 N--CA 1.512 2.67 0 O-C-N 120.842 -1.161 . . . . 0.0 109.245 179.134 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.0 -34.74 78.4 Favored 'General case' 0 N--CA 1.499 1.985 0 C-N-CA 119.046 -1.062 . . . . 0.0 108.807 177.626 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.693 HG23 HD11 ' A' ' 30' ' ' LEU . 5.1 mt -71.74 -56.75 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.175 0 O-C-N 121.114 -0.991 . . . . 0.0 109.358 179.106 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.554 ' HE1' ' O ' ' A' ' 147' ' ' HIS . 0.3 OUTLIER -58.22 -25.88 62.18 Favored 'General case' 0 N--CA 1.512 2.633 0 C-N-CA 118.208 -1.397 . . . . 0.0 109.884 178.72 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.5 mt-30 -62.17 -37.14 84.11 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.874 -1.141 . . . . 0.0 109.376 178.165 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.769 HD12 ' CD2' ' A' ' 26' ' ' PHE . 1.0 OUTLIER -53.76 -35.67 61.52 Favored 'General case' 0 N--CA 1.513 2.683 0 O-C-N 120.933 -1.105 . . . . 0.0 109.73 179.099 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.466 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 33.5 t60 -51.51 -36.86 46.49 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.039 -1.038 . . . . 0.0 110.449 179.975 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.453 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 15.3 m170 -71.2 -46.77 60.54 Favored 'General case' 0 N--CA 1.505 2.29 0 C-N-CA 119.225 -0.99 . . . . 0.0 109.088 179.222 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.428 ' HB3' ' CE2' ' A' ' 26' ' ' PHE . 5.6 tt0 -63.2 -35.4 80.18 Favored 'General case' 0 N--CA 1.505 2.284 0 C-N-CA 119.249 -0.98 . . . . 0.0 109.41 178.696 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.46 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -68.26 -48.91 63.79 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.138 -0.976 . . . . 0.0 109.292 179.259 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.4 p -63.86 -38.53 91.43 Favored 'General case' 0 N--CA 1.503 2.198 0 C-N-CA 119.356 -0.938 . . . . 0.0 109.231 179.161 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.407 ' O ' ' OG1' ' A' ' 65' ' ' THR . 5.1 ttt-85 -65.73 -42.04 91.52 Favored 'General case' 0 N--CA 1.504 2.275 0 C-N-CA 119.246 -0.982 . . . . 0.0 109.106 179.125 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.978 ' CE2' HG21 ' A' ' 22' ' ' THR . 54.4 t80 -62.8 -48.75 77.75 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.189 -0.944 . . . . 0.0 109.357 179.377 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.677 HD12 ' HB2' ' A' ' 87' ' ' ALA . 89.6 mt -71.02 -39.94 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.328 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.245 179.574 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.424 ' HD2' HD13 ' A' ' 92' ' ' ILE . 10.3 t80 -65.3 -42.12 93.37 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.245 -0.91 . . . . 0.0 108.839 179.027 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.419 HG23 ' HD2' ' A' ' 69' ' ' LYS . 92.0 m -61.27 -41.83 97.6 Favored 'General case' 0 N--CA 1.502 2.135 0 C-N-CA 119.283 -0.967 . . . . 0.0 110.54 -179.614 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.537 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.6 pp -83.09 -32.35 26.82 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 118.811 -1.156 . . . . 0.0 112.323 -178.944 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.426 ' CD2' HG23 ' A' ' 73' ' ' ILE . 31.1 t80 -86.44 -32.53 20.81 Favored 'General case' 0 N--CA 1.511 2.591 0 O-C-N 120.708 -1.245 . . . . 0.0 111.781 -179.454 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.402 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 8.3 m-85 -98.42 -25.38 14.82 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 120.716 -1.24 . . . . 0.0 112.525 -178.661 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.419 ' HD2' HG23 ' A' ' 65' ' ' THR . 63.3 mttt -108.55 -57.52 2.12 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.596 -1.315 . . . . 0.0 110.717 179.968 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.467 HH11 ' HB2' ' A' ' 72' ' ' ALA . 28.4 ttt-85 -72.92 -30.22 63.73 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.242 -0.911 . . . . 0.0 111.009 -179.388 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.5 mttp 56.62 42.39 27.14 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.743 -1.223 . . . . 0.0 110.041 -179.468 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.467 ' HB2' HH11 ' A' ' 70' ' ' ARG . . . -108.84 34.18 3.83 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.423 -0.798 . . . . 0.0 109.845 179.119 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.737 HG13 HD23 ' A' ' 77' ' ' LEU . 13.9 tt -149.21 162.84 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.17 -0.956 . . . . 0.0 109.58 -179.938 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 62.0 m -107.44 144.24 34.64 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.013 -1.054 . . . . 0.0 110.378 179.972 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -45.24 -32.71 2.03 Favored 'General case' 0 N--CA 1.515 2.805 0 O-C-N 121.353 -0.842 . . . . 0.0 111.562 179.988 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -61.82 -51.09 69.66 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 120.908 -1.12 . . . . 0.0 109.19 179.329 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.737 HD23 HG13 ' A' ' 73' ' ' ILE . 37.2 tp -66.13 -43.85 85.91 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.186 -1.006 . . . . 0.0 108.322 178.637 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.683 ' HA ' HD12 ' A' ' 81' ' ' LEU . 15.5 t80 -58.98 -41.45 87.58 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.359 -0.838 . . . . 0.0 109.173 178.956 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -72.32 -42.3 65.59 Favored 'General case' 0 N--CA 1.504 2.271 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 178.222 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.801 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 86.5 t90 -56.12 -36.78 68.6 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.231 -0.918 . . . . 0.0 109.359 178.464 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.683 HD12 ' HA ' ' A' ' 78' ' ' TYR . 11.1 mt -66.59 -59.56 3.51 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.232 -0.917 . . . . 0.0 108.769 178.927 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.46 HG13 ' HB3' ' A' ' 87' ' ' ALA . 2.5 mt -56.27 -27.73 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.584 0 O-C-N 120.907 -1.12 . . . . 0.0 109.927 179.352 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 56.1 tttt -81.5 -21.02 38.91 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.896 -1.127 . . . . 0.0 110.971 178.579 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.442 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 20.3 mm-40 -105.44 22.72 14.96 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.809 -1.182 . . . . 0.0 111.979 179.91 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.416 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 4.2 tmtt? 77.3 67.73 0.05 OUTLIER 'General case' 0 N--CA 1.515 2.811 0 O-C-N 121.207 -0.933 . . . . 0.0 112.075 179.167 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.487 ' HE2' HD13 ' A' ' 23' ' ' LEU . 20.8 m-85 -130.28 -62.59 0.93 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.409 -0.807 . . . . 0.0 108.938 178.839 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.677 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -131.26 167.62 18.9 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.406 -0.809 . . . . 0.0 109.581 179.463 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.466 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 13.3 t0 -120.13 114.6 22.2 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.187 -0.945 . . . . 0.0 110.338 179.897 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -58.1 -38.16 75.93 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.24 -0.912 . . . . 0.0 110.028 179.803 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.637 HD23 HD22 ' A' ' 106' ' ' LEU . 13.5 tp -58.69 -38.19 77.72 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.211 -0.931 . . . . 0.0 110.144 179.842 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.584 ' HA ' HD21 ' A' ' 106' ' ' LEU . 62.8 tp -69.42 -52.34 27.83 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.007 -1.058 . . . . 0.0 108.854 179.41 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.424 HD13 ' HD2' ' A' ' 64' ' ' TYR . 69.0 mt -60.33 -32.7 51.57 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 C-N-CA 119.249 -0.98 . . . . 0.0 108.978 178.33 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.42 -49.27 67.32 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 120.989 -1.069 . . . . 0.0 109.267 178.826 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.491 ' HD3' HD23 ' A' ' 106' ' ' LEU . 11.2 mttp -56.55 -42.11 77.97 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.004 -1.06 . . . . 0.0 109.618 179.243 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.419 ' CZ3' ' HG ' ' A' ' 91' ' ' LEU . 3.8 m0 -62.17 -30.99 71.44 Favored 'General case' 0 N--CA 1.504 2.273 0 C-N-CA 119.142 -1.023 . . . . 0.0 109.634 178.682 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.15 22.58 10.23 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 120.953 -1.092 . . . . 0.0 111.117 179.048 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.458 ' HB2' ' CD2' ' A' ' 100' ' ' TYR . 8.0 mmtp -102.17 -174.06 2.49 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 120.686 -1.259 . . . . 0.0 109.628 179.052 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 56.5 m -102.57 127.43 49.65 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.112 -0.992 . . . . 0.0 109.678 179.244 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.69 9.22 50.37 Favored Glycine 0 N--CA 1.493 2.454 0 C-N-CA 120.187 -1.006 . . . . 0.0 111.038 -179.218 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.458 ' CD2' ' HB2' ' A' ' 97' ' ' LYS . 44.6 m-85 -111.15 48.87 0.91 Allowed 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 119.598 1.699 . . . . 0.0 110.219 179.744 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -59.52 -38.48 81.1 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.112 -0.992 . . . . 0.0 109.988 179.862 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -122.06 121.25 36.56 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.18 -0.95 . . . . 0.0 110.202 -179.966 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.88 HD13 HD13 ' A' ' 109' ' ' ILE . 9.7 tp -153.74 131.3 11.42 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.185 -0.947 . . . . 0.0 110.259 -179.674 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.453 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.4 p -108.98 -37.06 5.93 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.228 -0.92 . . . . 0.0 112.227 179.988 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.79 ' O ' HD11 ' A' ' 103' ' ' LEU . 7.3 m -140.97 -168.62 2.64 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.216 -1.552 . . . . 0.0 110.118 178.943 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.637 HD22 HD23 ' A' ' 90' ' ' LEU . 15.8 mt -97.18 -38.44 9.71 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.97 -1.082 . . . . 0.0 110.368 179.298 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 1.1 ttt85 -101.71 31.57 3.77 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.954 -1.091 . . . . 0.0 109.612 178.195 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.667 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.305 1.7 t -127.72 16.13 6.94 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.123 -0.986 . . . . 0.0 109.021 -179.344 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.88 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -158.88 38.41 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.369 0 O-C-N 120.937 -1.102 . . . . 0.0 110.423 -178.953 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.746 ' C ' HG23 ' A' ' 119' ' ' THR . 4.2 tt0 . . . . . 0 N--CA 1.502 2.164 0 O-C-N 120.838 -1.164 . . . . 0.0 111.314 -178.625 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.746 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.1 m . . . . . 0 N--CA 1.494 1.769 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 . . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.428 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 47.2 t -103.93 155.05 18.95 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.361 -0.837 . . . . 0.0 109.113 178.889 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.807 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -71.72 -36.19 58.16 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.372 0 O-C-N 121.056 -1.027 . . . . 0.0 110.77 -179.344 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.451 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.4 p -54.58 -32.55 58.79 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 120.772 -1.205 . . . . 0.0 110.9 -179.108 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.455 ' HG3' HG22 ' A' ' 109' ' ' ILE . 6.7 ttt-85 -58.75 -35.02 72.07 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 120.974 -1.079 . . . . 0.0 109.409 178.123 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 47.3 t -81.39 125.5 78.71 Favored Pre-proline 0 N--CA 1.504 2.253 0 O-C-N 121.282 -0.886 . . . . 0.0 109.669 179.539 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.635 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.3 Cg_endo -66.01 177.93 2.71 Favored 'Trans proline' 0 N--CA 1.489 1.242 0 O-C-N 123.126 1.067 . . . . 0.0 110.698 179.807 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -75.18 -37.78 61.09 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.23 -0.919 . . . . 0.0 110.548 -179.766 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.51 -41.72 86.06 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.062 -1.024 . . . . 0.0 109.967 -179.804 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -68.6 -41.36 79.71 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.22 -0.925 . . . . 0.0 109.209 179.307 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.635 HD12 ' O ' ' A' ' 125' ' ' PRO . 3.5 mt -64.29 -38.78 92.24 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.265 -0.897 . . . . 0.0 109.651 179.278 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -61.65 -40.56 95.35 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.123 -0.986 . . . . 0.0 109.721 179.802 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -60.42 -39.13 86.33 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.214 -0.929 . . . . 0.0 110.099 179.848 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -59.9 -41.07 90.84 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.232 -0.917 . . . . 0.0 110.038 -179.985 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.0 -45.17 94.8 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.186 -0.946 . . . . 0.0 109.91 179.911 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 3.5 ttt85 -59.33 -38.49 80.46 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.131 -0.98 . . . . 0.0 109.867 179.46 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -58.54 -35.62 72.6 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.223 -0.923 . . . . 0.0 110.509 179.859 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 13.9 mttp -105.37 18.24 22.6 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 120.98 -1.075 . . . . 0.0 111.908 -179.959 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 56.17 44.95 88.77 Favored Glycine 0 N--CA 1.498 2.775 0 O-C-N 120.601 -1.312 . . . . 0.0 110.312 179.374 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.2 t -136.89 -163.0 1.35 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.131 -1.217 . . . . 0.0 109.967 179.848 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -137.12 146.09 44.64 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.075 -1.015 . . . . 0.0 110.276 -179.957 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.556 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.7 p -132.79 161.38 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.226 -0.921 . . . . 0.0 110.117 -179.954 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 42.2 t -167.36 82.1 0.21 Allowed 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.212 -0.93 . . . . 0.0 111.041 179.943 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.794 ' CG ' HD12 ' A' ' 121' ' ' ILE . 44.7 t80 -94.42 161.45 14.23 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.253 -0.904 . . . . 0.0 110.337 179.997 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 -140.67 -60.71 0.51 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.534 -0.728 . . . . 0.0 109.098 179.124 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -131.15 151.56 51.32 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.427 -0.796 . . . . 0.0 109.055 178.871 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 28.1 p -96.73 154.79 17.08 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 121.052 -1.03 . . . . 0.0 110.957 -179.698 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.1 m -73.89 -25.68 20.61 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.464 0 O-C-N 121.382 -0.824 . . . . 0.0 111.813 -179.218 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 147' ' ' HIS . . . . . 0.554 ' O ' ' HE1' ' A' ' 53' ' ' MET . 63.2 m170 -49.99 -51.66 39.97 Favored 'General case' 0 N--CA 1.516 2.829 0 O-C-N 120.839 -1.163 . . . . 0.0 110.268 -179.768 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.486 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 28.1 p -134.87 -165.53 1.68 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.198 -0.938 . . . . 0.0 110.606 179.832 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -99.17 58.08 0.87 Allowed Glycine 0 N--CA 1.493 2.441 0 N-CA-C 108.013 -2.035 . . . . 0.0 108.013 178.492 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 27.8 t -103.06 144.05 31.79 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.339 -1.095 . . . . 0.0 109.988 -179.196 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 74.7 mtt85 -99.06 49.02 0.95 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.331 -0.855 . . . . 0.0 109.629 179.298 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.94 98.58 0.05 OUTLIER Glycine 0 N--CA 1.488 2.133 0 N-CA-C 109.866 -1.294 . . . . 0.0 109.866 179.938 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.5 p -111.98 128.01 56.04 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.302 -1.116 . . . . 0.0 110.237 179.652 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 154' ' ' ALA . . . . . 0.526 ' HB1' ' HD3' ' A' ' 125' ' ' PRO . . . -141.87 146.12 35.41 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.014 -1.054 . . . . 0.0 110.005 -179.626 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.496 1.847 0 O-C-N 121.269 -0.894 . . . . 0.0 110.203 -179.901 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.865 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.507 2.4 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 . . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -76.22 79.14 3.02 Favored 'Trans proline' 0 N--CA 1.487 1.089 0 O-C-N 123.251 1.132 . . . . 0.0 112.168 -178.299 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.9 t70 48.04 90.05 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.332 -0.855 . . . . 0.0 111.826 178.397 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 164.23 -42.19 0.31 Allowed Glycine 0 N--CA 1.501 2.969 0 C-N-CA 119.782 -1.199 . . . . 0.0 110.641 179.58 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.564 ' HE1' HD13 ' A' ' 23' ' ' LEU . 18.7 t80 -55.07 -29.4 57.45 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.183 -1.186 . . . . 0.0 110.801 179.872 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -54.52 -37.81 65.79 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 120.92 -1.113 . . . . 0.0 110.18 179.596 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.08 -35.04 70.82 Favored 'General case' 0 N--CA 1.511 2.585 0 O-C-N 121.231 -0.918 . . . . 0.0 110.376 179.425 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.1 pt -124.4 36.82 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 121.173 -0.954 . . . . 0.0 110.325 179.835 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -83.81 -42.69 0.79 Allowed Pre-proline 0 N--CA 1.509 2.507 0 O-C-N 121.128 -0.982 . . . . 0.0 113.474 -179.168 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.0 Cg_endo -74.41 -33.8 5.14 Favored 'Trans proline' 0 N--CA 1.488 1.166 0 O-C-N 122.623 0.802 . . . . 0.0 112.04 -177.978 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.884 HG21 ' CE2' ' A' ' 62' ' ' TYR . 93.2 m -58.73 -41.46 86.45 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.791 -1.193 . . . . 0.0 110.044 -179.814 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.564 HD13 ' HE1' ' A' ' 16' ' ' PHE . 0.3 OUTLIER -62.22 -37.27 84.7 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.26 -0.9 . . . . 0.0 110.109 179.636 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -57.43 -37.06 72.18 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 120.964 -1.085 . . . . 0.0 110.22 179.809 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -59.91 -35.38 74.74 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.105 -0.997 . . . . 0.0 110.198 179.592 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.712 ' CD2' HD12 ' A' ' 55' ' ' LEU . 6.9 m-85 -57.37 -43.53 83.64 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 120.987 -1.07 . . . . 0.0 110.071 179.355 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -57.49 -26.55 61.46 Favored 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 119.264 -0.974 . . . . 0.0 110.45 179.259 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.6 mm -65.15 -49.63 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.325 0 O-C-N 120.987 -1.07 . . . . 0.0 109.05 179.402 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -66.96 -52.01 48.12 Favored 'General case' 0 N--CA 1.505 2.323 0 C-N-CA 119.201 -1.0 . . . . 0.0 108.61 179.042 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.819 HD21 HG23 ' A' ' 52' ' ' ILE . 0.1 OUTLIER -57.84 -33.25 68.44 Favored 'General case' 0 N--CA 1.51 2.552 0 C-N-CA 119.331 -0.948 . . . . 0.0 109.738 178.802 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.27 -44.9 96.47 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 120.877 -1.139 . . . . 0.0 110.0 179.875 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.34 -43.33 96.56 Favored 'General case' 0 N--CA 1.508 2.468 0 C-N-CA 119.218 -0.993 . . . . 0.0 109.884 -179.629 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.519 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -71.79 -41.69 68.0 Favored 'General case' 0 N--CA 1.503 2.218 0 C-N-CA 119.247 -0.981 . . . . 0.0 109.093 178.954 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -62.48 -32.72 73.66 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.288 -0.883 . . . . 0.0 110.28 179.474 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.4 mmtt -94.96 -38.37 10.72 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 120.896 -1.128 . . . . 0.0 110.723 179.906 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.5 t70 . . . . . 0 N--CA 1.511 2.614 0 O-C-N 121.055 -1.028 . . . . 0.0 109.984 179.836 . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.1 m . . . . . 0 N--CA 1.499 2.014 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 . . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.403 ' O ' ' CG ' ' A' ' 50' ' ' TRP . 68.5 m-20 -58.51 -39.02 78.93 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.206 -0.934 . . . . 0.0 109.856 179.483 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -66.32 -45.64 79.57 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.164 -0.96 . . . . 0.0 109.333 179.344 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 49.2 tp60 -66.78 -41.66 87.29 Favored 'General case' 0 N--CA 1.505 2.296 0 C-N-CA 119.341 -0.943 . . . . 0.0 109.015 179.048 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.54 HD23 HD12 ' A' ' 52' ' ' ILE . 12.5 mt -61.0 -37.33 82.15 Favored 'General case' 0 N--CA 1.506 2.332 0 C-N-CA 119.506 -0.878 . . . . 0.0 109.78 179.318 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.5 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.4 m0 -58.6 -35.95 73.24 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.947 -1.096 . . . . 0.0 110.259 179.712 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.6 ' O ' HD22 ' A' ' 55' ' ' LEU . 4.3 tt0 -63.92 -29.49 70.66 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.022 -1.049 . . . . 0.0 109.87 178.513 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.819 HG23 HD21 ' A' ' 30' ' ' LEU . 68.1 mt -71.88 -57.9 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.279 0 O-C-N 120.92 -1.112 . . . . 0.0 109.564 179.542 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 ptm -57.93 -26.65 62.52 Favored 'General case' 0 N--CA 1.511 2.602 0 C-N-CA 118.284 -1.366 . . . . 0.0 109.796 178.769 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -62.39 -35.97 80.85 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 120.812 -1.18 . . . . 0.0 109.503 178.19 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.712 HD12 ' CD2' ' A' ' 26' ' ' PHE . 0.5 OUTLIER -53.64 -36.51 62.15 Favored 'General case' 0 N--CA 1.513 2.695 0 O-C-N 120.868 -1.145 . . . . 0.0 109.869 179.378 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.457 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 22.4 t60 -53.14 -38.42 62.69 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.917 -1.114 . . . . 0.0 110.427 -179.684 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.448 ' CD2' HD21 ' A' ' 91' ' ' LEU . 5.5 m170 -67.48 -54.79 17.14 Favored 'General case' 0 N--CA 1.506 2.338 0 C-N-CA 119.207 -0.997 . . . . 0.0 109.318 179.369 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.439 ' HB3' ' CE2' ' A' ' 26' ' ' PHE . 13.7 tt0 -56.76 -32.93 66.1 Favored 'General case' 0 N--CA 1.507 2.381 0 C-N-CA 119.404 -0.918 . . . . 0.0 109.726 178.975 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.407 ' HG3' ' CE2' ' A' ' 26' ' ' PHE . 0.4 OUTLIER -67.18 -52.42 41.54 Favored 'General case' 0 N--CA 1.509 2.475 0 O-C-N 120.965 -1.084 . . . . 0.0 109.184 178.834 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.8 p -63.31 -37.63 88.0 Favored 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 119.253 -0.979 . . . . 0.0 109.318 178.997 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 48.6 ttt85 -65.06 -39.33 93.12 Favored 'General case' 0 N--CA 1.505 2.289 0 C-N-CA 119.251 -0.98 . . . . 0.0 109.355 179.053 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.884 ' CE2' HG21 ' A' ' 22' ' ' THR . 35.7 t80 -62.27 -50.51 71.41 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.013 -1.054 . . . . 0.0 109.375 179.441 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.571 HD12 ' HB2' ' A' ' 87' ' ' ALA . 86.8 mt -71.8 -40.33 69.2 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.34 0 O-C-N 121.188 -0.945 . . . . 0.0 109.232 179.28 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -64.08 -42.59 96.9 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.157 -0.964 . . . . 0.0 109.123 179.272 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.418 ' HA ' ' CD ' ' A' ' 69' ' ' LYS . 94.0 m -61.67 -42.28 98.7 Favored 'General case' 0 N--CA 1.501 2.116 0 C-N-CA 119.3 -0.96 . . . . 0.0 110.297 -179.642 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.56 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.6 pp -83.25 -31.85 26.76 Favored 'General case' 0 N--CA 1.504 2.267 0 C-N-CA 118.828 -1.149 . . . . 0.0 112.485 -179.022 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.456 ' HD1' HG23 ' A' ' 73' ' ' ILE . 66.8 t80 -86.24 -33.16 20.8 Favored 'General case' 0 N--CA 1.514 2.732 0 O-C-N 120.659 -1.275 . . . . 0.0 111.71 -179.508 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -98.37 -18.95 18.03 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 120.813 -1.179 . . . . 0.0 112.726 -178.662 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.418 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 5.6 mttt -120.97 -59.32 1.74 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 120.439 -1.413 . . . . 0.0 110.944 179.844 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.411 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 1.0 OUTLIER -63.1 -30.76 71.85 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.124 -0.985 . . . . 0.0 110.763 -179.648 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 42.0 tttt 57.68 42.35 23.95 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 120.751 -1.218 . . . . 0.0 110.062 -179.554 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -111.9 35.12 3.83 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.406 -0.809 . . . . 0.0 109.879 179.285 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.56 HG21 ' CD1' ' A' ' 66' ' ' LEU . 14.0 tt -154.17 162.48 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 O-C-N 121.234 -0.916 . . . . 0.0 109.895 179.969 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 43.5 m -107.6 145.08 33.75 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.137 -0.977 . . . . 0.0 110.301 179.863 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -46.71 -30.6 2.46 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.293 -0.879 . . . . 0.0 111.772 179.95 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.44 -50.46 73.5 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.781 -1.199 . . . . 0.0 109.462 179.677 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 24.5 tp -69.26 -44.02 72.76 Favored 'General case' 0 N--CA 1.505 2.277 0 C-N-CA 118.918 -1.113 . . . . 0.0 108.232 178.637 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.666 ' HA ' HD12 ' A' ' 81' ' ' LEU . 20.0 t80 -57.41 -38.6 74.59 Favored 'General case' 0 N--CA 1.509 2.475 0 C-N-CA 119.547 -0.861 . . . . 0.0 109.228 178.662 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -74.99 -42.45 57.51 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 177.925 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.865 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 81.4 t90 -55.44 -37.86 68.27 Favored 'General case' 0 N--CA 1.511 2.596 0 O-C-N 121.27 -0.894 . . . . 0.0 109.361 178.444 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.666 HD12 ' HA ' ' A' ' 78' ' ' TYR . 9.2 mt -68.32 -50.2 55.02 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.17 -0.956 . . . . 0.0 108.828 178.917 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.43 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 36.5 mm -56.4 -30.72 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.647 0 O-C-N 121.271 -0.893 . . . . 0.0 110.115 179.36 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 54.1 mttt -89.09 -22.17 23.03 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.932 -1.105 . . . . 0.0 111.753 -179.999 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.435 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 60.2 mm-40 -98.46 21.58 10.95 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 120.618 -1.301 . . . . 0.0 111.941 -179.97 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.6 tttm 74.39 74.1 0.11 Allowed 'General case' 0 N--CA 1.511 2.624 0 O-C-N 121.062 -1.024 . . . . 0.0 111.765 179.258 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.458 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 29.7 m-85 -133.22 -62.4 0.79 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.488 -0.757 . . . . 0.0 109.342 179.603 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.571 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -127.65 161.81 28.01 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.423 -0.798 . . . . 0.0 109.402 179.219 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.457 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 8.5 t0 -108.33 111.39 23.3 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.125 -0.984 . . . . 0.0 110.445 -179.853 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.0 mmtp -58.23 -36.81 73.73 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.313 -0.867 . . . . 0.0 110.109 179.707 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.1 tp -58.2 -38.64 77.14 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.075 -1.016 . . . . 0.0 110.131 179.707 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.623 ' HA ' HD21 ' A' ' 106' ' ' LEU . 64.1 tp -70.24 -53.22 17.89 Favored 'General case' 0 N--CA 1.505 2.311 0 C-N-CA 119.196 -1.002 . . . . 0.0 108.751 179.284 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.449 HG22 ' HD2' ' A' ' 96' ' ' ARG . 54.8 mt -59.38 -31.33 46.19 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.47 0 C-N-CA 119.225 -0.99 . . . . 0.0 109.299 178.469 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.5 -45.57 83.03 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 120.962 -1.086 . . . . 0.0 109.733 179.219 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.497 ' HD3' HD23 ' A' ' 106' ' ' LEU . 7.2 mttp -60.89 -45.03 96.2 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.088 -1.007 . . . . 0.0 109.882 179.376 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.7 m0 -58.31 -37.6 75.4 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.987 -1.071 . . . . 0.0 109.843 179.366 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.449 ' HD2' HG22 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -77.09 -36.75 55.48 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.204 -0.935 . . . . 0.0 109.743 178.864 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 31.1 mmtt -54.36 -177.12 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.641 0 O-C-N 121.075 -1.016 . . . . 0.0 110.226 179.588 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 33.1 m -108.57 141.03 41.08 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.247 -0.908 . . . . 0.0 109.341 178.807 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 106.5 -29.72 10.57 Favored Glycine 0 N--CA 1.492 2.42 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 -178.987 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 51.9 m-85 -92.64 56.83 2.77 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 120.895 -1.356 . . . . 0.0 110.061 179.747 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -69.44 -39.42 77.82 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 120.939 -1.101 . . . . 0.0 109.707 179.649 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.56 81.54 1.74 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.234 -0.916 . . . . 0.0 110.094 179.923 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.994 HD12 HD13 ' A' ' 109' ' ' ILE . 2.2 tt -113.99 137.14 52.09 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.107 -0.996 . . . . 0.0 110.212 -179.983 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.44 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.0 p -105.56 -30.07 9.75 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.394 -0.816 . . . . 0.0 111.871 179.259 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.671 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 13.1 m -145.28 -168.03 2.84 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 120.323 -1.486 . . . . 0.0 109.444 178.813 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.623 HD21 ' HA ' ' A' ' 91' ' ' LEU . 15.1 mt -99.13 -37.03 9.49 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.119 -0.988 . . . . 0.0 110.492 178.898 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 1.8 ttt-85 -103.95 34.98 2.81 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.851 -1.156 . . . . 0.0 109.417 178.456 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.671 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.309 1.7 t -129.46 21.17 5.62 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -179.39 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.994 HD13 HD12 ' A' ' 103' ' ' LEU . 1.6 pt -156.73 37.08 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.282 0 O-C-N 120.953 -1.092 . . . . 0.0 110.634 -178.626 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.51 ' C ' HG23 ' A' ' 119' ' ' THR . 1.7 mt-30 . . . . . 0 N--CA 1.514 2.745 0 O-C-N 120.858 -1.151 . . . . 0.0 110.833 -178.864 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.51 HG23 ' C ' ' A' ' 110' ' ' GLN . 4.0 m . . . . . 0 N--CA 1.494 1.765 0 CA-C-O 120.659 0.266 . . . . 0.0 110.372 . . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 49.5 t -89.32 153.75 20.63 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.242 -0.911 . . . . 0.0 109.183 178.99 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.82 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -74.12 -35.63 41.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 121.048 -1.032 . . . . 0.0 111.184 -178.898 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.458 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.7 p -56.05 -35.84 67.37 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.886 -1.134 . . . . 0.0 111.058 -178.613 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.519 ' HG3' HG22 ' A' ' 109' ' ' ILE . 0.5 OUTLIER -58.82 -33.96 70.97 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.004 -1.06 . . . . 0.0 109.959 178.662 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 47.2 t -76.51 125.36 87.55 Favored Pre-proline 0 N--CA 1.505 2.28 0 O-C-N 121.065 -1.022 . . . . 0.0 110.077 179.957 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.4 ' HB3' ' CB ' ' A' ' 154' ' ' ALA . 37.9 Cg_endo -65.04 175.64 3.69 Favored 'Trans proline' 0 N--CA 1.488 1.204 0 O-C-N 123.236 1.124 . . . . 0.0 110.801 179.428 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -75.02 -36.66 61.91 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.274 -0.891 . . . . 0.0 110.542 -179.977 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.29 -40.36 77.63 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.035 -1.04 . . . . 0.0 109.989 -179.935 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.21 -42.43 75.77 Favored 'General case' 0 N--CA 1.506 2.356 0 C-N-CA 119.358 -0.937 . . . . 0.0 109.169 179.313 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.579 HD11 HD11 ' A' ' 121' ' ' ILE . 3.5 mt -66.94 -39.68 87.38 Favored 'General case' 0 N--CA 1.505 2.279 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.342 178.989 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -60.51 -38.02 82.99 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.237 -0.915 . . . . 0.0 109.82 179.404 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -57.74 -37.0 72.83 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.17 -0.956 . . . . 0.0 110.372 179.787 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -63.57 -50.38 69.69 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.131 -0.981 . . . . 0.0 109.673 179.862 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.53 -38.35 87.1 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.186 -0.946 . . . . 0.0 109.991 179.745 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 5.1 ttt85 -68.96 -36.53 78.0 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 121.057 -1.027 . . . . 0.0 110.265 179.61 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -79.03 -33.83 44.43 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.01 -1.056 . . . . 0.0 110.587 179.861 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 23.1 mttt -83.97 -19.28 34.88 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.054 -1.029 . . . . 0.0 111.765 179.758 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.37 32.73 10.07 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 -179.502 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 7.8 t -135.88 -160.88 1.1 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.031 -1.276 . . . . 0.0 109.738 179.883 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -132.72 142.21 48.93 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.063 -1.023 . . . . 0.0 110.232 179.905 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.7 p -125.6 160.54 31.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 O-C-N 121.246 -0.909 . . . . 0.0 110.027 179.738 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 32.4 t -167.71 83.14 0.2 Allowed 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.223 -0.923 . . . . 0.0 111.277 -179.828 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.752 ' CG ' HD12 ' A' ' 121' ' ' ILE . 46.6 t80 -92.72 159.61 15.35 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.175 -0.953 . . . . 0.0 109.981 179.601 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 20.7 m170 -136.97 -61.31 0.67 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.434 -0.791 . . . . 0.0 109.136 179.245 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -135.63 151.65 50.46 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.48 -0.762 . . . . 0.0 109.227 178.988 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 29.8 p -92.85 154.05 18.47 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.107 -0.996 . . . . 0.0 110.877 -179.761 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 26.8 m -72.05 -25.63 24.02 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.533 0 O-C-N 121.422 -0.799 . . . . 0.0 111.481 -179.487 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 64.0 m170 -51.32 -55.14 19.98 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 120.811 -1.18 . . . . 0.0 109.94 -179.958 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.5 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 28.4 p -131.39 -170.15 2.32 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.235 -0.915 . . . . 0.0 110.583 179.571 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 149' ' ' GLY . . . . . 0.4 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -97.7 58.44 1.09 Allowed Glycine 0 N--CA 1.492 2.425 0 N-CA-C 107.937 -2.065 . . . . 0.0 107.937 178.421 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 13.0 t -97.71 146.21 25.58 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.369 -1.077 . . . . 0.0 109.797 -179.157 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 14.9 mmt85 -98.16 50.29 1.01 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.287 -0.883 . . . . 0.0 109.503 179.123 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.95 98.0 0.03 OUTLIER Glycine 0 N--CA 1.486 2.008 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 -179.877 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.0 p -110.48 129.35 55.8 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.298 -1.119 . . . . 0.0 110.336 179.699 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 154' ' ' ALA . . . . . 0.4 ' CB ' ' HB3' ' A' ' 125' ' ' PRO . . . -143.08 145.75 33.16 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.05 -1.031 . . . . 0.0 110.046 -179.789 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.499 1.99 0 O-C-N 121.159 -0.963 . . . . 0.0 110.62 -179.752 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.865 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.511 2.579 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 . . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -83.12 83.08 1.99 Allowed 'Trans proline' 0 C--N 1.318 -1.057 0 O-C-N 123.186 1.098 . . . . 0.0 112.434 -178.131 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 48.81 92.07 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.322 -0.862 . . . . 0.0 111.676 178.473 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.06 -39.58 0.46 Allowed Glycine 0 N--CA 1.5 2.95 0 C-N-CA 119.658 -1.258 . . . . 0.0 110.579 179.554 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.582 ' N ' HD21 ' A' ' 77' ' ' LEU . 18.1 t80 -58.03 -31.47 67.02 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.073 -1.251 . . . . 0.0 110.509 179.812 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -52.69 -33.81 49.21 Favored 'General case' 0 N--CA 1.512 2.671 0 O-C-N 120.968 -1.083 . . . . 0.0 110.218 179.247 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 42.8 mmtt -58.4 -38.2 76.87 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.147 -0.971 . . . . 0.0 110.111 179.525 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.525 HD11 HD21 ' A' ' 81' ' ' LEU . 3.8 pt -116.65 36.94 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.213 -0.929 . . . . 0.0 110.499 179.727 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.427 ' N ' ' HD2' ' A' ' 21' ' ' PRO . 1.4 tmtt? -84.1 -42.64 0.76 Allowed Pre-proline 0 N--CA 1.508 2.447 0 O-C-N 121.173 -0.954 . . . . 0.0 113.523 -178.941 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.427 ' HD2' ' N ' ' A' ' 20' ' ' LYS . 44.6 Cg_endo -74.58 -36.88 2.63 Favored 'Trans proline' 0 N--CA 1.486 1.054 0 O-C-N 122.518 0.746 . . . . 0.0 111.967 -177.971 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.959 HG21 ' CE2' ' A' ' 62' ' ' TYR . 70.4 m -62.22 -48.0 81.91 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 120.96 -1.088 . . . . 0.0 109.786 -179.97 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.428 ' CD1' HD12 ' A' ' 19' ' ' ILE . 5.2 mt -60.09 -35.42 75.16 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.252 -0.905 . . . . 0.0 109.825 179.196 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 25.2 m -55.76 -36.91 67.84 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.026 -1.046 . . . . 0.0 110.11 179.324 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -57.47 -38.42 74.48 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.184 -0.948 . . . . 0.0 109.946 179.554 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.75 ' CD2' HD22 ' A' ' 55' ' ' LEU . 20.5 m-85 -59.34 -40.66 87.08 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.15 -0.969 . . . . 0.0 109.887 179.616 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -58.63 -25.27 62.52 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.299 -0.875 . . . . 0.0 111.321 -179.874 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.537 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.6 mp -79.0 -34.61 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.442 0 O-C-N 120.889 -1.132 . . . . 0.0 109.833 179.705 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -81.85 -36.72 27.95 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.007 -1.058 . . . . 0.0 109.109 178.554 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.737 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -73.9 -31.98 63.37 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.163 -0.96 . . . . 0.0 110.109 178.81 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.1 ptm180 -69.57 -36.49 76.34 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 120.799 -1.188 . . . . 0.0 109.753 179.354 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.49 -42.19 99.33 Favored 'General case' 0 N--CA 1.508 2.435 0 C-N-CA 119.043 -1.063 . . . . 0.0 109.123 179.316 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.602 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -69.7 -42.4 74.14 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.373 -0.931 . . . . 0.0 108.839 178.775 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 34.3 mm-40 -58.98 -35.02 72.51 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.308 -0.87 . . . . 0.0 110.138 179.436 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -90.04 -39.45 12.93 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 120.976 -1.077 . . . . 0.0 110.133 179.653 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.6 t70 . . . . . 0 N--CA 1.51 2.544 0 O-C-N 121.2 -0.937 . . . . 0.0 110.308 179.639 . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 28.3 t . . . . . 0 N--CA 1.502 2.168 0 CA-C-O 120.396 0.141 . . . . 0.0 110.733 . . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.403 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 15.1 m-80 -57.51 -40.62 79.09 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.073 -1.017 . . . . 0.0 109.954 179.918 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -61.23 -40.0 92.37 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.229 -0.92 . . . . 0.0 109.878 179.667 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 25.4 tp60 -68.13 -38.96 82.78 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.123 -0.986 . . . . 0.0 109.858 179.574 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.539 HD23 HD12 ' A' ' 52' ' ' ILE . 63.4 mt -70.19 -33.51 71.81 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.193 -0.942 . . . . 0.0 110.599 179.91 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.487 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.1 m0 -57.43 -40.89 79.37 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 120.865 -1.147 . . . . 0.0 109.85 179.824 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -63.18 -33.83 76.33 Favored 'General case' 0 N--CA 1.504 2.24 0 C-N-CA 119.177 -1.009 . . . . 0.0 109.481 178.413 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.737 HG23 ' CG ' ' A' ' 30' ' ' LEU . 76.1 mt -71.28 -56.04 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.217 0 O-C-N 121.059 -1.025 . . . . 0.0 109.218 179.323 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.3 ptm -63.21 -30.19 71.39 Favored 'General case' 0 N--CA 1.506 2.374 0 C-N-CA 118.547 -1.261 . . . . 0.0 109.883 178.816 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -66.6 -38.97 88.12 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 120.817 -1.177 . . . . 0.0 108.907 178.227 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.75 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.5 mt -53.63 -33.13 54.01 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 121.105 -0.997 . . . . 0.0 110.117 178.93 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.474 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 69.6 t60 -54.73 -37.9 66.46 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.048 -1.032 . . . . 0.0 109.973 179.668 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.434 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.0 m170 -60.89 -49.38 77.68 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.2 -0.938 . . . . 0.0 109.257 179.437 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.57 -36.21 77.93 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.386 -0.925 . . . . 0.0 109.374 178.74 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.42 ' HG3' ' CE2' ' A' ' 26' ' ' PHE . 0.5 OUTLIER -62.6 -49.76 73.96 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.139 -0.976 . . . . 0.0 109.299 179.229 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 92.3 p -64.65 -39.97 94.63 Favored 'General case' 0 N--CA 1.503 2.199 0 C-N-CA 119.222 -0.991 . . . . 0.0 108.982 179.175 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.1 ttp85 -63.18 -40.25 96.97 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.135 -0.978 . . . . 0.0 109.091 178.927 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.959 ' CE2' HG21 ' A' ' 22' ' ' THR . 43.6 t80 -64.15 -53.76 44.35 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.202 -0.937 . . . . 0.0 109.187 179.293 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.722 HD12 ' HB2' ' A' ' 87' ' ' ALA . 78.6 mt -66.28 -34.71 72.0 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 C-N-CA 119.163 -1.015 . . . . 0.0 109.36 179.292 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.461 ' HD2' HD13 ' A' ' 92' ' ' ILE . 12.4 t80 -68.87 -42.57 76.82 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.993 -1.067 . . . . 0.0 108.797 178.789 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.403 ' HA ' ' HD3' ' A' ' 69' ' ' LYS . 85.4 m -59.45 -39.28 83.08 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.219 -0.926 . . . . 0.0 110.615 -179.608 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.609 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.6 pp -83.02 -34.42 26.29 Favored 'General case' 0 N--CA 1.503 2.224 0 C-N-CA 118.596 -1.241 . . . . 0.0 112.114 -179.08 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.548 ' N ' HD12 ' A' ' 66' ' ' LEU . 36.5 t80 -86.52 -32.09 20.92 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 120.705 -1.247 . . . . 0.0 111.948 -179.395 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.436 ' CD2' ' CE2' ' A' ' 64' ' ' TYR . 9.4 m-85 -98.39 -17.9 18.58 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.764 -1.21 . . . . 0.0 112.943 -178.495 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.403 ' HD3' ' HA ' ' A' ' 65' ' ' THR . 21.0 mtpt -118.29 -57.16 2.1 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.433 -1.417 . . . . 0.0 110.846 -179.962 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.406 ' HB2' ' HA ' ' A' ' 66' ' ' LEU . 46.4 mtp180 -68.8 -29.25 67.57 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.177 -0.952 . . . . 0.0 110.964 -179.581 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.21 42.02 22.66 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 120.881 -1.137 . . . . 0.0 109.896 -179.425 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.86 35.25 3.97 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.453 -0.779 . . . . 0.0 109.927 179.286 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.609 HG21 ' CD1' ' A' ' 66' ' ' LEU . 13.4 tt -152.91 162.05 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.2 -0.937 . . . . 0.0 109.775 179.933 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -108.33 149.57 28.5 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.155 -0.966 . . . . 0.0 110.204 -179.916 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.2 ttpt -46.84 -32.23 3.59 Favored 'General case' 0 N--CA 1.514 2.763 0 O-C-N 121.314 -0.866 . . . . 0.0 111.426 179.992 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -64.24 -47.82 78.18 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 120.846 -1.159 . . . . 0.0 109.319 179.349 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.582 HD21 ' N ' ' A' ' 16' ' ' PHE . 0.4 OUTLIER -67.39 -41.01 85.67 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.186 -0.946 . . . . 0.0 108.749 178.869 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.472 ' CE1' HG22 ' A' ' 63' ' ' ILE . 13.2 t80 -66.33 -41.34 89.77 Favored 'General case' 0 N--CA 1.505 2.298 0 C-N-CA 119.565 -0.854 . . . . 0.0 109.263 179.027 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -72.9 -41.78 64.24 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.136 -0.978 . . . . 0.0 108.788 178.78 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.865 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 87.8 t90 -55.8 -37.37 68.53 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.158 -0.964 . . . . 0.0 109.31 178.803 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.525 HD21 HD11 ' A' ' 19' ' ' ILE . 17.2 mt -67.81 -59.76 3.05 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.136 -0.978 . . . . 0.0 108.627 178.869 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.537 HG21 ' HG3' ' A' ' 89' ' ' LYS . 3.8 mt -57.18 -26.91 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 O-C-N 120.924 -1.11 . . . . 0.0 110.026 179.306 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.2 tptm -80.19 -18.74 48.77 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 120.873 -1.142 . . . . 0.0 110.946 178.549 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.44 ' HB2' ' CE1' ' A' ' 86' ' ' TYR . 11.0 mm-40 -109.24 23.89 13.87 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.66 -1.275 . . . . 0.0 112.0 179.982 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.418 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 15.0 tttm 77.17 68.35 0.05 Allowed 'General case' 0 N--CA 1.515 2.775 0 O-C-N 121.212 -0.93 . . . . 0.0 112.133 179.243 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.472 ' CE2' HD23 ' A' ' 81' ' ' LEU . 21.6 m-85 -130.53 -62.4 0.92 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.404 -0.81 . . . . 0.0 109.186 179.196 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.722 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -128.6 173.32 10.38 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.447 -0.783 . . . . 0.0 109.602 179.596 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.474 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 13.7 t0 -120.29 108.54 14.3 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.035 -1.041 . . . . 0.0 110.453 179.965 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.537 ' HG3' HG21 ' A' ' 82' ' ' ILE . 20.8 mtmt -58.84 -39.17 80.46 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.195 -0.941 . . . . 0.0 110.1 179.863 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.574 HD23 HD22 ' A' ' 106' ' ' LEU . 16.5 tp -59.61 -38.58 81.66 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.108 -0.995 . . . . 0.0 110.258 -179.831 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.461 ' N ' HD11 ' A' ' 106' ' ' LEU . 53.6 tp -68.18 -48.76 64.41 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.191 -1.004 . . . . 0.0 109.184 179.482 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.461 HD13 ' HD2' ' A' ' 64' ' ' TYR . 70.8 mt -59.59 -37.91 72.89 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.495 0 O-C-N 121.126 -0.984 . . . . 0.0 108.838 178.658 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.76 -38.98 87.67 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.12 -0.988 . . . . 0.0 109.059 178.442 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.616 ' HB3' HD22 ' A' ' 103' ' ' LEU . 9.6 mmtm -57.17 -42.97 82.12 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.116 -0.99 . . . . 0.0 109.493 179.34 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 2.4 m0 -63.52 -33.43 75.57 Favored 'General case' 0 N--CA 1.507 2.418 0 C-N-CA 119.583 -0.847 . . . . 0.0 110.316 179.576 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.8 -33.25 25.0 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.024 -1.048 . . . . 0.0 110.655 179.611 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.8 mmmt -51.31 176.93 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.761 0 O-C-N 120.857 -1.152 . . . . 0.0 110.831 179.907 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -103.5 140.81 37.01 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.196 -0.94 . . . . 0.0 109.321 179.163 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 102.48 -26.91 22.53 Favored Glycine 0 N--CA 1.493 2.451 0 C-N-CA 119.755 -1.212 . . . . 0.0 110.106 -179.099 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.568 ' HB3' HD23 ' A' ' 103' ' ' LEU . 67.6 m-85 -92.29 57.85 3.12 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 120.83 -1.394 . . . . 0.0 110.132 179.815 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -68.66 -36.87 79.13 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 120.936 -1.102 . . . . 0.0 110.009 179.637 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.31 81.75 2.0 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.064 -1.022 . . . . 0.0 110.481 -179.88 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.649 ' HB2' HD13 ' A' ' 109' ' ' ILE . 2.0 pp -116.4 140.23 49.57 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.084 -1.01 . . . . 0.0 110.1 179.703 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.434 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.1 p -107.4 -30.21 8.81 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.241 -0.912 . . . . 0.0 112.575 -179.722 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.712 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 10.9 m -146.41 -170.3 3.47 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 120.329 -1.482 . . . . 0.0 109.994 179.23 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.574 HD22 HD23 ' A' ' 90' ' ' LEU . 18.0 mt -99.61 -34.98 10.0 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.337 -0.852 . . . . 0.0 110.445 178.688 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 3.9 ttm180 -104.57 36.05 2.54 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.8 -1.188 . . . . 0.0 109.205 178.275 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.712 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.281 1.6 t -127.68 -59.55 1.2 Allowed 'General case' 0 N--CA 1.497 1.905 0 N-CA-C 105.901 -1.889 . . . . 0.0 105.901 -179.426 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.673 ' O ' HG21 ' A' ' 119' ' ' THR . 9.4 pt -67.81 -23.71 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.699 0 O-C-N 120.925 -1.109 . . . . 0.0 111.052 177.084 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.57 ' C ' HG23 ' A' ' 119' ' ' THR . 27.3 tt0 . . . . . 0 N--CA 1.492 1.661 0 O-C-N 120.836 -1.165 . . . . 0.0 110.024 -179.321 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.673 HG21 ' O ' ' A' ' 109' ' ' ILE . 1.6 m . . . . . 0 N--CA 1.496 1.868 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 . . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 27.4 t -57.97 154.59 12.2 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.134 -0.979 . . . . 0.0 109.952 179.821 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.827 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -75.15 -34.92 32.79 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.471 0 O-C-N 121.14 -0.975 . . . . 0.0 111.239 -179.269 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.469 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 12.1 p -54.42 -33.6 59.74 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.763 -1.21 . . . . 0.0 111.251 -178.485 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.5 -34.99 73.29 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 120.916 -1.115 . . . . 0.0 109.615 178.471 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 47.7 t -79.91 124.87 82.97 Favored Pre-proline 0 N--CA 1.504 2.254 0 O-C-N 121.134 -0.979 . . . . 0.0 109.884 179.786 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.609 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.0 Cg_endo -65.03 176.33 3.17 Favored 'Trans proline' 0 N--CA 1.489 1.233 0 O-C-N 123.113 1.059 . . . . 0.0 110.921 179.499 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -75.04 -37.21 61.77 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.296 -0.877 . . . . 0.0 110.481 -179.837 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.27 -40.75 78.36 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 120.954 -1.091 . . . . 0.0 109.926 179.946 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 9.9 tp60 -70.27 -41.61 73.19 Favored 'General case' 0 N--CA 1.505 2.305 0 C-N-CA 119.378 -0.929 . . . . 0.0 108.998 178.956 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.611 HD11 HD11 ' A' ' 121' ' ' ILE . 2.2 mt -65.09 -39.3 92.97 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.301 -0.875 . . . . 0.0 109.394 179.081 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -60.1 -39.51 86.44 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.134 -0.979 . . . . 0.0 109.905 179.639 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -58.72 -37.2 75.61 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.173 -0.955 . . . . 0.0 110.289 179.755 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -59.97 -43.46 95.05 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.159 -0.963 . . . . 0.0 109.957 179.925 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 133' ' ' ALA . . . . . 0.662 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -60.12 -38.96 84.6 Favored 'General case' 0 N--CA 1.51 2.544 0 C-N-CA 119.374 -0.93 . . . . 0.0 109.993 179.879 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 20.9 mtt-85 -67.11 -40.27 86.84 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.142 -0.974 . . . . 0.0 109.822 179.803 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 26.6 mmtp -68.95 -35.99 77.42 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.206 -0.934 . . . . 0.0 110.34 179.714 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 136' ' ' LYS . . . . . 0.431 ' HB3' HG22 ' A' ' 138' ' ' THR . 2.4 tppt? -85.48 -21.7 28.55 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.045 -1.034 . . . . 0.0 111.446 179.781 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 91.61 31.47 9.44 Favored Glycine 0 N--CA 1.493 2.473 0 N-CA-C 110.069 -1.213 . . . . 0.0 110.069 -179.727 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.662 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.9 t -140.64 -161.66 1.24 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.961 -1.317 . . . . 0.0 109.835 179.682 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -123.2 171.54 9.27 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.124 -0.985 . . . . 0.0 110.266 179.997 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 10.1 p -155.18 160.45 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.203 -0.936 . . . . 0.0 110.702 179.801 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 44.2 t -168.51 89.28 0.24 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.288 -0.882 . . . . 0.0 111.086 -179.937 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.73 ' CG ' HD12 ' A' ' 121' ' ' ILE . 50.3 t80 -95.69 159.02 15.19 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.235 -0.915 . . . . 0.0 110.13 179.867 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 8.3 m80 -136.46 -61.4 0.69 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.47 -0.769 . . . . 0.0 109.08 179.179 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 144' ' ' GLN . . . . . 0.405 ' OE1' ' CZ3' ' A' ' 50' ' ' TRP . 11.5 pt20 -135.74 151.28 49.98 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 178.918 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 145' ' ' CYS . . . . . 0.425 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.3 p -90.13 153.09 20.79 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.155 -1.018 . . . . 0.0 111.008 -179.67 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.8 m -71.14 -26.73 27.71 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 C-N-CA 119.715 -0.794 . . . . 0.0 111.496 -179.436 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 63.7 m170 -51.69 -60.66 2.91 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 120.835 -1.166 . . . . 0.0 110.288 -179.856 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.487 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 24.3 p -125.29 -170.9 2.25 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.214 -0.929 . . . . 0.0 110.849 179.862 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -95.78 59.41 1.5 Allowed Glycine 0 N--CA 1.493 2.451 0 N-CA-C 108.297 -1.921 . . . . 0.0 108.297 178.752 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 19.3 t -100.91 140.38 35.29 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.372 -1.075 . . . . 0.0 109.849 -179.367 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.6 53.18 1.43 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.282 -0.886 . . . . 0.0 109.563 179.287 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.95 98.52 0.03 OUTLIER Glycine 0 N--CA 1.486 2.001 0 N-CA-C 109.81 -1.316 . . . . 0.0 109.81 -179.952 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.8 p -108.75 127.59 54.13 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.303 -1.116 . . . . 0.0 110.451 179.683 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -143.23 147.8 35.42 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.129 -0.982 . . . . 0.0 109.927 -179.68 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.498 1.954 0 O-C-N 121.218 -0.926 . . . . 0.0 110.624 -179.709 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.666 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.505 2.282 0 N-CA-C 109.765 -0.458 . . . . 0.0 109.765 . . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -71.21 163.74 38.11 Favored 'Trans proline' 0 C--N 1.316 -1.158 0 O-C-N 123.433 1.228 . . . . 0.0 110.89 -179.669 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -48.72 -31.67 7.25 Favored 'General case' 0 N--CA 1.513 2.715 0 O-C-N 121.416 -0.802 . . . . 0.0 111.463 -179.892 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.62 -34.88 36.5 Favored Glycine 0 N--CA 1.499 2.863 0 O-C-N 120.961 -1.087 . . . . 0.0 110.552 179.828 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.405 ' HB2' HD11 ' A' ' 77' ' ' LEU . 28.2 t80 -55.4 -32.79 62.95 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 121.008 -1.289 . . . . 0.0 110.614 179.692 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -54.3 -37.66 65.04 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 121.039 -1.038 . . . . 0.0 110.234 179.695 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 27.9 mttt -57.59 -36.74 72.14 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.303 -0.873 . . . . 0.0 110.177 179.452 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.89 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.1 pt -116.64 35.06 1.13 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.176 -0.952 . . . . 0.0 110.449 179.509 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.431 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 1.2 tmtt? -84.79 -43.04 0.69 Allowed Pre-proline 0 N--CA 1.509 2.511 0 O-C-N 121.122 -0.986 . . . . 0.0 113.172 -179.024 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.9 Cg_endo -76.22 -37.7 1.37 Allowed 'Trans proline' 0 N--CA 1.487 1.121 0 O-C-N 122.618 0.799 . . . . 0.0 111.571 -178.337 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.759 HG21 ' CE2' ' A' ' 62' ' ' TYR . 88.5 m -59.6 -41.62 90.74 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.031 -1.043 . . . . 0.0 109.959 -179.726 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.89 HD12 ' O ' ' A' ' 19' ' ' ILE . 6.0 mt -65.19 -39.57 93.04 Favored 'General case' 0 N--CA 1.506 2.338 0 C-N-CA 119.484 -0.887 . . . . 0.0 109.461 179.238 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.15 -35.02 69.02 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.073 -1.017 . . . . 0.0 110.235 179.335 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -56.45 -35.82 68.33 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 121.118 -0.988 . . . . 0.0 110.407 179.82 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.571 ' CE2' HD12 ' A' ' 55' ' ' LEU . 15.8 m-85 -57.25 -36.84 71.45 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.074 -1.016 . . . . 0.0 110.673 -179.952 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -60.31 -37.96 82.2 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.149 -0.969 . . . . 0.0 110.893 -178.93 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.409 HD12 ' H ' ' A' ' 28' ' ' ILE . 2.9 mp -63.28 -40.31 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.475 0 C-N-CA 118.992 -1.083 . . . . 0.0 108.961 179.783 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -70.08 -55.98 8.08 Favored 'General case' 0 N--CA 1.505 2.316 0 C-N-CA 119.115 -1.034 . . . . 0.0 108.468 178.63 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.939 HD12 HD23 ' A' ' 55' ' ' LEU . 0.8 OUTLIER -56.67 -31.28 64.27 Favored 'General case' 0 N--CA 1.509 2.508 0 C-N-CA 119.242 -0.983 . . . . 0.0 109.738 178.382 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -57.75 -38.78 75.98 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 120.942 -1.099 . . . . 0.0 110.19 179.891 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -64.32 -50.29 68.4 Favored 'General case' 0 N--CA 1.506 2.351 0 C-N-CA 119.097 -1.041 . . . . 0.0 109.728 -179.902 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.449 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -70.61 -37.59 73.88 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.371 -0.932 . . . . 0.0 109.517 179.183 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 7.2 mm100 -71.55 -30.82 66.31 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 121.164 -0.96 . . . . 0.0 110.206 179.339 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.7 mtpp -91.79 -35.21 14.24 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.905 -1.122 . . . . 0.0 110.552 179.771 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 . . . . . 0 N--CA 1.506 2.361 0 O-C-N 121.109 -0.994 . . . . 0.0 109.356 179.377 . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 38.6 t . . . . . 0 N--CA 1.496 1.838 0 CA-C-O 120.599 0.238 . . . . 0.0 110.496 . . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 -55.87 -39.23 71.23 Favored 'General case' 0 N--CA 1.512 2.642 0 O-C-N 121.208 -0.932 . . . . 0.0 109.91 179.846 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -59.55 -36.79 76.86 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.269 -0.894 . . . . 0.0 110.028 179.524 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -62.08 -47.47 84.49 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.076 -1.015 . . . . 0.0 109.718 179.89 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 49' ' ' LEU . 12.5 mt -58.52 -38.04 76.89 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.187 -0.945 . . . . 0.0 110.127 179.908 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 48.1 m0 -59.23 -34.04 71.73 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.122 -0.986 . . . . 0.0 110.049 179.464 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.666 ' O ' HD22 ' A' ' 55' ' ' LEU . 0.7 OUTLIER -62.76 -31.09 71.98 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.077 -1.015 . . . . 0.0 109.947 178.646 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.745 HG23 HD11 ' A' ' 30' ' ' LEU . 5.7 mt -71.41 -58.89 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.263 0 O-C-N 120.921 -1.112 . . . . 0.0 109.324 179.547 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.52 -25.95 60.62 Favored 'General case' 0 N--CA 1.513 2.717 0 C-N-CA 118.312 -1.355 . . . . 0.0 110.076 178.829 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.6 mm100 -64.07 -40.07 95.46 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 120.742 -1.224 . . . . 0.0 109.405 178.522 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.939 HD23 HD12 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -55.0 -33.93 62.99 Favored 'General case' 0 N--CA 1.513 2.702 0 O-C-N 120.942 -1.099 . . . . 0.0 109.873 179.074 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.47 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 16.3 t60 -55.54 -39.78 71.02 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 120.972 -1.08 . . . . 0.0 110.291 -179.672 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 57' ' ' HIS . . . . . 0.446 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.2 m170 -64.85 -50.96 64.59 Favored 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 119.208 -0.997 . . . . 0.0 109.61 179.45 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 54.1 tp60 -57.11 -34.87 68.78 Favored 'General case' 0 N--CA 1.507 2.423 0 C-N-CA 119.436 -0.905 . . . . 0.0 109.962 179.286 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.456 ' HD3' ' CD1' ' A' ' 26' ' ' PHE . 19.2 mmm-85 -65.16 -50.32 66.43 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.027 -1.046 . . . . 0.0 109.567 179.333 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 53.8 p -60.76 -39.91 90.52 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.375 -0.93 . . . . 0.0 109.695 179.769 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.2 tpt180 -63.97 -41.19 97.63 Favored 'General case' 0 N--CA 1.505 2.314 0 C-N-CA 119.174 -1.01 . . . . 0.0 109.186 179.204 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.759 ' CE2' HG21 ' A' ' 22' ' ' THR . 36.7 t80 -63.23 -49.95 72.16 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.177 -0.952 . . . . 0.0 109.682 179.499 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.881 HD12 ' HB2' ' A' ' 87' ' ' ALA . 74.0 mt -71.61 -36.03 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 O-C-N 121.209 -0.932 . . . . 0.0 109.654 179.585 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.437 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 10.5 t80 -69.28 -41.64 76.57 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 120.974 -1.079 . . . . 0.0 108.871 178.848 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 87.8 m -61.19 -40.85 95.47 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.046 -1.034 . . . . 0.0 109.876 179.683 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.659 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.8 pp -83.23 -35.89 25.03 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 120.962 -1.086 . . . . 0.0 112.374 -179.241 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.596 ' N ' HD12 ' A' ' 66' ' ' LEU . 63.9 t80 -86.58 -35.14 19.64 Favored 'General case' 0 N--CA 1.513 2.71 0 O-C-N 120.585 -1.322 . . . . 0.0 111.839 -179.499 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.437 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 7.6 m-85 -98.26 -3.58 37.03 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 120.837 -1.164 . . . . 0.0 113.17 -178.574 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.76 -58.86 0.61 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.354 -1.466 . . . . 0.0 110.819 179.555 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.408 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 10.1 tpt180 -63.11 -29.12 70.55 Favored 'General case' 0 N--CA 1.51 2.561 0 O-C-N 121.063 -1.023 . . . . 0.0 110.609 179.956 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt 57.83 43.34 21.85 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 120.855 -1.153 . . . . 0.0 110.163 -179.512 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -115.02 36.86 3.69 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.499 -0.751 . . . . 0.0 109.737 179.213 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.744 HG13 HD23 ' A' ' 77' ' ' LEU . 13.8 tt -156.43 162.39 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.21 -0.931 . . . . 0.0 110.174 -179.83 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 31.8 m -109.93 147.54 33.24 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.163 -0.961 . . . . 0.0 109.971 179.595 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.2 tttm -45.29 -32.61 2.05 Favored 'General case' 0 N--CA 1.516 2.829 0 O-C-N 121.406 -0.809 . . . . 0.0 111.675 -179.866 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -61.72 -50.35 72.79 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 120.95 -1.093 . . . . 0.0 109.324 179.496 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.744 HD23 HG13 ' A' ' 73' ' ' ILE . 25.4 tp -67.27 -43.7 81.16 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 119.15 -1.02 . . . . 0.0 108.582 178.831 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.491 ' HA ' HD12 ' A' ' 81' ' ' LEU . 16.1 t80 -60.66 -37.97 83.3 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.312 -0.868 . . . . 0.0 109.435 178.913 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.475 ' O ' HG22 ' A' ' 82' ' ' ILE . 10.0 t70 -74.88 -41.38 59.9 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.099 -1.0 . . . . 0.0 108.968 178.786 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.666 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 82.6 t90 -59.21 -38.45 79.94 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.111 -0.993 . . . . 0.0 109.212 178.816 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.491 HD12 ' HA ' ' A' ' 78' ' ' TYR . 15.1 mt -65.95 -55.8 14.99 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.249 -0.907 . . . . 0.0 109.278 179.116 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.524 HD12 ' HB3' ' A' ' 87' ' ' ALA . 0.8 OUTLIER -56.22 -27.11 23.24 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.429 0 O-C-N 121.16 -0.962 . . . . 0.0 110.852 -179.633 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.18 -18.71 26.57 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.95 -1.094 . . . . 0.0 111.674 179.598 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.446 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 10.4 mm-40 -103.75 25.19 10.11 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 120.601 -1.312 . . . . 0.0 111.809 179.97 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 7.8 mmpt? 75.25 69.97 0.08 Allowed 'General case' 0 N--CA 1.513 2.72 0 O-C-N 121.319 -0.863 . . . . 0.0 111.989 179.362 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.524 ' HE2' HD13 ' A' ' 23' ' ' LEU . 27.7 m-85 -131.9 -64.0 0.8 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.41 -0.806 . . . . 0.0 109.192 178.997 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.881 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -129.71 -178.68 4.8 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.339 -0.85 . . . . 0.0 109.734 179.44 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.47 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 6.4 t70 -131.12 124.24 30.31 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.093 -1.004 . . . . 0.0 110.615 -179.835 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -74.35 -36.75 63.62 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.264 -0.897 . . . . 0.0 109.899 179.349 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.903 HD23 HD13 ' A' ' 106' ' ' LEU . 16.0 tp -60.1 -43.35 95.62 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.022 -1.049 . . . . 0.0 109.763 179.867 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.691 ' HA ' HD21 ' A' ' 106' ' ' LEU . 67.8 tp -67.56 -48.54 66.63 Favored 'General case' 0 N--CA 1.506 2.364 0 C-N-CA 119.16 -1.016 . . . . 0.0 108.511 179.014 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 63.9 mt -58.52 -40.0 77.26 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.473 0 O-C-N 121.112 -0.993 . . . . 0.0 108.628 178.464 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.91 -39.23 91.3 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.18 -0.95 . . . . 0.0 109.459 178.803 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.411 ' HB3' ' CD2' ' A' ' 103' ' ' LEU . 5.8 mmtt -59.0 -45.4 90.77 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.051 -1.031 . . . . 0.0 109.423 179.523 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.498 ' CD1' HD23 ' A' ' 103' ' ' LEU . 8.2 m0 -64.53 -41.93 96.07 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.45 -0.9 . . . . 0.0 109.718 179.639 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 3.0 mtp85 -65.27 -31.73 73.03 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.319 -0.863 . . . . 0.0 110.595 179.58 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 3.1 mmtp -54.26 -177.17 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.668 0 O-C-N 121.018 -1.051 . . . . 0.0 110.524 179.934 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.71 133.3 52.32 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.181 -0.949 . . . . 0.0 109.838 179.405 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.23 4.16 55.3 Favored Glycine 0 N--CA 1.493 2.458 0 C-N-CA 120.149 -1.024 . . . . 0.0 111.184 -179.488 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -110.29 46.86 1.0 Allowed 'General case' 0 N--CA 1.497 1.924 0 CA-C-N 119.658 1.729 . . . . 0.0 110.048 179.696 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -60.85 -39.74 90.25 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.171 -0.956 . . . . 0.0 109.829 179.835 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -116.01 101.89 9.16 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.3 -0.875 . . . . 0.0 109.899 179.906 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.699 HD11 ' O ' ' A' ' 105' ' ' CYS . 1.2 tp -137.98 139.82 39.89 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.247 -0.908 . . . . 0.0 109.452 -179.372 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.681 ' N ' HD12 ' A' ' 103' ' ' LEU . 29.4 p -112.36 -37.76 4.89 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.148 -0.97 . . . . 0.0 112.765 -179.521 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 105' ' ' CYS . . . . . 0.699 ' O ' HD11 ' A' ' 103' ' ' LEU . 6.4 m -142.57 -169.43 2.98 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 120.209 -1.557 . . . . 0.0 110.361 179.292 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.903 HD13 HD23 ' A' ' 90' ' ' LEU . 18.0 mt -96.69 -38.76 9.79 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.103 -0.998 . . . . 0.0 110.28 179.124 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 8.1 ttm180 -101.03 29.2 4.76 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 120.944 -1.098 . . . . 0.0 109.883 178.012 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.654 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.299 1.8 t -126.64 14.35 7.55 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.052 -1.03 . . . . 0.0 109.344 -179.429 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.576 ' CD1' HD13 ' A' ' 103' ' ' LEU . 1.0 OUTLIER -160.07 37.88 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.386 0 O-C-N 120.826 -1.171 . . . . 0.0 110.648 -178.963 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.654 ' O ' HG23 ' A' ' 119' ' ' THR . 25.8 mt-30 . . . . . 0 N--CA 1.499 1.993 0 O-C-N 120.678 -1.264 . . . . 0.0 111.552 -178.562 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.654 HG23 ' O ' ' A' ' 110' ' ' GLN . 1.7 m . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 120.779 0.323 . . . . 0.0 110.255 . . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.432 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 48.1 t -97.7 155.52 16.97 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.319 -0.863 . . . . 0.0 109.068 178.996 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.722 HG23 ' CE1' ' A' ' 142' ' ' PHE . 14.6 tt -77.49 -29.43 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.296 0 O-C-N 120.995 -1.066 . . . . 0.0 112.022 -179.257 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.475 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.3 p -54.76 -35.78 64.15 Favored 'General case' 0 N--CA 1.512 2.643 0 O-C-N 120.517 -1.365 . . . . 0.0 110.2 -179.278 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.86 -29.39 64.97 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.984 -1.072 . . . . 0.0 109.514 177.476 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.525 HG12 ' HG ' ' A' ' 129' ' ' LEU . 51.2 t -73.16 118.37 68.0 Favored Pre-proline 0 N--CA 1.507 2.403 0 O-C-N 121.1 -1.0 . . . . 0.0 110.221 179.764 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.404 ' HB3' ' CB ' ' A' ' 154' ' ' ALA . 37.7 Cg_endo -64.91 168.44 13.66 Favored 'Trans proline' 0 N--CA 1.489 1.221 0 O-C-N 123.088 1.046 . . . . 0.0 110.678 178.736 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 -74.98 -38.9 61.53 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.199 -0.938 . . . . 0.0 110.335 179.983 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.66 -40.62 83.99 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.079 -1.013 . . . . 0.0 110.078 -179.779 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -66.08 -41.65 90.43 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.167 -0.958 . . . . 0.0 109.514 179.604 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.611 ' O ' HG11 ' A' ' 140' ' ' VAL . 58.0 mt -64.15 -40.2 95.64 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.191 -0.943 . . . . 0.0 109.633 179.502 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -60.34 -39.15 86.09 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.211 -0.93 . . . . 0.0 110.126 179.955 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.75 -39.01 93.24 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.059 -1.025 . . . . 0.0 110.184 179.924 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -65.46 -40.42 93.16 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.176 -0.952 . . . . 0.0 109.881 179.879 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -66.54 -41.08 89.24 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.149 -0.969 . . . . 0.0 109.647 179.704 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.26 -33.44 73.55 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.134 -0.979 . . . . 0.0 110.185 179.493 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 22.2 mttt -79.26 -29.22 42.52 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.893 -1.129 . . . . 0.0 111.147 179.975 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 36.9 mttt -97.53 21.96 9.55 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 120.825 -1.172 . . . . 0.0 111.855 -179.941 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.18 46.42 56.72 Favored Glycine 0 N--CA 1.499 2.898 0 O-C-N 120.666 -1.271 . . . . 0.0 110.8 179.317 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 7.9 t -149.39 -164.68 2.08 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.203 -1.174 . . . . 0.0 110.404 179.987 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -134.34 162.77 31.29 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.106 -0.996 . . . . 0.0 110.346 -179.902 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.611 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.9 p -151.16 161.43 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.257 -0.902 . . . . 0.0 110.453 -179.85 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 46.5 t -170.38 110.3 0.38 Allowed 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.179 -0.951 . . . . 0.0 111.202 179.789 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 142' ' ' PHE . . . . . 0.722 ' CE1' HG23 ' A' ' 121' ' ' ILE . 86.0 t80 -105.78 158.78 16.49 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.224 -0.922 . . . . 0.0 110.601 179.741 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 21.9 t-160 -138.42 -60.07 0.62 Allowed 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.673 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -148.05 149.01 31.32 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.42 -0.8 . . . . 0.0 109.175 178.646 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 145' ' ' CYS . . . . . 0.454 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 25.0 p -93.46 156.1 16.96 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.007 -1.058 . . . . 0.0 111.105 -179.247 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.9 p -73.31 -25.85 21.83 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.447 0 O-C-N 121.43 -0.794 . . . . 0.0 111.679 -179.235 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 61.0 m170 -49.06 -52.5 25.18 Favored 'General case' 0 N--CA 1.516 2.853 0 O-C-N 120.816 -1.177 . . . . 0.0 110.412 -179.724 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 28.2 p -135.39 -165.02 1.62 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.227 -0.921 . . . . 0.0 110.404 179.72 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.34 61.78 0.65 Allowed Glycine 0 N--CA 1.492 2.376 0 N-CA-C 107.867 -2.093 . . . . 0.0 107.867 178.309 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.8 t -103.26 137.38 41.48 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.368 -1.077 . . . . 0.0 109.847 -179.007 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 19.1 mtp85 -96.03 52.8 1.32 Allowed 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.206 -0.934 . . . . 0.0 109.612 179.305 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.52 97.59 0.05 OUTLIER Glycine 0 N--CA 1.488 2.164 0 N-CA-C 109.947 -1.261 . . . . 0.0 109.947 179.924 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.6 p -107.9 126.0 52.15 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.246 -1.149 . . . . 0.0 110.049 179.463 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 154' ' ' ALA . . . . . 0.404 ' CB ' ' HB3' ' A' ' 125' ' ' PRO . . . -139.45 137.52 35.66 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.047 -1.033 . . . . 0.0 109.924 -179.374 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.497 1.916 0 O-C-N 121.124 -0.985 . . . . 0.0 110.485 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.328 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 137.9 -49.24 0.85 Allowed Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 53.1 p -120.09 151.86 53.55 Favored Pre-proline 0 N--CA 1.494 1.746 0 O-C-N 121.152 -1.205 . . . . 0.0 110.208 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.73 168.36 24.73 Favored 'Trans proline' 0 C--N 1.316 -1.132 0 O-C-N 123.384 1.202 . . . . 0.0 110.401 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.81 83.38 1.85 Allowed 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.181 -0.949 . . . . 0.0 110.247 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.515 HG23 ' O ' ' A' ' 4' ' ' ILE . 5.9 tp -152.9 121.88 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.239 -0.913 . . . . 0.0 110.598 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.2 mttm -145.99 91.62 2.1 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.172 -0.955 . . . . 0.0 110.391 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.0 p -129.13 162.8 26.92 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.221 -0.925 . . . . 0.0 110.236 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.4 mtp85 -119.77 121.98 40.36 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.195 -0.94 . . . . 0.0 110.228 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -133.99 152.94 52.05 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.241 -0.912 . . . . 0.0 110.3 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.4 ' OG ' ' N ' ' A' ' 10' ' ' LYS . 54.6 p -116.88 -56.6 2.25 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.19 -0.943 . . . . 0.0 110.318 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.4 ' N ' ' OG ' ' A' ' 9' ' ' SER . 66.7 mttt -116.05 151.0 46.09 Favored Pre-proline 0 N--CA 1.495 1.787 0 O-C-N 121.257 -0.902 . . . . 0.0 110.339 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.34 158.72 48.04 Favored 'Trans proline' 0 C--N 1.317 -1.103 0 O-C-N 123.407 1.214 . . . . 0.0 110.678 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.687 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -100.68 147.52 33.74 Favored Pre-proline 0 N--CA 1.501 2.095 0 O-C-N 121.411 -0.806 . . . . 0.0 109.814 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -70.58 161.73 45.01 Favored 'Trans proline' 0 C--N 1.317 -1.108 0 O-C-N 123.382 1.201 . . . . 0.0 110.81 -179.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -48.95 -31.69 7.82 Favored 'General case' 0 N--CA 1.514 2.758 0 O-C-N 121.42 -0.8 . . . . 0.0 111.384 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.71 -33.81 35.2 Favored Glycine 0 N--CA 1.499 2.855 0 O-C-N 120.925 -1.109 . . . . 0.0 110.671 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.411 ' HB2' HD11 ' A' ' 77' ' ' LEU . 25.1 t80 -55.42 -33.51 63.6 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 120.929 -1.336 . . . . 0.0 110.623 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -54.13 -36.8 63.67 Favored 'General case' 0 N--CA 1.512 2.654 0 O-C-N 121.01 -1.056 . . . . 0.0 110.331 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.4 mtpp -58.13 -36.22 72.63 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.248 -0.908 . . . . 0.0 110.261 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.848 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.9 pt -116.33 35.8 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 O-C-N 121.192 -0.942 . . . . 0.0 110.602 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.425 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 3.9 tmtt? -83.59 -43.16 0.81 Allowed Pre-proline 0 N--CA 1.508 2.451 0 O-C-N 121.04 -1.038 . . . . 0.0 113.12 -179.282 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.425 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.6 Cg_endo -76.24 -35.69 2.2 Favored 'Trans proline' 0 N--CA 1.486 1.061 0 O-C-N 122.582 0.78 . . . . 0.0 111.725 -178.4 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.912 HG21 ' CE2' ' A' ' 62' ' ' TYR . 85.3 m -59.6 -43.8 93.59 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 120.921 -1.112 . . . . 0.0 109.973 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.848 HD12 ' O ' ' A' ' 19' ' ' ILE . 7.2 mt -64.78 -39.88 94.33 Favored 'General case' 0 N--CA 1.506 2.349 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.472 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.8 m -58.23 -35.22 71.37 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.119 -0.988 . . . . 0.0 110.168 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -56.57 -35.88 68.69 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.037 -1.039 . . . . 0.0 110.383 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.61 ' CD1' HD22 ' A' ' 55' ' ' LEU . 11.7 m-85 -57.16 -38.27 73.32 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.085 -1.009 . . . . 0.0 110.578 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 55.2 mm-40 -58.64 -39.61 81.06 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.23 -0.919 . . . . 0.0 110.49 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.422 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.2 mp -65.75 -41.26 89.94 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.385 0 C-N-CA 119.187 -1.005 . . . . 0.0 108.77 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -69.18 -50.33 48.57 Favored 'General case' 0 N--CA 1.506 2.336 0 C-N-CA 119.244 -0.982 . . . . 0.0 108.534 178.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.023 HD11 HG23 ' A' ' 52' ' ' ILE . 3.1 tp -59.73 -35.29 74.25 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.254 -0.904 . . . . 0.0 109.453 178.5 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.63 -37.32 73.12 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.035 -1.041 . . . . 0.0 110.352 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -62.92 -51.61 66.28 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.201 -1.0 . . . . 0.0 109.588 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.437 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -69.76 -41.2 75.49 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 119.029 -1.069 . . . . 0.0 108.726 178.806 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -62.5 -34.85 77.69 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.242 -0.911 . . . . 0.0 109.868 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.8 mmtm -70.44 -38.68 74.56 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 120.984 -1.072 . . . . 0.0 110.183 179.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.04 -38.96 77.23 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.16 -0.962 . . . . 0.0 110.107 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.28 -36.31 68.46 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.122 -0.986 . . . . 0.0 110.643 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 54.7 p -95.18 -38.27 10.66 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.063 -1.023 . . . . 0.0 110.495 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 82.7 p -113.13 143.02 45.07 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.106 -0.996 . . . . 0.0 110.227 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.2 mtpt 52.89 95.17 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.045 -1.035 . . . . 0.0 110.795 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -142.45 64.42 1.38 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.165 -0.959 . . . . 0.0 110.312 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -114.95 -56.0 2.42 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.141 -0.974 . . . . 0.0 110.224 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -115.55 159.54 21.13 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.193 -0.942 . . . . 0.0 110.175 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 29.6 mttt 52.87 74.79 0.27 Allowed 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.036 -1.04 . . . . 0.0 110.703 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -113.05 -54.48 2.62 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.171 -0.956 . . . . 0.0 110.423 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.431 ' HB3' ' CZ2' ' A' ' 50' ' ' TRP . 5.3 m-20 -56.65 -39.66 74.08 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.194 -0.941 . . . . 0.0 109.989 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -60.1 -38.08 81.88 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.26 -0.9 . . . . 0.0 109.922 179.444 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.42 ' HG2' ' CB ' ' A' ' 33' ' ' ALA . 0.3 OUTLIER -60.02 -45.87 91.36 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.086 -1.008 . . . . 0.0 109.656 179.727 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.44 HD23 ' HA ' ' A' ' 49' ' ' LEU . 30.3 mt -65.39 -36.72 84.84 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.391 -0.924 . . . . 0.0 110.146 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.503 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.0 m0 -59.1 -38.57 79.85 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.058 -1.026 . . . . 0.0 109.635 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -63.01 -31.95 73.2 Favored 'General case' 0 N--CA 1.503 2.221 0 C-N-CA 119.097 -1.041 . . . . 0.0 109.464 178.174 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 1.023 HG23 HD11 ' A' ' 30' ' ' LEU . 11.3 mt -71.61 -58.55 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.184 0 O-C-N 121.0 -1.062 . . . . 0.0 109.111 179.205 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.7 ptm -59.87 -28.33 67.44 Favored 'General case' 0 N--CA 1.509 2.484 0 C-N-CA 118.601 -1.239 . . . . 0.0 109.988 178.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -69.24 -37.93 78.21 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.826 -1.171 . . . . 0.0 109.153 178.122 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.61 HD22 ' CD1' ' A' ' 26' ' ' PHE . 11.0 mt -53.66 -33.28 54.71 Favored 'General case' 0 N--CA 1.512 2.654 0 O-C-N 120.956 -1.09 . . . . 0.0 110.098 179.059 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.44 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 13.7 t60 -54.87 -36.27 64.93 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.082 -1.011 . . . . 0.0 110.137 179.576 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.435 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 8.0 m170 -59.64 -49.33 78.17 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.029 -1.045 . . . . 0.0 109.381 179.303 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -58.48 -34.46 70.91 Favored 'General case' 0 N--CA 1.507 2.421 0 C-N-CA 119.526 -0.87 . . . . 0.0 109.729 179.078 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.435 ' HG2' ' CE1' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -64.18 -50.58 67.58 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.068 -1.02 . . . . 0.0 109.545 179.363 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 87.9 p -63.49 -39.67 95.06 Favored 'General case' 0 N--CA 1.504 2.237 0 C-N-CA 119.25 -0.98 . . . . 0.0 109.296 179.399 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 18.9 ttt85 -63.99 -39.24 93.67 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 119.255 -0.978 . . . . 0.0 109.264 178.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.912 ' CE2' HG21 ' A' ' 22' ' ' THR . 40.4 t80 -63.49 -52.28 61.96 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.175 -0.953 . . . . 0.0 109.416 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.96 HD12 ' HB2' ' A' ' 87' ' ' ALA . 77.5 mt -70.2 -36.71 68.88 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 C-N-CA 119.163 -1.015 . . . . 0.0 109.34 179.44 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.41 ' HD2' HD13 ' A' ' 92' ' ' ILE . 13.0 t80 -66.83 -43.08 84.66 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.057 -1.027 . . . . 0.0 108.907 179.001 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.406 ' HA ' ' CD ' ' A' ' 69' ' ' LYS . 90.0 m -61.35 -40.46 94.36 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.132 -0.98 . . . . 0.0 110.475 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.576 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.05 -33.32 26.47 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 120.921 -1.112 . . . . 0.0 112.353 -178.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.502 ' N ' HD12 ' A' ' 66' ' ' LEU . 46.9 t80 -86.35 -32.16 21.13 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 120.64 -1.288 . . . . 0.0 111.807 -179.413 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -98.26 -19.32 17.9 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.817 -1.177 . . . . 0.0 112.645 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.406 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 9.1 mtpt -120.35 -59.28 1.79 Allowed 'General case' 0 N--CA 1.502 2.135 0 O-C-N 120.488 -1.382 . . . . 0.0 110.704 179.666 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.406 ' HB3' ' HA ' ' A' ' 66' ' ' LEU . 3.0 ttt85 -62.67 -30.83 71.68 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.164 -0.96 . . . . 0.0 110.837 -179.674 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 56.86 42.16 26.89 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 120.77 -1.207 . . . . 0.0 109.994 -179.516 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.66 35.4 3.87 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.38 -0.825 . . . . 0.0 109.991 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.676 HG13 HD23 ' A' ' 77' ' ' LEU . 14.3 tt -153.73 162.6 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.199 -0.938 . . . . 0.0 109.909 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -108.73 146.76 33.02 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.102 -0.999 . . . . 0.0 110.298 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -46.04 -32.11 2.66 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.341 -0.849 . . . . 0.0 111.586 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 38.4 m-20 -61.65 -49.95 74.47 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 120.895 -1.128 . . . . 0.0 109.352 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.676 HD23 HG13 ' A' ' 73' ' ' ILE . 28.9 tp -67.9 -44.28 77.31 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.16 -1.016 . . . . 0.0 108.408 178.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.55 ' HA ' HD12 ' A' ' 81' ' ' LEU . 18.3 t80 -60.03 -37.88 81.05 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.326 -0.859 . . . . 0.0 109.393 179.037 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -74.14 -42.66 59.61 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.154 -0.966 . . . . 0.0 108.695 178.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.687 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 77.7 t90 -57.43 -36.37 71.27 Favored 'General case' 0 N--CA 1.51 2.557 0 O-C-N 121.278 -0.889 . . . . 0.0 109.716 178.848 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.55 HD12 ' HA ' ' A' ' 78' ' ' TYR . 12.1 mt -69.92 -48.7 57.51 Favored 'General case' 0 N--CA 1.505 2.308 0 O-C-N 121.163 -0.961 . . . . 0.0 108.858 179.079 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.403 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 33.8 mm -56.9 -32.27 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.629 0 O-C-N 121.259 -0.901 . . . . 0.0 110.11 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.8 tmtt? -89.23 -17.9 28.13 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 120.958 -1.089 . . . . 0.0 112.074 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.443 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 21.3 mm-40 -103.68 21.71 15.69 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 120.645 -1.284 . . . . 0.0 112.087 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.7 tttp 74.6 75.07 0.11 Allowed 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.108 -0.995 . . . . 0.0 111.729 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.509 ' HB3' HD11 ' A' ' 63' ' ' ILE . 33.6 m-85 -135.94 -63.42 0.65 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.458 -0.776 . . . . 0.0 109.334 179.574 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.96 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -123.05 -171.23 2.25 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.401 -0.812 . . . . 0.0 109.276 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.462 ' OD1' HD11 ' A' ' 106' ' ' LEU . 5.5 t0 -131.09 120.25 23.13 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.086 -1.009 . . . . 0.0 110.522 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 10.8 mmtp -77.34 -39.84 46.23 Favored 'General case' 0 N--CA 1.505 2.306 0 C-N-CA 119.528 -0.869 . . . . 0.0 109.649 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 33.0 tp -60.64 -39.96 90.23 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.196 -0.94 . . . . 0.0 109.74 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.792 ' HA ' HD21 ' A' ' 106' ' ' LEU . 60.5 tp -69.85 -49.92 47.73 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.101 -0.999 . . . . 0.0 108.788 179.289 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.411 HG22 ' HD2' ' A' ' 96' ' ' ARG . 58.1 mt -58.87 -32.35 47.0 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.392 0 C-N-CA 119.361 -0.936 . . . . 0.0 108.993 178.25 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.04 -44.03 70.06 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 120.962 -1.087 . . . . 0.0 109.358 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.49 ' HD3' HD23 ' A' ' 106' ' ' LEU . 5.1 mttp -58.21 -39.14 78.24 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.099 -1.001 . . . . 0.0 110.106 179.151 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.0 m0 -69.09 -39.77 78.81 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.109 -0.995 . . . . 0.0 109.767 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.411 ' HD2' HG22 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -67.84 -33.95 75.75 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.245 -0.91 . . . . 0.0 110.349 179.494 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 10.3 mmtm -54.17 -177.18 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.679 0 O-C-N 121.081 -1.012 . . . . 0.0 110.526 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.96 131.75 53.69 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.217 -0.927 . . . . 0.0 109.614 179.246 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 101.44 1.91 53.58 Favored Glycine 0 N--CA 1.492 2.398 0 C-N-CA 120.066 -1.064 . . . . 0.0 111.192 -179.383 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 41.2 m-85 -105.64 64.03 0.69 Allowed 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 119.595 1.698 . . . . 0.0 109.903 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -88.82 -36.57 15.97 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.102 -0.998 . . . . 0.0 110.121 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -108.23 71.24 0.79 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.153 -0.967 . . . . 0.0 109.786 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.855 HD13 HD13 ' A' ' 109' ' ' ILE . 7.2 tp -117.84 133.08 56.28 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.223 -0.923 . . . . 0.0 109.627 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.435 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.3 p -109.72 -37.44 5.66 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.242 -0.911 . . . . 0.0 112.361 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.757 ' O ' HD11 ' A' ' 103' ' ' LEU . 6.6 m -141.04 -169.06 2.75 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.217 -1.552 . . . . 0.0 110.1 178.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.792 HD21 ' HA ' ' A' ' 91' ' ' LEU . 27.9 mt -97.34 -38.07 9.79 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.186 -0.946 . . . . 0.0 110.282 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 8.7 ttt-85 -101.15 30.06 4.34 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 120.966 -1.084 . . . . 0.0 109.734 177.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.667 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.3 1.7 t -126.56 15.07 7.63 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.07 -1.019 . . . . 0.0 108.995 -179.375 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.855 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -159.07 37.26 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.404 0 O-C-N 120.788 -1.195 . . . . 0.0 110.759 -179.015 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.619 ' C ' HG23 ' A' ' 119' ' ' THR . 10.6 mm100 -125.44 137.28 53.98 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 120.643 -1.286 . . . . 0.0 111.767 -178.42 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.532 ' HA ' ' HG1' ' A' ' 119' ' ' THR . 17.6 ptpt -131.54 155.87 46.72 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.284 -0.885 . . . . 0.0 110.124 179.319 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 63.8 m-20 -127.88 166.34 18.46 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.182 -0.949 . . . . 0.0 110.234 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 72.5 mt-10 -138.77 39.89 2.18 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.213 -0.93 . . . . 0.0 110.272 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 1.3 m -118.93 -57.07 2.06 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.198 -0.938 . . . . 0.0 110.297 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 12.7 m-20 -121.19 -58.04 1.82 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.147 -0.97 . . . . 0.0 110.255 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 47.5 p30 -132.27 179.12 6.31 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.211 -0.93 . . . . 0.0 110.268 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -120.43 119.82 4.32 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 2.8 m -116.81 76.56 1.04 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.249 -1.147 . . . . 0.0 110.07 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.619 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.1 m -126.23 173.62 9.14 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.208 -0.932 . . . . 0.0 110.321 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.425 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 47.9 t -105.37 155.37 19.18 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.395 -0.816 . . . . 0.0 109.385 179.123 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.812 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -71.41 -35.94 59.05 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.344 0 O-C-N 121.113 -0.992 . . . . 0.0 110.801 -179.471 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.436 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.3 p -55.59 -34.27 64.67 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 120.8 -1.187 . . . . 0.0 110.929 -179.026 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -35.83 78.17 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 120.957 -1.09 . . . . 0.0 109.607 178.39 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.2 t -77.63 124.98 86.54 Favored Pre-proline 0 N--CA 1.505 2.291 0 O-C-N 121.167 -0.958 . . . . 0.0 109.952 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.618 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.0 Cg_endo -64.94 178.92 1.61 Allowed 'Trans proline' 0 N--CA 1.489 1.237 0 O-C-N 123.176 1.093 . . . . 0.0 110.718 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -75.01 -36.96 61.93 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.287 -0.883 . . . . 0.0 110.627 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.61 -41.57 81.52 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 120.985 -1.072 . . . . 0.0 109.886 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -70.1 -41.19 74.35 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.338 -0.945 . . . . 0.0 108.966 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.618 HD12 ' O ' ' A' ' 125' ' ' PRO . 4.2 mt -64.94 -39.3 93.3 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.27 -0.894 . . . . 0.0 109.465 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -60.41 -40.0 89.41 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.134 -0.979 . . . . 0.0 109.806 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -59.29 -37.67 78.28 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.152 -0.968 . . . . 0.0 110.251 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -59.37 -41.69 89.91 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.178 -0.951 . . . . 0.0 110.042 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.647 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -62.75 -48.23 80.09 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.192 -0.943 . . . . 0.0 109.614 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 1.1 ttt-85 -60.82 -37.1 80.85 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.211 -0.931 . . . . 0.0 110.067 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 33.4 mmtm -67.96 -34.12 75.96 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.103 -0.998 . . . . 0.0 110.781 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 18.4 mtmt -102.82 23.28 12.37 Favored 'General case' 0 N--CA 1.502 2.165 0 O-C-N 120.925 -1.109 . . . . 0.0 111.718 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.53 46.5 53.11 Favored Glycine 0 N--CA 1.499 2.866 0 O-C-N 120.715 -1.24 . . . . 0.0 110.851 179.277 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.647 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 9.2 t -147.18 -167.7 2.85 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.132 -1.216 . . . . 0.0 110.433 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -123.81 174.61 7.41 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.239 -0.913 . . . . 0.0 110.317 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.6 p -157.35 159.81 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.253 -0.904 . . . . 0.0 110.855 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 29.6 t -170.24 85.95 0.12 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.243 -0.911 . . . . 0.0 110.924 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.787 ' CG ' HD12 ' A' ' 121' ' ' ILE . 47.1 t80 -97.85 161.5 13.71 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.197 -0.939 . . . . 0.0 110.612 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 13.3 m80 -140.63 -61.08 0.5 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.521 -0.737 . . . . 0.0 109.104 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.7 151.48 51.1 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.413 -0.805 . . . . 0.0 109.037 178.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 29.2 p -95.79 153.26 17.83 Favored 'General case' 0 N--CA 1.503 2.203 0 C-N-CA 119.163 -1.015 . . . . 0.0 111.102 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.4 m -72.08 -25.7 24.07 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 O-C-N 121.44 -0.787 . . . . 0.0 111.563 -179.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 62.6 m170 -50.08 -60.41 2.97 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 120.868 -1.145 . . . . 0.0 110.219 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.503 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 25.0 p -125.83 -165.93 1.49 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.295 -0.878 . . . . 0.0 110.574 179.678 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -98.59 59.09 0.93 Allowed Glycine 0 N--CA 1.492 2.373 0 N-CA-C 108.16 -1.976 . . . . 0.0 108.16 178.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.7 t -103.84 143.97 32.13 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.316 -1.108 . . . . 0.0 109.931 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 14.0 ttt-85 -98.67 49.78 0.98 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.289 -0.882 . . . . 0.0 109.545 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.25 97.57 0.05 OUTLIER Glycine 0 N--CA 1.488 2.105 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.7 p -109.51 123.79 49.99 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.293 -1.122 . . . . 0.0 110.221 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -140.02 121.56 15.18 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.108 -0.995 . . . . 0.0 109.605 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -88.75 -38.41 14.72 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.121 -0.987 . . . . 0.0 110.419 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.53 -40.62 79.21 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 121.046 -1.034 . . . . 0.0 110.317 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 . . . . . 0 N--CA 1.497 1.882 0 CA-C-O 118.005 -0.997 . . . . 0.0 110.497 179.982 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.308 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 119.76 -148.87 17.97 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -123.92 87.23 53.13 Favored Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.139 -1.212 . . . . 0.0 110.205 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.56 -40.2 2.26 Favored 'Trans proline' 0 C--N 1.318 -1.059 0 O-C-N 123.419 1.22 . . . . 0.0 110.487 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 12.7 ttt180 -127.27 -59.83 1.22 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.273 -0.892 . . . . 0.0 110.225 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.2 tp -145.26 148.69 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.334 -0.853 . . . . 0.0 110.267 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.2 ttpt -129.49 130.18 45.5 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.237 -0.915 . . . . 0.0 110.145 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.9 p -127.51 127.81 44.62 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.192 -0.942 . . . . 0.0 110.2 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -137.49 99.43 3.95 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.211 -0.931 . . . . 0.0 110.224 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 18.9 ttm-85 -144.32 -58.82 0.38 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.25 -0.906 . . . . 0.0 110.392 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.3 p -115.31 -165.17 1.0 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.269 -0.894 . . . . 0.0 110.062 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.9 mtmt -114.13 162.14 24.58 Favored Pre-proline 0 N--CA 1.496 1.851 0 O-C-N 121.168 -0.957 . . . . 0.0 110.269 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.97 158.89 49.08 Favored 'Trans proline' 0 C--N 1.316 -1.163 0 O-C-N 123.411 1.216 . . . . 0.0 110.661 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.718 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -90.37 146.87 35.43 Favored Pre-proline 0 N--CA 1.503 2.197 0 O-C-N 121.429 -0.794 . . . . 0.0 109.736 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.407 ' HG2' HD13 ' A' ' 77' ' ' LEU . 45.6 Cg_endo -70.7 162.77 41.37 Favored 'Trans proline' 0 C--N 1.317 -1.109 0 O-C-N 123.405 1.213 . . . . 0.0 110.879 -179.59 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -48.64 -31.88 7.39 Favored 'General case' 0 N--CA 1.514 2.764 0 O-C-N 121.443 -0.785 . . . . 0.0 111.375 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.03 -35.14 40.22 Favored Glycine 0 N--CA 1.5 2.931 0 O-C-N 121.046 -1.034 . . . . 0.0 110.542 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -56.03 -32.93 64.47 Favored 'General case' 0 N--CA 1.511 2.621 0 O-C-N 120.973 -1.31 . . . . 0.0 110.554 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -54.61 -38.5 66.87 Favored 'General case' 0 N--CA 1.511 2.62 0 O-C-N 120.98 -1.075 . . . . 0.0 110.123 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.0 mtmt -58.64 -37.44 75.93 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.315 -0.866 . . . . 0.0 110.087 179.401 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.712 HD12 ' CD1' ' A' ' 23' ' ' LEU . 2.1 pt -114.86 34.79 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.152 -0.967 . . . . 0.0 110.452 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.5 OUTLIER -83.57 -43.79 0.81 Allowed Pre-proline 0 N--CA 1.509 2.48 0 O-C-N 121.052 -1.03 . . . . 0.0 113.12 -179.177 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.2 Cg_endo -76.13 -36.96 1.67 Allowed 'Trans proline' 0 N--CA 1.486 1.079 0 O-C-N 122.712 0.849 . . . . 0.0 111.455 -178.409 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.782 HG21 ' CE2' ' A' ' 62' ' ' TYR . 62.7 m -60.39 -44.24 95.84 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.004 -1.06 . . . . 0.0 109.972 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.712 ' CD1' HD12 ' A' ' 19' ' ' ILE . 3.3 mt -65.25 -40.06 93.51 Favored 'General case' 0 N--CA 1.506 2.327 0 C-N-CA 119.411 -0.916 . . . . 0.0 109.453 179.318 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 47.9 m -57.93 -35.51 71.19 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.25 -0.906 . . . . 0.0 110.1 179.285 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.59 -36.92 69.94 Favored 'General case' 0 N--CA 1.511 2.606 0 O-C-N 121.05 -1.031 . . . . 0.0 110.252 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.73 ' CD2' HD22 ' A' ' 55' ' ' LEU . 14.9 m-85 -58.57 -39.47 80.41 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.094 -1.004 . . . . 0.0 110.457 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -59.89 -38.74 83.09 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.073 -1.017 . . . . 0.0 110.662 -179.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.418 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.2 mp -66.7 -40.27 85.7 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.412 0 C-N-CA 119.196 -1.001 . . . . 0.0 109.241 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.6 tp60 -69.58 -46.5 66.21 Favored 'General case' 0 N--CA 1.506 2.342 0 C-N-CA 119.211 -0.996 . . . . 0.0 108.821 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.739 HD21 HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -64.21 -35.28 80.28 Favored 'General case' 0 N--CA 1.508 2.469 0 C-N-CA 119.283 -0.967 . . . . 0.0 108.923 178.359 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.31 -40.04 77.05 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 120.959 -1.088 . . . . 0.0 110.075 179.338 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -62.58 -50.24 72.08 Favored 'General case' 0 N--CA 1.507 2.392 0 C-N-CA 119.262 -0.975 . . . . 0.0 109.37 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.606 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -65.9 -41.5 91.4 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.38 -0.928 . . . . 0.0 109.088 179.002 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.441 ' CG ' HD23 ' A' ' 30' ' ' LEU . 10.1 mm-40 -63.18 -34.99 78.84 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.22 -0.925 . . . . 0.0 110.03 179.416 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.6 mtpt -84.1 -37.09 22.46 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.998 -1.064 . . . . 0.0 110.318 179.68 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -57.86 -38.62 76.02 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.044 -1.035 . . . . 0.0 110.032 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 13.9 tptt -55.46 -36.85 67.02 Favored 'General case' 0 N--CA 1.512 2.634 0 O-C-N 121.1 -1.0 . . . . 0.0 110.348 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.6 p -103.64 39.96 1.51 Allowed 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.171 -0.955 . . . . 0.0 110.03 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.3 t -143.36 -60.15 0.42 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.259 -0.901 . . . . 0.0 109.926 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -113.93 105.1 12.84 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.285 -0.884 . . . . 0.0 109.686 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.1 tp -113.12 50.87 0.86 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.139 -0.976 . . . . 0.0 110.405 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -115.93 -56.42 2.32 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.184 -0.948 . . . . 0.0 110.135 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -144.37 163.23 34.35 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.182 -0.949 . . . . 0.0 110.408 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm 52.8 53.35 12.27 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.132 -0.98 . . . . 0.0 111.011 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.6 p -110.31 -52.29 2.79 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.052 -1.03 . . . . 0.0 110.491 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -55.31 -37.19 67.04 Favored 'General case' 0 N--CA 1.511 2.6 0 O-C-N 121.153 -0.967 . . . . 0.0 110.172 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -59.05 -39.48 82.17 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.142 -0.974 . . . . 0.0 110.042 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -61.6 -41.23 97.15 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.119 -0.988 . . . . 0.0 109.888 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 49' ' ' LEU . 12.6 mt -59.46 -38.36 80.55 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.273 -0.892 . . . . 0.0 110.319 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.507 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.5 m0 -59.91 -36.79 77.74 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.165 -0.96 . . . . 0.0 110.174 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -60.36 -30.33 69.49 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.065 -1.022 . . . . 0.0 110.126 178.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.739 HG23 HD21 ' A' ' 30' ' ' LEU . 75.0 mt -72.33 -58.68 4.53 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.276 0 O-C-N 120.879 -1.138 . . . . 0.0 109.209 179.253 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 ptm -61.55 -29.55 70.08 Favored 'General case' 0 N--CA 1.508 2.465 0 C-N-CA 118.504 -1.278 . . . . 0.0 109.683 178.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 -68.85 -37.25 79.0 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.79 -1.194 . . . . 0.0 109.063 178.016 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.73 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.1 mt -53.02 -32.19 45.33 Favored 'General case' 0 N--CA 1.512 2.659 0 O-C-N 121.045 -1.035 . . . . 0.0 110.155 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.464 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 66.0 t60 -54.63 -38.06 66.4 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.062 -1.024 . . . . 0.0 110.072 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.45 ' CD2' HD21 ' A' ' 91' ' ' LEU . 5.5 m170 -61.35 -51.19 69.86 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.17 -0.956 . . . . 0.0 109.362 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -59.38 -33.98 71.87 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 119.474 -0.89 . . . . 0.0 109.668 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.461 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -68.18 -50.2 55.91 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.067 -1.021 . . . . 0.0 109.191 179.15 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 77.3 p -63.38 -38.44 91.16 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.093 -1.004 . . . . 0.0 109.154 178.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 10.4 ttm-85 -64.28 -39.86 94.79 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.165 -0.96 . . . . 0.0 109.184 178.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.782 ' CE2' HG21 ' A' ' 22' ' ' THR . 37.8 t80 -62.85 -51.26 67.73 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.113 -0.992 . . . . 0.0 109.292 179.367 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.803 HD12 ' HB2' ' A' ' 87' ' ' ALA . 77.5 mt -69.65 -38.99 77.65 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 O-C-N 121.257 -0.902 . . . . 0.0 109.179 179.312 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.41 ' HD2' HD13 ' A' ' 92' ' ' ILE . 11.8 t80 -65.48 -43.25 90.83 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.195 -0.941 . . . . 0.0 109.05 179.154 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.409 ' HA ' ' CD ' ' A' ' 69' ' ' LYS . 88.2 m -61.04 -41.26 96.25 Favored 'General case' 0 N--CA 1.503 2.186 0 C-N-CA 119.331 -0.948 . . . . 0.0 110.546 -179.501 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.582 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.22 -33.35 26.13 Favored 'General case' 0 N--CA 1.504 2.245 0 C-N-CA 118.926 -1.11 . . . . 0.0 112.52 -178.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.496 ' N ' HD12 ' A' ' 66' ' ' LEU . 52.0 t80 -86.33 -32.7 20.87 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 120.738 -1.226 . . . . 0.0 111.779 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -98.26 -15.74 19.69 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.752 -1.217 . . . . 0.0 112.759 -178.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.409 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 8.2 mtpt -124.88 -59.38 1.43 Allowed 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.394 -1.441 . . . . 0.0 110.778 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.404 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 4.5 ttp85 -62.43 -30.59 71.33 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.153 -0.967 . . . . 0.0 110.829 -179.558 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.4 tttp 57.68 42.49 23.72 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 120.816 -1.178 . . . . 0.0 110.073 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.82 36.3 3.71 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.404 -0.81 . . . . 0.0 109.82 179.336 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.761 HG13 HD23 ' A' ' 77' ' ' LEU . 14.2 tt -154.53 162.7 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.126 -0.984 . . . . 0.0 110.011 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 73.3 m -109.8 146.81 34.38 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.174 -0.954 . . . . 0.0 110.065 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -45.25 -32.45 1.94 Allowed 'General case' 0 N--CA 1.515 2.819 0 O-C-N 121.323 -0.861 . . . . 0.0 111.7 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -61.88 -50.63 71.45 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.956 -1.09 . . . . 0.0 109.374 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.761 HD23 HG13 ' A' ' 73' ' ' ILE . 30.6 tp -66.98 -43.75 82.21 Favored 'General case' 0 N--CA 1.505 2.296 0 C-N-CA 119.155 -1.018 . . . . 0.0 108.584 178.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.473 ' HA ' HD12 ' A' ' 81' ' ' LEU . 15.7 t80 -60.78 -38.38 85.07 Favored 'General case' 0 N--CA 1.506 2.344 0 C-N-CA 119.645 -0.822 . . . . 0.0 109.317 178.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.493 ' O ' HG22 ' A' ' 82' ' ' ILE . 20.1 t0 -74.63 -41.19 60.82 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.136 -0.977 . . . . 0.0 108.892 178.695 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.718 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 86.6 t90 -59.13 -39.14 81.41 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.184 -0.947 . . . . 0.0 109.259 178.861 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.473 HD12 ' HA ' ' A' ' 78' ' ' TYR . 14.8 mt -65.61 -54.75 23.4 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.211 -0.93 . . . . 0.0 109.223 179.072 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.578 HD12 ' HB3' ' A' ' 87' ' ' ALA . 0.7 OUTLIER -55.9 -27.63 22.94 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.423 0 O-C-N 121.123 -0.986 . . . . 0.0 110.701 -179.745 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.2 tttm -88.2 -19.46 26.86 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 120.899 -1.126 . . . . 0.0 111.628 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.446 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 77.0 mm-40 -102.77 23.74 11.65 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 120.623 -1.298 . . . . 0.0 111.843 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.41 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 15.6 tttt 76.34 69.57 0.07 Allowed 'General case' 0 N--CA 1.513 2.696 0 O-C-N 121.175 -0.953 . . . . 0.0 111.916 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.57 ' HE2' HD13 ' A' ' 23' ' ' LEU . 28.3 m-85 -132.04 -63.1 0.82 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.467 -0.771 . . . . 0.0 109.134 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.803 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -131.2 167.43 19.17 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.477 -0.764 . . . . 0.0 109.464 179.359 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.464 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 24.2 t70 -120.35 121.1 37.86 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.091 -1.006 . . . . 0.0 110.599 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 29.5 mtpt -67.75 -35.39 78.64 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 121.304 -0.873 . . . . 0.0 110.227 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.726 HD23 HD13 ' A' ' 106' ' ' LEU . 25.7 tp -58.56 -40.87 84.3 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.017 -1.052 . . . . 0.0 109.965 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.462 ' HA ' HD21 ' A' ' 106' ' ' LEU . 58.5 tp -70.58 -50.62 35.41 Favored 'General case' 0 N--CA 1.506 2.343 0 C-N-CA 119.185 -1.006 . . . . 0.0 108.652 179.145 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.41 HD13 ' HD2' ' A' ' 64' ' ' TYR . 63.2 mt -58.45 -34.83 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.457 0 C-N-CA 119.209 -0.996 . . . . 0.0 108.823 178.201 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.95 -39.51 87.29 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.049 -1.032 . . . . 0.0 109.135 178.371 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.424 ' HD2' ' CE1' ' A' ' 100' ' ' TYR . 4.9 mmtt -57.27 -44.66 84.17 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.098 -1.001 . . . . 0.0 109.174 179.176 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.3 m0 -63.41 -35.41 80.33 Favored 'General case' 0 N--CA 1.509 2.477 0 C-N-CA 119.562 -0.855 . . . . 0.0 110.1 179.399 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.01 -32.53 45.15 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.087 -1.008 . . . . 0.0 110.723 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.5 mmtt -53.69 -176.91 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.714 0 O-C-N 120.989 -1.069 . . . . 0.0 110.715 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.2 m -102.91 135.07 45.27 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.099 -1.001 . . . . 0.0 109.711 179.227 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.03 11.71 54.07 Favored Glycine 0 N--CA 1.494 2.524 0 C-N-CA 120.183 -1.008 . . . . 0.0 111.056 -179.391 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.585 ' HB3' HD23 ' A' ' 103' ' ' LEU . 50.4 m-85 -119.97 71.94 0.91 Allowed 'General case' 0 N--CA 1.492 1.641 0 CA-C-N 119.41 1.605 . . . . 0.0 109.823 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -97.37 -34.24 11.12 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.192 -0.942 . . . . 0.0 111.18 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.1 63.4 1.15 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.974 -1.079 . . . . 0.0 111.044 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.585 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.1 pp -111.57 152.98 26.95 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.0 -1.062 . . . . 0.0 109.67 179.182 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.429 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.8 p -113.17 -30.28 7.01 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.156 -0.965 . . . . 0.0 113.463 -179.138 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.634 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.9 m -143.47 -169.03 2.97 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 120.161 -1.587 . . . . 0.0 110.175 179.372 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.726 HD13 HD23 ' A' ' 90' ' ' LEU . 16.4 mt -95.39 -38.74 10.35 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.173 -0.954 . . . . 0.0 109.95 178.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 5.6 ttt85 -102.02 29.81 4.83 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.928 -1.108 . . . . 0.0 110.092 178.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.634 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.301 1.8 t -127.65 17.57 6.89 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.035 -1.041 . . . . 0.0 108.847 -179.564 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.461 HG23 ' C ' ' A' ' 108' ' ' CYS . 1.3 pt -158.36 38.66 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.277 0 O-C-N 120.982 -1.074 . . . . 0.0 110.216 -178.814 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.765 ' C ' HG23 ' A' ' 119' ' ' THR . 25.6 mt-30 -98.67 103.53 15.49 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.91 -1.119 . . . . 0.0 111.02 -178.741 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.428 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 7.6 ttmt -106.31 -50.04 3.23 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.263 -0.898 . . . . 0.0 110.568 179.633 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -111.62 -170.6 1.68 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.085 -1.01 . . . . 0.0 110.243 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 53.46 51.07 16.01 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.018 -1.051 . . . . 0.0 110.748 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -142.49 169.45 17.56 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.159 -0.963 . . . . 0.0 110.19 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -116.92 -61.69 1.68 Allowed 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.277 -0.889 . . . . 0.0 110.204 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -133.53 49.94 2.25 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.217 -0.927 . . . . 0.0 110.108 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -126.98 -161.39 10.86 Favored Glycine 0 N--CA 1.493 2.469 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.3 m -146.34 -175.72 4.89 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.24 -1.153 . . . . 0.0 110.427 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.765 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.4 m -116.11 171.19 7.96 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.192 -0.943 . . . . 0.0 110.136 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 48.7 t -94.37 154.21 17.59 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 119.401 -0.92 . . . . 0.0 108.804 178.391 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.953 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -74.66 -30.6 25.22 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.381 0 O-C-N 121.021 -1.05 . . . . 0.0 111.654 -178.706 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.493 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.7 p -59.46 -35.75 74.67 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 120.594 -1.316 . . . . 0.0 110.639 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.82 -31.1 64.38 Favored 'General case' 0 N--CA 1.512 2.655 0 O-C-N 120.95 -1.093 . . . . 0.0 109.998 178.679 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 60.7 t -82.61 124.54 77.45 Favored Pre-proline 0 N--CA 1.504 2.256 0 O-C-N 121.061 -1.024 . . . . 0.0 109.974 179.719 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -66.21 176.03 4.31 Favored 'Trans proline' 0 N--CA 1.489 1.242 0 O-C-N 123.172 1.09 . . . . 0.0 110.871 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.0 mmm-85 -75.15 -38.37 60.98 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.292 -0.88 . . . . 0.0 110.162 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.47 -40.01 77.63 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 121.042 -1.036 . . . . 0.0 109.994 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -68.38 -42.59 78.87 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.228 -0.92 . . . . 0.0 109.192 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.889 HD11 HD11 ' A' ' 121' ' ' ILE . 11.7 mt -65.1 -39.36 93.03 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.413 -0.915 . . . . 0.0 109.362 179.145 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -59.04 -37.96 78.19 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.116 -0.99 . . . . 0.0 110.061 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -58.34 -39.03 78.38 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 121.123 -0.986 . . . . 0.0 110.195 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -62.41 -46.93 86.35 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.268 -0.895 . . . . 0.0 109.724 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.532 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -59.21 -38.39 79.8 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.167 -0.958 . . . . 0.0 110.2 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 25.6 ttt85 -67.59 -38.97 84.79 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.19 -0.944 . . . . 0.0 110.107 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 16.9 mttp -72.01 -34.67 69.04 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.067 -1.02 . . . . 0.0 110.511 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -88.61 -19.67 25.96 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.044 -1.035 . . . . 0.0 111.626 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.38 33.36 9.45 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.532 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.6 t -133.07 -160.67 1.07 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.066 -1.256 . . . . 0.0 109.737 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -134.19 144.45 48.47 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.076 -1.015 . . . . 0.0 110.098 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.495 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.7 p -131.45 160.58 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.169 -0.957 . . . . 0.0 110.349 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 39.2 t -169.26 95.16 0.32 Allowed 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.219 -0.925 . . . . 0.0 110.928 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.953 ' CD1' HD12 ' A' ' 121' ' ' ILE . 72.9 t80 -99.25 159.88 14.68 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.273 -0.892 . . . . 0.0 110.767 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 10.1 m170 -138.43 -61.12 0.6 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -138.57 150.82 46.72 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.429 -0.794 . . . . 0.0 109.227 178.934 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 145' ' ' CYS . . . . . 0.429 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 30.6 p -93.6 154.12 18.02 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.015 -1.053 . . . . 0.0 110.941 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 19.7 m -73.55 -23.14 19.27 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.46 0 O-C-N 121.363 -0.835 . . . . 0.0 111.669 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 60.4 m170 -51.39 -62.06 1.85 Allowed 'General case' 0 N--CA 1.515 2.793 0 O-C-N 120.742 -1.224 . . . . 0.0 110.066 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.507 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 21.6 p -124.17 -163.8 1.19 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.265 -0.897 . . . . 0.0 110.385 179.543 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 149' ' ' GLY . . . . . 0.412 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.33 63.86 0.61 Allowed Glycine 0 N--CA 1.491 2.333 0 N-CA-C 107.997 -2.041 . . . . 0.0 107.997 178.333 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 34.4 t -101.09 142.41 32.59 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.289 -1.124 . . . . 0.0 109.687 -179.231 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -101.09 43.44 1.06 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.233 -0.917 . . . . 0.0 109.78 179.388 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 80.62 94.81 0.41 Allowed Glycine 0 N--CA 1.486 2.009 0 N-CA-C 109.87 -1.292 . . . . 0.0 109.87 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.8 p -107.85 123.95 49.36 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.272 -1.134 . . . . 0.0 110.205 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -143.1 141.66 31.3 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.081 -1.012 . . . . 0.0 110.089 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 1.4 m -104.51 42.39 1.21 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.167 -0.958 . . . . 0.0 109.617 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 28.0 m -159.64 -55.64 0.06 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.336 -0.853 . . . . 0.0 110.744 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 118.05 -0.976 . . . . 0.0 110.247 179.934 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.375 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 133.53 -129.11 5.25 Favored Glycine 0 N--CA 1.493 2.482 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.6 m -132.57 164.04 46.36 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.295 -1.12 . . . . 0.0 110.152 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.65 164.88 34.31 Favored 'Trans proline' 0 C--N 1.317 -1.091 0 O-C-N 123.441 1.232 . . . . 0.0 110.339 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 10.9 ttt-85 -140.97 174.23 10.72 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.198 -0.939 . . . . 0.0 110.302 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 86.4 mt -116.1 89.89 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.192 -0.942 . . . . 0.0 109.988 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -134.35 -164.2 1.47 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.157 -0.964 . . . . 0.0 110.072 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -112.4 89.33 3.04 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.184 -0.948 . . . . 0.0 110.156 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.72 94.85 2.77 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.199 -0.938 . . . . 0.0 110.073 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 4.2 tpt85 -133.36 145.5 50.42 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.152 -0.967 . . . . 0.0 110.332 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 71.3 m -125.16 154.18 41.91 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.249 -0.907 . . . . 0.0 110.028 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.5 mttt -145.25 155.46 54.33 Favored Pre-proline 0 N--CA 1.494 1.772 0 O-C-N 121.154 -0.966 . . . . 0.0 110.494 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -72.76 160.79 45.45 Favored 'Trans proline' 0 C--N 1.318 -1.078 0 O-C-N 123.499 1.263 . . . . 0.0 110.617 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.698 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -78.71 146.28 68.64 Favored Pre-proline 0 N--CA 1.506 2.365 0 O-C-N 121.365 -0.834 . . . . 0.0 109.789 179.835 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.26 162.12 42.51 Favored 'Trans proline' 0 C--N 1.317 -1.092 0 O-C-N 123.311 1.164 . . . . 0.0 110.794 -179.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -48.99 -31.77 8.02 Favored 'General case' 0 N--CA 1.514 2.758 0 O-C-N 121.474 -0.767 . . . . 0.0 111.339 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.53 -34.45 42.69 Favored Glycine 0 N--CA 1.5 2.909 0 O-C-N 120.987 -1.071 . . . . 0.0 110.431 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -54.65 -32.35 59.0 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 120.968 -1.313 . . . . 0.0 110.649 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -55.21 -38.95 69.09 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.012 -1.055 . . . . 0.0 110.194 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 29.5 mttt -58.2 -37.28 74.49 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.236 -0.915 . . . . 0.0 110.078 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.714 HG22 ' OH ' ' A' ' 62' ' ' TYR . 1.6 pt -114.62 34.61 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.2 -0.938 . . . . 0.0 110.323 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -84.73 -43.04 0.7 Allowed Pre-proline 0 N--CA 1.51 2.534 0 O-C-N 120.974 -1.079 . . . . 0.0 113.331 -179.024 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.1 Cg_endo -75.6 -36.66 2.1 Favored 'Trans proline' 0 N--CA 1.487 1.092 0 O-C-N 122.566 0.772 . . . . 0.0 111.583 -178.207 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.577 HG21 ' CE2' ' A' ' 62' ' ' TYR . 75.2 m -60.4 -43.5 96.63 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.046 -1.034 . . . . 0.0 109.936 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.666 HD12 ' O ' ' A' ' 19' ' ' ILE . 3.3 mt -64.05 -39.38 93.96 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.233 -0.917 . . . . 0.0 109.571 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.95 -37.0 75.74 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.062 -1.024 . . . . 0.0 110.15 179.595 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -57.38 -36.41 71.22 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.167 -0.958 . . . . 0.0 110.29 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.726 ' CD2' HD22 ' A' ' 55' ' ' LEU . 16.9 m-85 -57.43 -38.54 74.55 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.085 -1.009 . . . . 0.0 110.47 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -62.96 -22.48 66.84 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.168 -0.958 . . . . 0.0 111.854 -179.498 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.568 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.8 mp -81.26 -33.94 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.738 -1.226 . . . . 0.0 109.954 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -81.66 -34.59 30.68 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 120.949 -1.094 . . . . 0.0 109.438 178.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.755 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -75.83 -32.08 59.64 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.1 -1.0 . . . . 0.0 109.942 178.8 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.2 ptt85 -68.55 -34.84 76.54 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 120.874 -1.141 . . . . 0.0 109.998 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -68.15 -41.1 82.08 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.01 -1.056 . . . . 0.0 109.54 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.479 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -67.21 -43.35 82.29 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.269 -0.895 . . . . 0.0 109.325 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.6 mm100 -61.99 -38.79 89.92 Favored 'General case' 0 N--CA 1.506 2.373 0 C-N-CA 119.454 -0.898 . . . . 0.0 109.815 179.54 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 37.2 mmtm -62.41 -36.7 83.18 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.101 -1.0 . . . . 0.0 110.422 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -58.3 -41.25 84.03 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.059 -1.026 . . . . 0.0 110.04 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.2 mmtp -58.08 -34.02 69.71 Favored 'General case' 0 N--CA 1.511 2.582 0 O-C-N 121.235 -0.916 . . . . 0.0 110.763 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 36.6 m -96.96 -30.74 12.92 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.022 -1.049 . . . . 0.0 111.472 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.97 -46.9 6.02 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 120.92 -1.112 . . . . 0.0 110.497 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 15.8 mtpt -114.21 90.17 3.27 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.097 -1.002 . . . . 0.0 110.346 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.2 tp -116.51 58.43 0.76 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.13 -0.981 . . . . 0.0 110.182 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -135.13 -62.82 0.71 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.137 -0.977 . . . . 0.0 110.149 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -116.78 149.85 39.27 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.162 -0.961 . . . . 0.0 110.101 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.4 mtmm 52.83 55.25 9.26 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 120.956 -1.09 . . . . 0.0 110.69 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 18.7 m -105.86 -52.07 2.88 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.205 -0.935 . . . . 0.0 110.147 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -57.74 -39.62 77.75 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.2 -0.937 . . . . 0.0 109.813 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -60.05 -38.55 83.11 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.15 -0.969 . . . . 0.0 109.917 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 34.2 tp60 -59.09 -42.54 90.7 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 121.068 -1.02 . . . . 0.0 109.895 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.46 HD13 ' HA ' ' A' ' 49' ' ' LEU . 4.2 mm? -58.96 -37.93 77.9 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.224 -0.923 . . . . 0.0 109.993 179.466 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.495 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 37.5 m0 -59.95 -36.16 76.48 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.198 -0.939 . . . . 0.0 109.435 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -64.74 -33.11 75.19 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 120.696 -1.252 . . . . 0.0 109.502 178.353 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.755 HG23 ' CG ' ' A' ' 30' ' ' LEU . 73.4 mt -71.24 -55.17 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.315 0 O-C-N 120.981 -1.074 . . . . 0.0 109.377 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.487 ' CE ' ' HB2' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -60.56 -32.22 71.3 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 118.687 -1.205 . . . . 0.0 109.5 179.015 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.18 -41.35 96.65 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 120.856 -1.153 . . . . 0.0 108.975 178.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.726 HD22 ' CD2' ' A' ' 26' ' ' PHE . 18.2 mt -54.27 -33.76 59.34 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.242 -0.911 . . . . 0.0 109.779 178.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.447 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 13.8 t60 -56.58 -40.62 75.53 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.105 -0.997 . . . . 0.0 109.545 179.238 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.489 ' CD2' HD21 ' A' ' 91' ' ' LEU . 7.5 m170 -61.13 -49.84 75.61 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.212 -0.93 . . . . 0.0 108.981 178.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -60.57 -38.46 84.66 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.289 -0.882 . . . . 0.0 109.302 179.055 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.456 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.71 -48.98 74.91 Favored 'General case' 0 N--CA 1.507 2.381 0 C-N-CA 119.33 -0.948 . . . . 0.0 109.015 179.187 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 76.8 p -66.71 -40.43 88.45 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.159 -0.963 . . . . 0.0 108.881 178.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 39.4 ttt85 -64.17 -37.16 86.46 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.115 -0.99 . . . . 0.0 109.502 178.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.714 ' OH ' HG22 ' A' ' 19' ' ' ILE . 40.7 t80 -60.98 -49.73 76.25 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.078 -1.014 . . . . 0.0 109.332 179.473 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.951 HD12 ' HB2' ' A' ' 87' ' ' ALA . 83.9 mt -75.87 -42.75 39.82 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.32 0 O-C-N 121.207 -0.933 . . . . 0.0 109.011 179.108 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.523 ' CE1' HG23 ' A' ' 92' ' ' ILE . 34.8 t80 -59.05 -26.73 64.85 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.384 -0.822 . . . . 0.0 110.352 178.732 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 67.1 m -87.28 -34.69 18.82 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.787 -1.195 . . . . 0.0 110.533 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.614 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -82.9 -34.17 26.71 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 120.77 -1.207 . . . . 0.0 112.151 -179.19 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.548 ' N ' HD12 ' A' ' 66' ' ' LEU . 54.2 t80 -86.54 -36.65 18.82 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 120.672 -1.267 . . . . 0.0 111.873 -179.395 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -95.83 -20.58 18.71 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.901 -1.124 . . . . 0.0 112.84 -178.255 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -119.34 -58.05 1.95 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 120.574 -1.329 . . . . 0.0 111.164 -179.6 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.423 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -64.77 -30.48 71.49 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.004 -1.06 . . . . 0.0 110.655 -179.841 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 58.74 44.26 17.42 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 120.852 -1.155 . . . . 0.0 110.047 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -115.91 37.61 3.59 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.416 -0.802 . . . . 0.0 109.836 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.785 HG13 HD23 ' A' ' 77' ' ' LEU . 14.2 tt -156.09 162.8 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.182 -0.949 . . . . 0.0 110.118 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.3 p -108.47 147.63 31.39 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.101 -0.999 . . . . 0.0 110.102 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.4 tttp -45.9 -32.67 2.79 Favored 'General case' 0 N--CA 1.516 2.861 0 O-C-N 121.381 -0.825 . . . . 0.0 111.574 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -61.75 -49.33 76.81 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.886 -1.134 . . . . 0.0 109.467 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.785 HD23 HG13 ' A' ' 73' ' ' ILE . 50.4 tp -67.42 -44.08 79.64 Favored 'General case' 0 N--CA 1.505 2.317 0 C-N-CA 119.212 -0.995 . . . . 0.0 108.606 178.838 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.474 ' HA ' HD12 ' A' ' 81' ' ' LEU . 21.8 t80 -60.98 -38.48 86.1 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.304 -0.872 . . . . 0.0 109.43 178.916 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -73.89 -42.3 60.9 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.083 -1.011 . . . . 0.0 108.942 178.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.698 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 81.6 t90 -58.3 -37.04 74.25 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.24 -0.913 . . . . 0.0 109.667 178.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.508 HD22 ' CD2' ' A' ' 86' ' ' TYR . 13.6 mt -68.96 -48.68 62.6 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.175 -0.953 . . . . 0.0 108.981 179.209 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.459 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 32.4 mm -57.1 -30.89 35.64 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.553 0 O-C-N 121.145 -0.972 . . . . 0.0 110.1 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -87.86 -22.24 24.55 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.896 -1.128 . . . . 0.0 111.804 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.444 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 72.9 mm-40 -100.42 21.17 13.57 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 120.696 -1.253 . . . . 0.0 111.998 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt 73.56 79.42 0.13 Allowed 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.021 -1.049 . . . . 0.0 111.472 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.641 ' HE2' HD13 ' A' ' 23' ' ' LEU . 31.5 m-85 -137.35 -64.92 0.55 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.554 -0.716 . . . . 0.0 109.669 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.951 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -115.47 173.08 6.71 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.425 -0.797 . . . . 0.0 109.212 179.359 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.447 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 3.5 t0 -116.95 104.13 10.97 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.072 -1.017 . . . . 0.0 110.403 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.77 -39.23 84.17 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.225 -0.922 . . . . 0.0 109.857 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 18.1 tp -60.92 -40.54 93.58 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.219 -0.925 . . . . 0.0 109.947 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.587 ' HA ' HD21 ' A' ' 106' ' ' LEU . 45.5 tp -70.65 -49.06 51.43 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.266 -0.973 . . . . 0.0 108.875 179.346 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.523 HG23 ' CE1' ' A' ' 64' ' ' TYR . 49.6 mt -62.29 -32.08 53.71 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.32 0 C-N-CA 119.287 -0.965 . . . . 0.0 108.917 178.34 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -71.76 -42.08 67.64 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.02 -1.05 . . . . 0.0 109.157 178.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.496 ' HD3' HD23 ' A' ' 106' ' ' LEU . 13.0 mttp -60.73 -40.1 91.13 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.073 -1.017 . . . . 0.0 110.07 179.346 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 3.4 m0 -66.03 -38.01 87.33 Favored 'General case' 0 N--CA 1.509 2.514 0 C-N-CA 119.188 -1.005 . . . . 0.0 109.967 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.19 -35.27 63.96 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.113 -0.992 . . . . 0.0 110.179 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 17.0 mmtt -53.31 -178.82 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.671 0 O-C-N 121.124 -0.985 . . . . 0.0 110.639 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 18.4 m -107.09 142.05 37.37 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.261 -0.899 . . . . 0.0 109.438 179.087 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 101.98 -25.39 28.02 Favored Glycine 0 N--CA 1.494 2.508 0 C-N-CA 119.793 -1.194 . . . . 0.0 110.32 -179.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -91.71 57.88 3.34 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 120.691 -1.476 . . . . 0.0 110.111 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -70.65 -38.3 73.82 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.07 -1.019 . . . . 0.0 109.934 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.26 87.88 2.81 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.177 -0.952 . . . . 0.0 110.153 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.962 HD13 HD13 ' A' ' 109' ' ' ILE . 15.8 tp -120.35 133.01 55.52 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.187 -0.946 . . . . 0.0 109.733 -179.842 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.446 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.1 p -106.21 -36.03 7.01 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.175 -0.953 . . . . 0.0 112.165 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.866 ' O ' HD11 ' A' ' 103' ' ' LEU . 7.1 m -140.17 -169.11 2.68 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.26 -1.525 . . . . 0.0 109.461 178.666 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.587 HD21 ' HA ' ' A' ' 91' ' ' LEU . 15.3 mt -98.45 -36.1 10.05 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.064 -1.022 . . . . 0.0 110.662 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 18.3 ttm-85 -103.57 35.25 2.66 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 120.903 -1.123 . . . . 0.0 109.06 177.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.68 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.306 1.7 t -129.12 18.91 5.97 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.273 -0.892 . . . . 0.0 109.011 -178.907 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.962 HD13 HD13 ' A' ' 103' ' ' LEU . 1.3 pt -158.14 38.31 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 O-C-N 120.929 -1.107 . . . . 0.0 110.288 -178.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.576 ' C ' HG23 ' A' ' 119' ' ' THR . 11.7 tm0? -69.58 72.45 0.35 Allowed 'General case' 0 N--CA 1.509 2.525 0 O-C-N 120.878 -1.139 . . . . 0.0 110.79 -178.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.708 ' HD2' HG21 ' A' ' 119' ' ' THR . 0.2 OUTLIER -141.05 170.14 16.29 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.056 -1.027 . . . . 0.0 110.32 179.348 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -173.46 -58.8 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.307 -0.871 . . . . 0.0 110.587 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -136.12 -60.13 0.73 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.303 -0.873 . . . . 0.0 110.084 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 78.5 p -108.01 -169.74 1.57 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.27 -0.894 . . . . 0.0 109.731 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 41.9 t-20 -105.49 102.02 11.51 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.066 -1.021 . . . . 0.0 110.253 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -139.79 155.33 47.34 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.232 -0.918 . . . . 0.0 110.081 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 70.28 -142.43 35.74 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 17.9 m -128.68 119.33 24.47 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.2 -1.176 . . . . 0.0 110.281 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.708 HG21 ' HD2' ' A' ' 111' ' ' LYS . 2.8 m -114.61 169.15 9.27 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.235 -0.916 . . . . 0.0 110.139 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.447 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 48.9 t -102.4 154.98 18.56 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.241 -0.912 . . . . 0.0 109.74 179.273 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.802 HD12 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -73.39 -36.83 49.73 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.348 0 O-C-N 121.202 -0.936 . . . . 0.0 111.016 -179.422 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.44 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 6.5 p -53.35 -31.39 44.26 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 120.775 -1.203 . . . . 0.0 111.262 -178.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.73 -32.89 72.15 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 120.98 -1.075 . . . . 0.0 109.765 178.334 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 53.0 t -81.57 125.5 78.3 Favored Pre-proline 0 N--CA 1.505 2.319 0 O-C-N 121.032 -1.042 . . . . 0.0 110.075 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.522 ' O ' HD12 ' A' ' 129' ' ' LEU . 40.0 Cg_endo -67.18 175.9 5.24 Favored 'Trans proline' 0 N--CA 1.488 1.199 0 O-C-N 123.191 1.1 . . . . 0.0 110.639 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.11 -36.74 61.65 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.241 -0.912 . . . . 0.0 110.739 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.98 -41.65 83.41 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 120.946 -1.096 . . . . 0.0 110.024 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -68.16 -41.63 81.28 Favored 'General case' 0 N--CA 1.506 2.356 0 C-N-CA 119.317 -0.953 . . . . 0.0 109.221 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.523 HD11 HD11 ' A' ' 121' ' ' ILE . 2.5 mt -62.79 -39.52 94.51 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.236 -0.915 . . . . 0.0 109.669 179.235 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -59.24 -39.56 83.14 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.191 -0.943 . . . . 0.0 110.027 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -60.19 -39.26 85.89 Favored 'General case' 0 N--CA 1.508 2.46 0 C-N-CA 119.385 -0.926 . . . . 0.0 110.05 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -61.86 -46.09 90.92 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.231 -0.918 . . . . 0.0 109.812 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.487 ' HB1' ' HA ' ' A' ' 139' ' ' GLN . . . -61.53 -41.21 97.0 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.177 -0.952 . . . . 0.0 109.916 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 10.0 mmt-85 -65.57 -33.89 76.98 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.228 -0.92 . . . . 0.0 110.343 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 26.2 ttmt -76.82 -31.67 57.07 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.042 -1.036 . . . . 0.0 111.016 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 4.0 tppt? -99.93 23.38 9.87 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 120.945 -1.097 . . . . 0.0 111.762 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.89 46.74 49.11 Favored Glycine 0 N--CA 1.5 2.913 0 O-C-N 120.732 -1.23 . . . . 0.0 110.951 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.438 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 10.1 t -146.61 -163.54 1.77 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.065 -1.256 . . . . 0.0 110.295 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' GLN . . . . . 0.487 ' HA ' ' HB1' ' A' ' 133' ' ' ALA . 30.5 mt-30 -137.12 151.02 48.38 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.105 -0.997 . . . . 0.0 110.396 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.473 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.3 p -132.9 161.1 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.23 -0.919 . . . . 0.0 110.004 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 47.3 t -169.3 75.73 0.09 Allowed 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.172 -0.955 . . . . 0.0 111.211 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.802 ' CG ' HD12 ' A' ' 121' ' ' ILE . 36.8 t80 -91.86 161.62 14.77 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.263 -0.898 . . . . 0.0 109.975 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 3.3 m80 -139.54 -60.91 0.55 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.517 -0.739 . . . . 0.0 109.157 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.26 152.27 50.69 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 179.259 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 25.4 p -98.66 155.24 17.42 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.313 -0.867 . . . . 0.0 110.532 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.3 p -75.33 -23.31 16.92 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.572 0 O-C-N 121.271 -0.893 . . . . 0.0 112.045 -179.077 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -52.27 -44.54 65.02 Favored 'General case' 0 N--CA 1.516 2.867 0 O-C-N 120.667 -1.27 . . . . 0.0 109.592 179.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.495 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 29.3 p -140.15 -169.41 2.74 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.34 -0.85 . . . . 0.0 110.599 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 149' ' ' GLY . . . . . 0.446 ' CA ' ' CE3' ' A' ' 50' ' ' TRP . . . -98.98 56.93 0.93 Allowed Glycine 0 N--CA 1.489 2.169 0 N-CA-C 107.426 -2.27 . . . . 0.0 107.426 178.268 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 24.1 t -101.19 142.51 32.52 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.466 -1.02 . . . . 0.0 109.672 -178.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 2.4 ttp85 -97.4 53.02 1.13 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.258 -0.901 . . . . 0.0 109.379 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.42 97.55 0.03 OUTLIER Glycine 0 N--CA 1.488 2.139 0 N-CA-C 109.559 -1.417 . . . . 0.0 109.559 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 p -107.57 128.69 54.75 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.319 -1.106 . . . . 0.0 110.338 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -136.79 141.58 42.92 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.157 -0.964 . . . . 0.0 110.108 -179.593 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 155' ' ' SER . . . . . 0.66 ' O ' HG23 ' A' ' 156' ' ' THR . 0.7 OUTLIER -104.37 41.78 1.27 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.211 -0.931 . . . . 0.0 109.672 179.521 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 156' ' ' THR . . . . . 0.66 HG23 ' O ' ' A' ' 155' ' ' SER . 0.7 OUTLIER -160.34 -55.65 0.06 Allowed 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.287 -0.883 . . . . 0.0 110.742 -179.869 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 . . . . . 0 N--CA 1.493 1.723 0 CA-C-O 118.005 -0.997 . . . . 0.0 110.271 179.905 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.305 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -79.62 -177.53 50.41 Favored Glycine 0 N--CA 1.492 2.425 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.6 p -131.76 131.77 22.92 Favored Pre-proline 0 N--CA 1.494 1.726 0 O-C-N 121.192 -1.181 . . . . 0.0 110.097 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -74.16 78.93 2.49 Favored 'Trans proline' 0 N--CA 1.486 1.035 0 O-C-N 123.206 1.109 . . . . 0.0 110.345 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 27.2 ttm-85 -126.27 110.31 13.27 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.252 -0.905 . . . . 0.0 110.354 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.508 HG23 ' O ' ' A' ' 4' ' ' ILE . 1.2 tp -157.02 60.86 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 O-C-N 121.196 -0.94 . . . . 0.0 110.731 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.9 tttt -148.08 162.03 40.22 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.144 -0.972 . . . . 0.0 110.428 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.9 m -145.36 47.08 1.3 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.231 -0.918 . . . . 0.0 110.42 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.27 130.61 26.88 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.156 -0.965 . . . . 0.0 110.077 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -120.38 -61.52 1.57 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.19 -0.944 . . . . 0.0 110.194 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.4 t -155.25 81.65 1.06 Allowed 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.183 -0.948 . . . . 0.0 110.737 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 12.6 mmmt -143.35 63.77 13.07 Favored Pre-proline 0 N--CA 1.495 1.805 0 O-C-N 121.224 -0.923 . . . . 0.0 110.155 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.48 ' O ' ' HB3' ' A' ' 12' ' ' ALA . 47.8 Cg_endo -73.09 157.54 50.62 Favored 'Trans proline' 0 C--N 1.317 -1.082 0 O-C-N 123.356 1.187 . . . . 0.0 110.656 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.733 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . 61.89 146.46 0.08 OUTLIER Pre-proline 0 N--CA 1.503 2.198 0 O-C-N 121.395 -0.816 . . . . 0.0 110.69 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -73.75 162.71 38.93 Favored 'Trans proline' 0 C--N 1.318 -1.037 0 O-C-N 123.272 1.143 . . . . 0.0 110.52 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -48.94 -31.95 8.23 Favored 'General case' 0 N--CA 1.516 2.845 0 O-C-N 121.317 -0.864 . . . . 0.0 111.327 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.93 -34.46 51.77 Favored Glycine 0 N--CA 1.498 2.775 0 O-C-N 121.01 -1.056 . . . . 0.0 110.517 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -54.62 -31.8 57.83 Favored 'General case' 0 N--CA 1.511 2.621 0 O-C-N 120.924 -1.339 . . . . 0.0 110.821 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -54.24 -37.83 65.07 Favored 'General case' 0 N--CA 1.512 2.652 0 O-C-N 120.886 -1.134 . . . . 0.0 110.286 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 15.8 mttm -59.27 -37.62 78.07 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.254 -0.904 . . . . 0.0 110.139 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.868 HD12 HD11 ' A' ' 23' ' ' LEU . 1.7 pt -116.3 34.78 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 O-C-N 121.166 -0.959 . . . . 0.0 110.498 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.42 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.4 OUTLIER -85.1 -43.72 0.67 Allowed Pre-proline 0 N--CA 1.509 2.52 0 O-C-N 121.038 -1.039 . . . . 0.0 113.529 -178.911 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.42 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.1 Cg_endo -74.8 -34.14 4.32 Favored 'Trans proline' 0 N--CA 1.487 1.095 0 O-C-N 122.529 0.752 . . . . 0.0 111.96 -177.855 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.546 HG21 ' CE2' ' A' ' 62' ' ' TYR . 91.6 m -62.06 -47.78 83.16 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 120.909 -1.119 . . . . 0.0 109.792 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.868 HD11 HD12 ' A' ' 19' ' ' ILE . 7.7 mt -62.45 -39.53 93.68 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.27 -0.894 . . . . 0.0 109.519 179.357 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.7 m -57.1 -34.82 68.73 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.17 -0.956 . . . . 0.0 110.206 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -56.62 -37.13 70.27 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.094 -1.004 . . . . 0.0 110.266 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.606 ' CD2' HD22 ' A' ' 55' ' ' LEU . 20.2 m-85 -56.97 -37.4 71.54 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.141 -0.974 . . . . 0.0 110.254 179.576 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -56.45 -27.81 57.86 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.23 -0.919 . . . . 0.0 110.975 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.486 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.7 mp -77.75 -35.82 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.45 0 O-C-N 121.044 -1.035 . . . . 0.0 109.411 179.384 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -79.83 -40.03 29.41 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.006 -1.059 . . . . 0.0 108.603 178.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.057 HD11 HG23 ' A' ' 52' ' ' ILE . 7.0 tp -69.46 -34.04 73.81 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.238 -0.914 . . . . 0.0 110.364 179.066 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -71.41 -35.72 71.09 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 118.833 -1.147 . . . . 0.0 109.854 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -65.33 -39.95 93.05 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.106 -0.996 . . . . 0.0 109.645 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.438 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -72.76 -42.02 64.45 Favored 'General case' 0 N--CA 1.504 2.265 0 C-N-CA 119.167 -1.013 . . . . 0.0 109.031 179.01 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -62.92 -34.11 76.76 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.282 -0.887 . . . . 0.0 109.936 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 40.7 mmtt -84.4 -32.68 24.01 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.036 -1.04 . . . . 0.0 110.78 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -55.07 -36.66 65.84 Favored 'General case' 0 N--CA 1.511 2.616 0 O-C-N 120.985 -1.072 . . . . 0.0 110.392 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt -54.56 -38.18 66.34 Favored 'General case' 0 N--CA 1.513 2.691 0 O-C-N 121.107 -0.996 . . . . 0.0 110.399 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.5 m 53.19 -166.82 0.07 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 120.973 -1.079 . . . . 0.0 110.823 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.1 t -110.87 -53.94 2.65 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.218 -0.927 . . . . 0.0 110.171 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.2 mmmt -108.13 72.32 0.84 Allowed 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.245 -0.909 . . . . 0.0 109.746 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.3 tp -165.64 92.92 0.55 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.172 -0.955 . . . . 0.0 110.688 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -102.37 105.44 16.05 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.184 -0.948 . . . . 0.0 110.392 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -169.05 109.83 0.48 Allowed 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.183 -0.948 . . . . 0.0 110.683 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 18.8 mtpt 53.22 41.57 32.14 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.026 -1.046 . . . . 0.0 110.42 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.8 t -95.7 -35.53 11.54 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.307 -0.871 . . . . 0.0 110.865 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 50.0 m-20 -55.85 -38.99 70.83 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 120.982 -1.074 . . . . 0.0 110.122 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -62.36 -41.57 98.72 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.236 -0.915 . . . . 0.0 109.67 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 55.7 tp60 -61.98 -40.62 96.24 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.19 -0.944 . . . . 0.0 109.681 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.408 HD23 HD12 ' A' ' 52' ' ' ILE . 12.5 mt -58.68 -39.02 79.51 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.172 -0.955 . . . . 0.0 109.979 179.702 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.502 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 52.8 m0 -58.56 -36.84 74.55 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.153 -0.967 . . . . 0.0 109.826 179.398 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -60.71 -30.19 69.81 Favored 'General case' 0 N--CA 1.506 2.325 0 O-C-N 121.08 -1.013 . . . . 0.0 109.733 178.312 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 1.057 HG23 HD11 ' A' ' 30' ' ' LEU . 22.6 mt -71.36 -60.64 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.226 0 O-C-N 120.952 -1.092 . . . . 0.0 108.845 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.47 ' HE1' ' O ' ' A' ' 147' ' ' HIS . 0.9 OUTLIER -60.51 -28.69 68.58 Favored 'General case' 0 N--CA 1.51 2.537 0 C-N-CA 118.547 -1.261 . . . . 0.0 109.774 178.61 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -72.24 -39.22 68.62 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 120.875 -1.14 . . . . 0.0 108.89 178.028 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.606 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.0 mt -54.04 -33.71 58.06 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 121.105 -0.997 . . . . 0.0 110.269 178.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.44 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 12.9 t60 -57.03 -35.39 69.22 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.089 -1.007 . . . . 0.0 110.438 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.528 ' NE2' HD21 ' A' ' 91' ' ' LEU . 6.3 m170 -60.56 -50.65 72.69 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 120.981 -1.074 . . . . 0.0 109.603 179.314 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -58.72 -35.83 73.29 Favored 'General case' 0 N--CA 1.508 2.449 0 C-N-CA 119.501 -0.88 . . . . 0.0 109.596 179.167 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.449 ' CD ' ' CD1' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -68.27 -49.61 59.37 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.079 -1.013 . . . . 0.0 109.176 179.003 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.1 p -62.12 -38.46 89.02 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.201 -0.937 . . . . 0.0 109.356 179.04 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 37.5 ttt-85 -65.12 -38.22 89.97 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.092 -1.005 . . . . 0.0 109.384 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.582 ' OH ' HG22 ' A' ' 19' ' ' ILE . 34.1 t80 -59.78 -48.87 79.95 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.211 -0.93 . . . . 0.0 109.368 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.78 HD12 ' HB2' ' A' ' 87' ' ' ALA . 92.0 mt -76.27 -44.25 36.42 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.266 0 C-N-CA 119.505 -0.878 . . . . 0.0 108.869 179.121 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.516 ' CE1' HG23 ' A' ' 92' ' ' ILE . 40.9 t80 -58.92 -25.7 63.67 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.323 -0.86 . . . . 0.0 110.365 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.465 HG23 ' HD3' ' A' ' 69' ' ' LYS . 88.4 m -87.25 -36.09 18.13 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.756 -1.215 . . . . 0.0 110.373 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.564 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -82.92 -33.08 26.93 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 120.813 -1.179 . . . . 0.0 112.34 -179.267 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.518 ' N ' HD12 ' A' ' 66' ' ' LEU . 33.3 t80 -86.42 -34.61 20.1 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 120.707 -1.246 . . . . 0.0 111.922 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.402 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 14.4 m-85 -96.21 -22.02 17.52 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 120.903 -1.123 . . . . 0.0 112.986 -178.181 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.465 ' HD3' HG23 ' A' ' 65' ' ' THR . 8.5 mtpt -112.59 -58.13 2.19 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 120.527 -1.358 . . . . 0.0 110.979 -179.677 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.401 ' HB2' ' HA ' ' A' ' 66' ' ' LEU . 10.2 mmm-85 -71.7 -29.39 64.51 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.139 -0.975 . . . . 0.0 110.919 -179.571 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 58.83 43.91 17.61 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.815 -1.178 . . . . 0.0 109.953 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.01 35.08 3.52 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.302 -0.874 . . . . 0.0 109.807 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.778 HG13 HD23 ' A' ' 77' ' ' LEU . 13.4 tt -153.1 162.7 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.23 -0.919 . . . . 0.0 109.784 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.4 p -107.44 146.76 31.31 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.089 -1.007 . . . . 0.0 110.415 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -46.34 -32.31 3.09 Favored 'General case' 0 N--CA 1.516 2.869 0 O-C-N 121.307 -0.87 . . . . 0.0 111.469 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -62.14 -49.68 74.88 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 120.894 -1.129 . . . . 0.0 109.302 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.778 HD23 HG13 ' A' ' 73' ' ' ILE . 49.5 tp -67.28 -43.46 81.74 Favored 'General case' 0 N--CA 1.505 2.295 0 C-N-CA 119.185 -1.006 . . . . 0.0 108.552 178.811 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.416 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 17.5 t80 -61.64 -38.87 89.27 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.291 -0.88 . . . . 0.0 109.432 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -72.22 -42.41 65.77 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 120.998 -1.064 . . . . 0.0 108.991 178.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.733 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 84.2 t90 -57.94 -36.89 73.16 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.214 -0.929 . . . . 0.0 109.691 179.159 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.659 HD22 ' CD2' ' A' ' 86' ' ' TYR . 30.7 mt -68.75 -46.06 69.82 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.129 -0.982 . . . . 0.0 109.116 179.296 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.2 mm -58.46 -32.84 46.47 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.532 0 O-C-N 121.26 -0.9 . . . . 0.0 110.001 179.446 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.5 mmtp -89.16 -8.79 52.98 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 120.895 -1.128 . . . . 0.0 112.278 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.452 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 75.7 mm-40 -112.17 21.55 15.71 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 120.556 -1.34 . . . . 0.0 112.04 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt 74.05 77.9 0.12 Allowed 'General case' 0 N--CA 1.51 2.543 0 O-C-N 120.97 -1.081 . . . . 0.0 111.456 179.488 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.681 ' HE2' HD13 ' A' ' 23' ' ' LEU . 33.6 m-85 -137.06 -63.0 0.62 Allowed 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.558 -0.714 . . . . 0.0 109.49 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.78 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -126.38 175.97 7.47 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.403 -0.811 . . . . 0.0 109.44 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.44 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 19.1 t0 -116.24 105.5 12.64 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.114 -0.991 . . . . 0.0 110.505 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 13.1 mmmt -61.34 -39.74 91.69 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.228 -0.92 . . . . 0.0 109.655 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.773 HD23 HD13 ' A' ' 106' ' ' LEU . 26.9 tp -60.49 -42.41 96.28 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.104 -0.997 . . . . 0.0 109.658 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.776 ' HA ' HD21 ' A' ' 106' ' ' LEU . 43.4 tp -67.78 -49.36 62.82 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.291 -0.964 . . . . 0.0 109.119 179.332 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.516 HG23 ' CE1' ' A' ' 64' ' ' TYR . 34.3 mt -58.54 -29.88 39.97 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.48 0 C-N-CA 119.27 -0.972 . . . . 0.0 109.212 178.467 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.68 -46.2 66.62 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 120.911 -1.118 . . . . 0.0 109.328 178.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.514 ' HD3' HD23 ' A' ' 106' ' ' LEU . 6.4 mttp -58.16 -38.94 77.61 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.094 -1.004 . . . . 0.0 110.084 179.194 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.6 m0 -66.27 -39.98 89.81 Favored 'General case' 0 N--CA 1.508 2.467 0 C-N-CA 119.318 -0.953 . . . . 0.0 109.515 179.24 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.05 -33.65 70.49 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.282 -0.886 . . . . 0.0 110.358 179.468 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.6 mmtp -53.78 -177.17 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.699 0 O-C-N 121.037 -1.039 . . . . 0.0 110.651 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -106.34 133.22 51.37 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.183 -0.948 . . . . 0.0 109.797 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.95 3.1 56.0 Favored Glycine 0 N--CA 1.493 2.487 0 C-N-CA 120.06 -1.067 . . . . 0.0 111.31 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -108.62 48.48 0.86 Allowed 'General case' 0 N--CA 1.498 1.968 0 CA-C-N 119.645 1.723 . . . . 0.0 110.115 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -64.58 -39.51 93.87 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.213 -0.93 . . . . 0.0 109.911 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.78 104.26 11.78 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.153 -0.967 . . . . 0.0 109.979 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.906 HD13 HD13 ' A' ' 109' ' ' ILE . 8.9 tp -141.59 132.48 25.93 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.17 -0.956 . . . . 0.0 109.713 -179.537 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.444 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.4 p -108.4 -37.3 6.01 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.176 -0.953 . . . . 0.0 112.305 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.816 ' O ' HD11 ' A' ' 103' ' ' LEU . 7.6 m -140.76 -168.93 2.69 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 120.265 -1.522 . . . . 0.0 109.924 178.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.776 HD21 ' HA ' ' A' ' 91' ' ' LEU . 32.7 mt -97.69 -36.74 10.15 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.035 -1.04 . . . . 0.0 110.462 179.272 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 12.1 ttm-85 -103.11 32.72 3.6 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 120.92 -1.112 . . . . 0.0 109.473 178.072 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.657 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.309 1.7 t -128.98 16.47 6.24 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.207 -0.933 . . . . 0.0 109.219 -179.066 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.906 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -158.89 37.99 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 O-C-N 120.843 -1.161 . . . . 0.0 110.604 -178.732 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.575 ' O ' HG23 ' A' ' 119' ' ' THR . 0.0 OUTLIER -115.75 131.16 57.02 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 120.708 -1.245 . . . . 0.0 111.79 -178.433 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.467 ' HA ' ' HG1' ' A' ' 119' ' ' THR . 5.8 ptpt -133.34 -175.19 3.72 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.349 -0.844 . . . . 0.0 110.119 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -147.0 167.88 22.91 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.127 -0.983 . . . . 0.0 110.442 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -117.38 125.16 50.52 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.194 -0.941 . . . . 0.0 110.155 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 1.6 m 52.81 38.91 27.86 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.997 -1.064 . . . . 0.0 110.647 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -143.49 -171.88 3.6 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.221 -0.924 . . . . 0.0 110.145 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -113.31 73.02 0.8 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.19 -0.944 . . . . 0.0 110.165 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -107.64 -169.61 21.82 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 74.0 m -144.77 132.83 21.48 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.172 -1.193 . . . . 0.0 110.362 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.575 HG23 ' O ' ' A' ' 110' ' ' GLN . 2.5 m -125.04 168.55 13.2 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.251 -0.906 . . . . 0.0 110.216 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 45.6 t -92.14 154.44 18.7 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.296 -0.878 . . . . 0.0 109.038 178.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.813 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -71.31 -36.33 61.17 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.42 0 O-C-N 121.101 -1.0 . . . . 0.0 110.882 -179.159 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.446 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.4 p -55.37 -34.35 64.23 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 120.828 -1.17 . . . . 0.0 110.869 -179.004 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.496 ' HG3' HG22 ' A' ' 109' ' ' ILE . 3.0 ttp85 -59.36 -35.55 74.1 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.006 -1.059 . . . . 0.0 109.65 178.399 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 55.6 t -78.91 125.03 84.67 Favored Pre-proline 0 N--CA 1.503 2.202 0 O-C-N 121.171 -0.956 . . . . 0.0 109.823 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.462 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.2 Cg_endo -65.03 174.92 4.26 Favored 'Trans proline' 0 N--CA 1.487 1.133 0 O-C-N 123.143 1.075 . . . . 0.0 110.734 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -75.05 -36.18 61.83 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.203 -0.936 . . . . 0.0 110.719 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.53 -40.9 79.79 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.005 -1.06 . . . . 0.0 109.985 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 7.7 tp60 -69.68 -41.32 75.63 Favored 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 119.341 -0.944 . . . . 0.0 109.274 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.573 HD11 HD11 ' A' ' 121' ' ' ILE . 3.1 mt -65.5 -38.77 90.67 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.204 -0.935 . . . . 0.0 109.554 179.122 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -61.25 -39.91 92.09 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.181 -0.949 . . . . 0.0 109.757 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -59.03 -37.13 76.25 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.179 -0.951 . . . . 0.0 110.326 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -61.4 -44.97 96.22 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.115 -0.991 . . . . 0.0 110.057 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.428 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -60.8 -41.68 96.13 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.172 -0.955 . . . . 0.0 109.914 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 11.0 mtt180 -59.46 -36.9 76.85 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.143 -0.973 . . . . 0.0 110.178 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 44.6 mttm -65.93 -33.77 76.59 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.075 -1.016 . . . . 0.0 110.81 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 35.6 mtmt -105.51 22.39 15.56 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 120.931 -1.106 . . . . 0.0 111.923 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.72 46.47 54.16 Favored Glycine 0 N--CA 1.499 2.89 0 O-C-N 120.608 -1.307 . . . . 0.0 110.799 179.184 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.428 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 9.4 t -138.84 -163.5 1.48 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.197 -1.178 . . . . 0.0 110.088 179.639 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -138.6 146.62 41.99 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.098 -1.001 . . . . 0.0 110.549 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.429 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.9 p -131.0 161.46 40.98 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.185 -0.947 . . . . 0.0 109.723 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 42.1 t -166.75 83.56 0.26 Allowed 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.128 -0.982 . . . . 0.0 111.305 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.792 ' CG ' HD12 ' A' ' 121' ' ' ILE . 38.9 t80 -95.0 161.75 14.01 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.295 -0.878 . . . . 0.0 110.049 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -140.67 -60.61 0.51 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.571 -0.705 . . . . 0.0 109.19 179.011 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.22 151.25 50.94 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.437 -0.789 . . . . 0.0 109.293 178.807 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 28.0 p -97.06 154.43 17.33 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.122 -0.986 . . . . 0.0 111.065 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 19.7 m -74.06 -23.35 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.433 0 O-C-N 121.395 -0.816 . . . . 0.0 111.676 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' HIS . . . . . 0.47 ' O ' ' HE1' ' A' ' 53' ' ' MET . 61.8 m170 -51.68 -52.01 51.44 Favored 'General case' 0 N--CA 1.515 2.779 0 O-C-N 120.717 -1.239 . . . . 0.0 109.967 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.502 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 26.4 p -133.58 -164.88 1.55 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.329 -0.857 . . . . 0.0 110.518 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.59 56.51 0.78 Allowed Glycine 0 N--CA 1.492 2.386 0 N-CA-C 107.925 -2.07 . . . . 0.0 107.925 178.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 18.3 t -101.39 144.07 30.65 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.33 -1.1 . . . . 0.0 109.912 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 7.6 ttm-85 -98.49 50.27 0.99 Allowed 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.3 -0.875 . . . . 0.0 109.531 179.285 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 69.73 98.82 0.04 OUTLIER Glycine 0 N--CA 1.488 2.106 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.0 p -111.13 128.32 55.85 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.237 -1.155 . . . . 0.0 110.229 179.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -144.95 137.31 26.07 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.075 -1.016 . . . . 0.0 110.2 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -96.2 -38.58 10.07 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.208 -0.933 . . . . 0.0 110.559 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 2.7 m -55.41 -38.65 69.21 Favored 'General case' 0 N--CA 1.512 2.642 0 O-C-N 121.007 -1.058 . . . . 0.0 110.525 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 . . . . . 0 N--CA 1.494 1.768 0 CA-C-O 117.969 -1.015 . . . . 0.0 110.174 179.947 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.313 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -117.84 61.79 0.43 Allowed Glycine 0 N--CA 1.494 2.502 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.1 p -120.79 166.37 15.83 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.278 -1.131 . . . . 0.0 110.275 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.79 155.13 53.97 Favored 'Trans proline' 0 C--N 1.316 -1.133 0 O-C-N 123.434 1.229 . . . . 0.0 110.389 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.7 tpt180 -136.77 141.03 42.95 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.228 -0.92 . . . . 0.0 110.216 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 45.1 pt -136.85 144.46 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.222 -0.924 . . . . 0.0 110.3 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.7 ptpt -145.14 -176.71 5.21 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.17 -0.956 . . . . 0.0 110.35 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 66.1 p -128.96 -65.95 0.85 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.238 -0.914 . . . . 0.0 110.255 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 77.1 mtt-85 -145.99 126.82 14.42 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.284 -0.885 . . . . 0.0 110.377 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 25.6 ttp85 -144.04 95.53 2.74 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.172 -0.955 . . . . 0.0 110.261 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.1 t -140.47 93.82 2.66 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.187 -0.945 . . . . 0.0 110.195 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.6 mmtt 52.81 75.17 0.67 Allowed Pre-proline 0 N--CA 1.501 2.099 0 O-C-N 121.02 -1.05 . . . . 0.0 110.648 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -73.06 158.57 49.25 Favored 'Trans proline' 0 C--N 1.316 -1.151 0 O-C-N 123.361 1.19 . . . . 0.0 110.764 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.693 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -100.23 147.3 33.34 Favored Pre-proline 0 N--CA 1.499 1.987 0 O-C-N 121.391 -0.818 . . . . 0.0 109.748 179.54 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.435 ' HG2' HD13 ' A' ' 77' ' ' LEU . 44.2 Cg_endo -69.94 162.7 41.19 Favored 'Trans proline' 0 C--N 1.317 -1.125 0 O-C-N 123.315 1.166 . . . . 0.0 110.812 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -48.7 -31.83 7.46 Favored 'General case' 0 N--CA 1.514 2.758 0 O-C-N 121.451 -0.78 . . . . 0.0 111.339 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.67 -34.29 43.47 Favored Glycine 0 N--CA 1.499 2.861 0 O-C-N 120.941 -1.1 . . . . 0.0 110.609 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -55.6 -33.19 63.73 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 120.965 -1.315 . . . . 0.0 110.688 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -54.03 -37.65 64.33 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 121.04 -1.037 . . . . 0.0 110.187 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -58.9 -37.45 76.64 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.288 -0.882 . . . . 0.0 110.072 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.727 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.5 pt -116.43 34.5 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 O-C-N 121.118 -0.989 . . . . 0.0 110.554 179.689 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -82.89 -44.29 0.89 Allowed Pre-proline 0 N--CA 1.51 2.544 0 O-C-N 121.011 -1.055 . . . . 0.0 112.871 -179.252 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.4 Cg_endo -76.68 -36.12 1.74 Allowed 'Trans proline' 0 N--CA 1.486 1.087 0 O-C-N 122.642 0.811 . . . . 0.0 111.407 -178.464 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.87 HG21 ' CE2' ' A' ' 62' ' ' TYR . 87.3 m -58.71 -41.77 87.1 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 120.986 -1.071 . . . . 0.0 109.964 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.727 HD12 ' O ' ' A' ' 19' ' ' ILE . 2.3 mt -66.84 -40.97 88.14 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.263 -0.898 . . . . 0.0 109.397 179.481 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.6 m -59.42 -35.26 73.68 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.199 -0.938 . . . . 0.0 110.084 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -57.04 -36.94 71.07 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 121.036 -1.04 . . . . 0.0 110.266 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.597 ' CD2' HD22 ' A' ' 55' ' ' LEU . 12.5 m-85 -58.18 -37.95 75.74 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.136 -0.977 . . . . 0.0 110.497 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -60.74 -39.78 89.98 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.147 -0.971 . . . . 0.0 110.602 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.414 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.1 mp -65.83 -41.57 90.4 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 C-N-CA 119.23 -0.988 . . . . 0.0 109.039 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -67.78 -48.16 67.13 Favored 'General case' 0 N--CA 1.505 2.319 0 C-N-CA 119.224 -0.99 . . . . 0.0 108.643 178.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.702 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -62.93 -36.39 83.24 Favored 'General case' 0 N--CA 1.509 2.507 0 C-N-CA 119.35 -0.94 . . . . 0.0 108.936 178.356 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -57.31 -41.8 80.59 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.061 -1.025 . . . . 0.0 109.879 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -61.99 -45.28 94.33 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 119.393 -0.923 . . . . 0.0 109.862 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.548 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -68.72 -39.68 80.29 Favored 'General case' 0 N--CA 1.507 2.385 0 C-N-CA 119.343 -0.943 . . . . 0.0 109.652 179.479 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.519 ' HG3' HD23 ' A' ' 30' ' ' LEU . 56.6 mt-30 -68.93 -31.13 69.81 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.218 -0.926 . . . . 0.0 110.647 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.9 mtpt -98.02 -29.17 13.43 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.94 -1.1 . . . . 0.0 111.886 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.416 ' O ' HD22 ' A' ' 41' ' ' LEU . 23.2 m-20 -58.44 -36.72 74.07 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 120.757 -1.214 . . . . 0.0 110.344 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.1 ttmm -54.64 -38.98 67.52 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.007 -1.058 . . . . 0.0 110.387 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.3 t 52.62 -166.35 0.06 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.061 -1.024 . . . . 0.0 110.884 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.4 t -96.55 -38.99 9.75 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 121.173 -0.955 . . . . 0.0 110.468 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.34 82.23 1.71 Allowed 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.052 -1.03 . . . . 0.0 109.906 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.416 HD22 ' O ' ' A' ' 36' ' ' ASP . 18.4 tp -155.03 88.64 1.18 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.176 -0.952 . . . . 0.0 110.484 -179.8 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -103.23 35.57 2.52 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.253 -0.905 . . . . 0.0 110.651 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -127.29 120.74 29.32 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.263 -0.898 . . . . 0.0 109.901 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.5 mptt 53.15 58.04 5.68 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.008 -1.058 . . . . 0.0 110.547 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -101.98 -44.02 5.61 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.088 -1.008 . . . . 0.0 110.871 -179.87 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -57.85 -40.31 79.84 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.098 -1.001 . . . . 0.0 110.151 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -59.94 -39.29 85.02 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.26 -0.9 . . . . 0.0 110.052 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -62.36 -45.94 90.93 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.174 -0.954 . . . . 0.0 109.736 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.449 HD23 ' HA ' ' A' ' 49' ' ' LEU . 23.9 mt -59.21 -36.74 75.94 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.177 -0.952 . . . . 0.0 110.32 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 47.7 m0 -58.63 -37.74 76.56 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 121.035 -1.04 . . . . 0.0 110.038 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -61.22 -32.86 72.64 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 119.148 -1.021 . . . . 0.0 109.701 178.333 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.702 HG23 ' CG ' ' A' ' 30' ' ' LEU . 74.1 mt -71.06 -59.65 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.283 0 O-C-N 121.092 -1.005 . . . . 0.0 108.883 179.101 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -61.1 -29.4 69.73 Favored 'General case' 0 N--CA 1.511 2.591 0 C-N-CA 118.544 -1.263 . . . . 0.0 109.754 178.57 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -69.48 -37.15 77.14 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.79 -1.194 . . . . 0.0 109.062 178.215 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.597 HD22 ' CD2' ' A' ' 26' ' ' PHE . 10.9 mt -53.31 -33.55 53.81 Favored 'General case' 0 N--CA 1.511 2.616 0 O-C-N 120.982 -1.074 . . . . 0.0 110.179 179.048 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.468 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 71.1 t60 -54.47 -38.28 66.22 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 120.965 -1.085 . . . . 0.0 110.059 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.448 ' CD2' HD21 ' A' ' 91' ' ' LEU . 6.6 m170 -61.09 -48.08 83.35 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.193 -0.942 . . . . 0.0 109.359 179.369 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -59.39 -36.57 76.06 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.279 -0.888 . . . . 0.0 109.676 179.021 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.417 ' HD2' ' CD2' ' A' ' 26' ' ' PHE . 8.0 mtp85 -63.59 -49.58 72.79 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.125 -0.984 . . . . 0.0 109.477 179.384 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 93.8 p -63.83 -40.74 97.34 Favored 'General case' 0 N--CA 1.504 2.269 0 C-N-CA 119.301 -0.96 . . . . 0.0 109.118 179.18 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.9 ttt85 -62.14 -38.85 90.55 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.192 -0.943 . . . . 0.0 109.405 179.018 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.87 ' CE2' HG21 ' A' ' 22' ' ' THR . 39.1 t80 -62.94 -51.7 65.88 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.081 -1.012 . . . . 0.0 109.345 179.515 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.588 HD12 ' HB2' ' A' ' 87' ' ' ALA . 92.7 mt -69.81 -37.97 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.365 0 C-N-CA 119.321 -0.952 . . . . 0.0 109.332 179.386 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.44 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 7.1 t80 -66.1 -42.65 89.0 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.127 -0.983 . . . . 0.0 109.018 178.897 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 92.9 m -60.78 -40.88 94.21 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.19 -0.944 . . . . 0.0 110.384 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.594 HD12 ' N ' ' A' ' 67' ' ' TYR . 3.7 pp -83.14 -35.34 25.64 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.818 -1.176 . . . . 0.0 112.422 -178.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.594 ' N ' HD12 ' A' ' 66' ' ' LEU . 30.6 t80 -86.48 -33.02 20.49 Favored 'General case' 0 N--CA 1.513 2.712 0 O-C-N 120.589 -1.319 . . . . 0.0 112.054 -179.308 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.44 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 7.0 m-85 -98.41 -6.29 30.88 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 120.802 -1.186 . . . . 0.0 113.138 -178.444 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 15.0 mtpt -129.8 -58.09 1.1 Allowed 'General case' 0 N--CA 1.502 2.17 0 O-C-N 120.366 -1.459 . . . . 0.0 110.534 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.3 mtt85 -72.01 -28.95 63.72 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.145 -0.972 . . . . 0.0 110.83 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.7 tttp 58.58 43.62 18.89 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.771 -1.205 . . . . 0.0 110.034 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -109.85 34.23 3.96 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.363 -0.836 . . . . 0.0 109.915 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.67 HG13 HD23 ' A' ' 77' ' ' LEU . 13.4 tt -151.07 162.65 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 O-C-N 121.202 -0.936 . . . . 0.0 109.657 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.8 t -107.92 144.3 35.36 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.128 -0.983 . . . . 0.0 110.34 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 50.6 tttt -45.08 -32.48 1.76 Allowed 'General case' 0 N--CA 1.515 2.785 0 O-C-N 121.328 -0.857 . . . . 0.0 111.732 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.42 -49.65 76.02 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 120.915 -1.115 . . . . 0.0 109.321 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.67 HD23 HG13 ' A' ' 73' ' ' ILE . 33.6 tp -67.09 -46.93 72.75 Favored 'General case' 0 N--CA 1.505 2.276 0 C-N-CA 119.077 -1.049 . . . . 0.0 108.45 178.763 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.806 ' HA ' HD12 ' A' ' 81' ' ' LEU . 19.2 t80 -58.15 -38.64 76.98 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.294 -0.879 . . . . 0.0 109.395 178.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -71.7 -42.97 66.73 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.035 -1.041 . . . . 0.0 108.433 178.548 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.693 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 73.4 t90 -56.33 -37.76 70.4 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.265 -0.897 . . . . 0.0 109.561 178.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.806 HD12 ' HA ' ' A' ' 78' ' ' TYR . 8.0 mt -66.56 -50.39 63.28 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.206 -0.934 . . . . 0.0 109.153 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 36.9 mm -57.91 -33.18 45.24 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.545 0 O-C-N 121.178 -0.951 . . . . 0.0 110.181 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -89.18 -6.07 57.21 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.894 -1.129 . . . . 0.0 112.416 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.455 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 17.3 mm-40 -115.01 22.61 13.24 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.395 -1.441 . . . . 0.0 112.016 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt 75.08 72.82 0.1 Allowed 'General case' 0 N--CA 1.511 2.623 0 O-C-N 121.104 -0.997 . . . . 0.0 111.679 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.656 ' HE2' HD13 ' A' ' 23' ' ' LEU . 31.5 m-85 -133.37 -62.35 0.79 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.432 -0.793 . . . . 0.0 109.333 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.588 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -132.24 167.26 20.13 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.467 -0.771 . . . . 0.0 109.593 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.468 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.5 t0 -109.77 107.24 17.16 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.155 -0.965 . . . . 0.0 110.237 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 12.4 mmtt -58.17 -38.15 76.08 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.263 -0.898 . . . . 0.0 110.035 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.465 HD23 HD13 ' A' ' 106' ' ' LEU . 13.6 tp -58.82 -38.43 78.62 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.213 -0.929 . . . . 0.0 110.161 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.448 HD21 ' CD2' ' A' ' 57' ' ' HIS . 57.6 tp -71.23 -45.35 63.49 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.133 -0.979 . . . . 0.0 108.835 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.439 HG23 ' CE2' ' A' ' 64' ' ' TYR . 24.9 mt -59.63 -37.78 72.38 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 C-N-CA 119.396 -0.921 . . . . 0.0 108.531 178.208 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.73 -38.99 87.78 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.176 -0.953 . . . . 0.0 109.112 178.453 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.444 ' HB3' HD22 ' A' ' 103' ' ' LEU . 9.8 mmtm -57.75 -41.25 81.5 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.001 -1.062 . . . . 0.0 109.755 179.329 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.3 m0 -68.1 -35.36 78.03 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.259 -0.901 . . . . 0.0 110.337 179.58 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 10.1 mtp85 -83.36 -31.41 26.77 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.072 -1.018 . . . . 0.0 110.888 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.3 mmtt -51.63 177.15 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.739 0 O-C-N 120.865 -1.147 . . . . 0.0 110.759 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.58 140.67 37.23 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.202 -0.936 . . . . 0.0 109.48 179.194 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 101.07 -23.52 35.23 Favored Glycine 0 N--CA 1.493 2.474 0 C-N-CA 119.814 -1.184 . . . . 0.0 110.407 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.632 ' HB3' HD23 ' A' ' 103' ' ' LEU . 63.5 m-85 -92.04 58.11 3.27 Favored 'General case' 0 N--CA 1.504 2.246 0 CA-C-N 119.098 1.449 . . . . 0.0 110.056 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -66.92 -32.83 74.35 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.138 -0.976 . . . . 0.0 110.522 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt -132.9 102.07 5.49 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.002 -1.061 . . . . 0.0 110.506 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.632 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.9 pp -140.62 155.0 46.67 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.083 -1.011 . . . . 0.0 110.551 179.609 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.429 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.5 p -118.95 -35.61 3.61 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.29 -0.881 . . . . 0.0 113.222 -179.71 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.697 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.4 m -142.91 -170.72 3.3 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.253 -1.529 . . . . 0.0 110.384 179.588 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.465 HD13 HD23 ' A' ' 90' ' ' LEU . 24.3 mt -98.35 -35.91 10.15 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.28 -0.887 . . . . 0.0 110.333 178.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 1.1 ttt-85 -103.47 35.18 2.67 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.816 -1.177 . . . . 0.0 109.538 178.403 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.697 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.279 1.7 t -126.85 -59.75 1.25 Allowed 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 105.65 -1.982 . . . . 0.0 105.65 -179.631 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.752 ' O ' HG21 ' A' ' 119' ' ' THR . 15.1 pt -68.95 -26.01 31.45 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.546 0 O-C-N 120.902 -1.124 . . . . 0.0 110.854 176.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.415 ' N ' HG13 ' A' ' 109' ' ' ILE . 44.3 tt0 -126.16 155.09 42.26 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.972 -1.08 . . . . 0.0 110.138 -179.214 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 2.0 tpmt? -117.88 -56.96 2.15 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.186 -0.946 . . . . 0.0 110.163 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -149.34 -172.69 4.19 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.156 -0.965 . . . . 0.0 110.373 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -117.11 73.57 0.87 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.163 -0.961 . . . . 0.0 110.046 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.47 -164.33 1.7 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.219 -0.926 . . . . 0.0 110.026 -179.835 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 37.2 t-20 -95.08 -38.75 10.48 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.107 -0.996 . . . . 0.0 110.318 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -112.29 163.21 14.65 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.146 -0.971 . . . . 0.0 110.231 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 140.05 -168.5 25.05 Favored Glycine 0 N--CA 1.494 2.519 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.4 m -142.38 174.89 10.21 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.171 -1.193 . . . . 0.0 110.257 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.752 HG21 ' O ' ' A' ' 109' ' ' ILE . 1.7 m -140.84 174.34 10.61 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.225 -0.922 . . . . 0.0 109.802 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 34.0 t -53.41 153.94 3.73 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 120.928 -1.108 . . . . 0.0 109.801 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.79 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -73.77 -35.26 43.01 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.444 0 O-C-N 121.08 -1.012 . . . . 0.0 111.161 -178.948 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.484 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 12.1 p -54.52 -33.53 60.16 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 120.735 -1.228 . . . . 0.0 111.208 -178.827 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -34.16 70.1 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.907 -1.121 . . . . 0.0 109.635 178.439 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.58 HG12 ' HG ' ' A' ' 129' ' ' LEU . 53.0 t -81.65 124.66 79.62 Favored Pre-proline 0 N--CA 1.505 2.282 0 O-C-N 121.123 -0.985 . . . . 0.0 109.779 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.465 ' HD3' ' HB1' ' A' ' 154' ' ' ALA . 39.2 Cg_endo -66.25 178.82 2.28 Favored 'Trans proline' 0 N--CA 1.489 1.234 0 O-C-N 123.194 1.102 . . . . 0.0 110.637 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 6.6 tpt180 -75.04 -38.41 61.44 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.197 -0.939 . . . . 0.0 110.427 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.26 -43.32 92.45 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.074 -1.016 . . . . 0.0 109.809 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.8 tm0? -67.31 -41.17 85.81 Favored 'General case' 0 N--CA 1.505 2.296 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.239 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.639 HD11 HD11 ' A' ' 121' ' ' ILE . 74.6 mt -63.96 -39.94 95.3 Favored 'General case' 0 N--CA 1.506 2.369 0 C-N-CA 119.493 -0.883 . . . . 0.0 109.491 179.233 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -59.2 -38.3 79.52 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.119 -0.988 . . . . 0.0 109.966 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -57.52 -36.48 71.63 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.107 -0.995 . . . . 0.0 110.397 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -63.07 -48.94 76.47 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.205 -0.934 . . . . 0.0 109.833 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.62 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -59.08 -38.43 79.44 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.09 -1.007 . . . . 0.0 109.834 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -59.74 -38.58 82.12 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.146 -0.971 . . . . 0.0 110.207 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 58.7 mttt -87.13 -42.14 13.25 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.071 -1.018 . . . . 0.0 109.96 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 21.6 mmtt -63.03 -25.82 68.56 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.27 -0.894 . . . . 0.0 111.178 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.75 33.51 9.07 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.62 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 7.8 t -145.99 -160.84 1.2 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.084 -1.245 . . . . 0.0 109.91 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -130.89 143.85 51.03 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.079 -1.013 . . . . 0.0 109.967 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 12.3 p -124.85 160.28 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.206 -0.934 . . . . 0.0 110.722 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 43.8 t -165.5 87.97 0.41 Allowed 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.365 -0.834 . . . . 0.0 110.6 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.767 ' CG ' HD12 ' A' ' 121' ' ' ILE . 60.5 t80 -100.41 161.1 13.82 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.23 -0.919 . . . . 0.0 110.999 -179.19 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -139.29 -60.96 0.56 Allowed 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -134.68 150.52 50.64 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.359 -0.838 . . . . 0.0 108.952 178.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' CYS . . . . . 0.437 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.5 p -90.79 152.71 20.68 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.056 -1.027 . . . . 0.0 111.237 -179.528 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.8 m -70.9 -26.5 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 C-N-CA 119.736 -0.786 . . . . 0.0 111.298 -179.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 61.7 m170 -50.38 -58.83 4.8 Favored 'General case' 0 N--CA 1.515 2.818 0 O-C-N 120.9 -1.125 . . . . 0.0 110.221 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 22.9 p -128.3 -166.73 1.67 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.248 -0.908 . . . . 0.0 110.451 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -99.95 60.92 0.71 Allowed Glycine 0 N--CA 1.493 2.44 0 N-CA-C 108.076 -2.01 . . . . 0.0 108.076 178.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 17.4 t -98.72 145.44 26.9 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.315 -1.109 . . . . 0.0 109.902 -179.279 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 32.4 mtt-85 -98.62 49.93 0.98 Allowed 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.236 -0.915 . . . . 0.0 109.444 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 68.18 97.39 0.04 OUTLIER Glycine 0 N--CA 1.488 2.141 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 22.4 p -109.94 129.08 55.71 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.163 -1.198 . . . . 0.0 110.508 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 154' ' ' ALA . . . . . 0.465 ' HB1' ' HD3' ' A' ' 125' ' ' PRO . . . -151.0 140.17 21.2 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.187 -0.946 . . . . 0.0 110.179 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -116.52 -57.06 2.23 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.211 -0.931 . . . . 0.0 110.277 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 7.0 m -140.83 51.39 1.63 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.223 -0.923 . . . . 0.0 110.131 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.494 1.754 0 CA-C-O 117.961 -1.019 . . . . 0.0 110.177 -179.963 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 64.5 89.69 0.04 OUTLIER Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.486 -1.446 . . . . 0.0 109.486 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.454 ' OG ' ' HD3' ' A' ' 2' ' ' PRO . 0.0 OUTLIER -63.31 -57.84 18.56 Favored Pre-proline 0 N--CA 1.508 2.431 0 O-C-N 121.176 -1.191 . . . . 0.0 110.12 -179.997 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.454 ' HD3' ' OG ' ' A' ' 1' ' ' SER . 47.1 Cg_endo -73.43 111.07 3.2 Favored 'Trans proline' 0 C--N 1.319 -1.019 0 O-C-N 123.285 1.15 . . . . 0.0 110.414 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.9 ptt-85 -134.79 173.12 12.05 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.248 -0.907 . . . . 0.0 110.323 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.2 tt -141.68 50.9 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 O-C-N 121.186 -0.946 . . . . 0.0 110.108 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 20.5 mtmt -115.66 146.92 41.41 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.189 -0.945 . . . . 0.0 110.198 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 12.3 p -123.77 71.76 1.12 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.272 -0.893 . . . . 0.0 110.272 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -127.54 -179.09 4.74 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.08 -1.013 . . . . 0.0 110.176 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.8 ptt85 -159.69 -172.67 3.77 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.171 -0.955 . . . . 0.0 110.877 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -115.57 -165.31 1.02 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.225 -0.922 . . . . 0.0 110.159 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -115.91 138.81 24.3 Favored Pre-proline 0 N--CA 1.494 1.759 0 O-C-N 121.183 -0.948 . . . . 0.0 110.15 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.474 ' O ' ' HB3' ' A' ' 12' ' ' ALA . 48.4 Cg_endo -74.58 158.11 44.02 Favored 'Trans proline' 0 C--N 1.319 -0.998 0 O-C-N 123.248 1.13 . . . . 0.0 110.557 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.749 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . 61.78 149.1 0.09 OUTLIER Pre-proline 0 N--CA 1.503 2.201 0 O-C-N 121.328 -0.857 . . . . 0.0 110.721 179.775 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -72.6 165.21 33.38 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 O-C-N 123.287 1.151 . . . . 0.0 110.612 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -48.47 -32.02 7.21 Favored 'General case' 0 N--CA 1.515 2.776 0 O-C-N 121.481 -0.762 . . . . 0.0 111.391 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.83 -34.84 51.82 Favored Glycine 0 N--CA 1.498 2.795 0 N-CA-C 110.449 -1.061 . . . . 0.0 110.449 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.489 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 28.9 t80 -54.77 -32.74 60.42 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 120.919 -1.341 . . . . 0.0 110.673 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -53.94 -37.66 64.12 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 121.015 -1.053 . . . . 0.0 110.276 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.0 mmpt? -58.31 -36.13 72.88 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.203 -0.935 . . . . 0.0 110.275 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.678 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.7 pt -117.06 36.26 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.181 -0.95 . . . . 0.0 110.547 179.733 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.422 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.5 OUTLIER -83.22 -44.68 0.85 Allowed Pre-proline 0 N--CA 1.509 2.514 0 O-C-N 121.075 -1.016 . . . . 0.0 113.065 -179.178 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.422 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.1 Cg_endo -75.64 -35.87 2.48 Favored 'Trans proline' 0 N--CA 1.485 1.027 0 O-C-N 122.655 0.819 . . . . 0.0 111.757 -178.138 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.784 HG21 ' CE2' ' A' ' 62' ' ' TYR . 60.7 m -60.35 -43.64 96.31 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 120.933 -1.104 . . . . 0.0 110.014 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.728 HD13 ' HE2' ' A' ' 86' ' ' TYR . 4.2 mt -65.49 -41.03 93.73 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 119.45 -0.9 . . . . 0.0 109.419 179.488 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -57.56 -34.15 68.88 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.164 -0.96 . . . . 0.0 110.192 179.243 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -57.0 -37.21 71.34 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.106 -0.996 . . . . 0.0 110.316 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.595 ' CD2' HD22 ' A' ' 55' ' ' LEU . 13.3 m-85 -58.76 -38.69 79.03 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.136 -0.977 . . . . 0.0 110.476 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -59.56 -39.7 84.92 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.164 -0.96 . . . . 0.0 110.437 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.412 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.0 mp -64.99 -40.22 88.35 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 C-N-CA 119.227 -0.989 . . . . 0.0 108.958 179.549 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -69.01 -50.41 49.1 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.122 -0.986 . . . . 0.0 108.887 178.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.756 HD11 HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -60.94 -35.54 77.0 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.119 -0.988 . . . . 0.0 109.278 178.535 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.44 -39.36 70.2 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 121.087 -1.008 . . . . 0.0 109.911 179.495 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.41 -41.75 88.8 Favored 'General case' 0 N--CA 1.507 2.376 0 C-N-CA 119.206 -0.998 . . . . 0.0 109.395 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.48 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -70.84 -41.92 70.85 Favored 'General case' 0 N--CA 1.504 2.229 0 C-N-CA 119.228 -0.989 . . . . 0.0 109.073 179.068 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -60.4 -34.44 73.92 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.285 -0.885 . . . . 0.0 109.963 179.34 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.8 mmmt -80.08 -29.69 39.16 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.0 -1.062 . . . . 0.0 110.965 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.76 -35.9 57.11 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 120.808 -1.183 . . . . 0.0 110.266 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.7 tmtt? -52.48 -33.7 45.89 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 121.204 -0.935 . . . . 0.0 110.821 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.7 m -53.54 -179.76 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.706 0 O-C-N 121.016 -1.053 . . . . 0.0 110.632 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.9 m -109.05 163.45 13.31 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.174 -0.954 . . . . 0.0 110.297 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.7 ttmt 52.29 38.33 24.57 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.094 -1.004 . . . . 0.0 110.736 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 14.5 tp -124.72 -57.69 1.53 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.188 -0.945 . . . . 0.0 110.372 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.31 -171.12 3.76 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.091 -1.006 . . . . 0.0 110.673 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -113.16 -173.7 2.31 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.2 -0.937 . . . . 0.0 109.99 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.5 mptt 52.28 94.51 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.043 -1.036 . . . . 0.0 110.678 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.31 -51.02 3.59 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.188 -0.945 . . . . 0.0 109.82 179.623 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.551 ' ND2' ' CZ2' ' A' ' 50' ' ' TRP . 2.9 t30 -62.69 -39.65 94.65 Favored 'General case' 0 N--CA 1.506 2.345 0 C-N-CA 119.446 -0.902 . . . . 0.0 109.338 179.173 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -65.75 -40.15 91.79 Favored 'General case' 0 N--CA 1.507 2.39 0 C-N-CA 119.473 -0.891 . . . . 0.0 109.566 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.411 ' CG ' ' HA ' ' A' ' 33' ' ' ALA . 49.4 tp60 -63.31 -40.86 98.51 Favored 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 119.413 -0.915 . . . . 0.0 109.664 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.556 HD23 HD12 ' A' ' 52' ' ' ILE . 12.4 mt -59.54 -39.28 83.46 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.13 -0.981 . . . . 0.0 109.72 179.532 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.551 ' CZ2' ' ND2' ' A' ' 46' ' ' ASN . 54.1 m0 -58.01 -36.23 72.39 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.202 -0.936 . . . . 0.0 109.842 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -62.41 -29.89 70.82 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.054 -1.028 . . . . 0.0 109.672 178.263 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.756 HG23 HD11 ' A' ' 30' ' ' LEU . 46.4 mt -70.55 -59.07 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 120.953 -1.092 . . . . 0.0 109.089 179.425 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.3 ptm -60.37 -29.82 69.17 Favored 'General case' 0 N--CA 1.51 2.546 0 C-N-CA 118.46 -1.296 . . . . 0.0 109.754 178.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -68.01 -37.41 81.4 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 120.885 -1.134 . . . . 0.0 109.263 178.187 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.755 HD12 HD12 ' A' ' 30' ' ' LEU . 11.9 mt -53.05 -32.19 45.54 Favored 'General case' 0 N--CA 1.513 2.688 0 O-C-N 120.962 -1.086 . . . . 0.0 110.304 179.055 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.443 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 5.0 t60 -56.1 -36.77 68.55 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.057 -1.027 . . . . 0.0 110.113 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.482 ' NE2' HD21 ' A' ' 91' ' ' LEU . 5.5 m170 -60.48 -49.49 77.34 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.1 -1.0 . . . . 0.0 109.508 179.243 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -58.24 -37.42 74.87 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.3 -0.875 . . . . 0.0 109.679 179.329 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.426 HH12 HD13 ' A' ' 30' ' ' LEU . 7.3 mtt180 -63.07 -48.77 77.23 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.172 -0.955 . . . . 0.0 109.482 179.247 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.7 p -60.74 -40.37 92.14 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.172 -0.955 . . . . 0.0 109.564 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.407 ' O ' ' OG1' ' A' ' 65' ' ' THR . 4.1 tpt85 -62.6 -40.99 98.68 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 119.343 -0.943 . . . . 0.0 109.319 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.784 ' CE2' HG21 ' A' ' 22' ' ' THR . 45.3 t80 -62.95 -50.23 71.63 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.276 -0.89 . . . . 0.0 109.512 179.473 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.833 HD12 ' HB2' ' A' ' 87' ' ' ALA . 79.7 mt -70.28 -36.78 68.78 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 C-N-CA 119.3 -0.96 . . . . 0.0 109.453 179.425 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.447 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 9.5 t80 -67.8 -42.12 82.09 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.068 -1.02 . . . . 0.0 108.891 178.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.407 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 90.1 m -60.92 -40.83 94.68 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.175 -0.953 . . . . 0.0 110.097 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.626 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.8 pp -83.2 -36.49 24.62 Favored 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 118.99 -1.084 . . . . 0.0 112.465 -179.126 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.612 ' N ' HD12 ' A' ' 66' ' ' LEU . 50.0 t80 -86.65 -35.12 19.54 Favored 'General case' 0 N--CA 1.513 2.693 0 O-C-N 120.63 -1.294 . . . . 0.0 111.858 -179.54 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.447 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 6.6 m-85 -98.32 -3.42 37.21 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.903 -1.123 . . . . 0.0 113.25 -178.5 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.87 -58.93 0.61 Allowed 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.374 -1.454 . . . . 0.0 110.749 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.413 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -62.57 -29.44 70.59 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.063 -1.023 . . . . 0.0 110.654 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.1 tttt 59.87 44.41 13.75 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.768 -1.207 . . . . 0.0 109.985 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -117.38 37.61 3.83 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.342 -0.849 . . . . 0.0 109.888 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.762 HG13 HD23 ' A' ' 77' ' ' LEU . 14.9 tt -157.35 162.69 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.227 -0.921 . . . . 0.0 110.411 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.8 p -110.31 149.0 30.82 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.119 -0.988 . . . . 0.0 110.104 179.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.3 tttt -46.34 -31.92 2.87 Favored 'General case' 0 N--CA 1.515 2.791 0 O-C-N 121.269 -0.895 . . . . 0.0 111.722 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -62.86 -51.91 65.17 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 120.964 -1.085 . . . . 0.0 109.423 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.762 HD23 HG13 ' A' ' 73' ' ' ILE . 31.4 tp -65.04 -43.02 93.72 Favored 'General case' 0 N--CA 1.507 2.38 0 C-N-CA 119.145 -1.022 . . . . 0.0 108.816 178.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.639 ' HA ' HD12 ' A' ' 81' ' ' LEU . 16.9 t80 -62.53 -40.48 96.94 Favored 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 119.53 -0.868 . . . . 0.0 109.235 179.182 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -70.25 -42.05 72.7 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.168 -0.957 . . . . 0.0 108.849 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.749 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 81.1 t90 -57.06 -35.51 69.43 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.262 -0.899 . . . . 0.0 109.876 179.062 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.639 HD12 ' HA ' ' A' ' 78' ' ' TYR . 12.4 mt -69.9 -48.23 59.44 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.079 -1.013 . . . . 0.0 108.971 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.9 mm -57.47 -31.66 39.45 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.609 0 O-C-N 121.312 -0.868 . . . . 0.0 110.053 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 6.9 tttp -89.28 -15.87 32.52 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.938 -1.101 . . . . 0.0 112.136 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.444 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 18.9 mm-40 -106.33 22.26 16.06 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 120.529 -1.357 . . . . 0.0 112.098 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 19.4 tptt 74.24 75.77 0.12 Allowed 'General case' 0 N--CA 1.512 2.667 0 O-C-N 121.038 -1.039 . . . . 0.0 111.742 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.728 ' HE2' HD13 ' A' ' 23' ' ' LEU . 33.0 m-85 -135.42 -63.04 0.69 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.558 -0.714 . . . . 0.0 109.306 179.62 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.833 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -125.48 -172.99 2.72 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.485 -0.76 . . . . 0.0 109.198 179.165 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.443 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 8.4 t0 -131.24 102.91 6.19 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.057 -1.027 . . . . 0.0 110.524 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -59.41 -39.18 82.62 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.195 -0.941 . . . . 0.0 109.799 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 19.7 tp -59.5 -40.26 86.49 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.127 -0.983 . . . . 0.0 109.772 179.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.636 HD11 HD11 ' A' ' 103' ' ' LEU . 59.5 tp -71.05 -46.77 61.38 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.173 -0.954 . . . . 0.0 108.552 179.001 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 62.8 mt -60.24 -33.52 53.93 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.344 0 C-N-CA 119.406 -0.918 . . . . 0.0 109.047 178.356 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.67 -46.36 72.56 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.043 -1.035 . . . . 0.0 109.292 178.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.49 ' HD3' HD23 ' A' ' 106' ' ' LEU . 12.2 mttp -57.48 -40.81 79.39 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.092 -1.005 . . . . 0.0 110.146 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 3.0 m0 -60.77 -26.85 67.55 Favored 'General case' 0 N--CA 1.508 2.468 0 C-N-CA 119.188 -1.005 . . . . 0.0 110.668 179.104 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.56 -35.8 22.55 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 120.796 -1.19 . . . . 0.0 110.448 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -52.23 178.86 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.76 0 O-C-N 121.022 -1.049 . . . . 0.0 110.764 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -103.4 138.2 40.47 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.259 -0.9 . . . . 0.0 109.22 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 102.85 -27.49 19.98 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 109.948 -1.261 . . . . 0.0 109.948 -178.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.6 ' HB3' HD23 ' A' ' 103' ' ' LEU . 73.3 m-85 -92.32 58.78 3.31 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.885 -1.362 . . . . 0.0 109.808 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -85.56 -35.0 21.34 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.068 -1.02 . . . . 0.0 110.475 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.412 ' HB2' ' OG ' ' A' ' 155' ' ' SER . 0.0 OUTLIER -117.49 62.34 0.74 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.987 -1.071 . . . . 0.0 110.586 -179.827 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.636 HD11 HD11 ' A' ' 91' ' ' LEU . 0.9 OUTLIER -107.29 152.33 24.27 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.003 -1.06 . . . . 0.0 109.847 179.506 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.446 ' N ' HD12 ' A' ' 103' ' ' LEU . 26.8 p -113.75 -29.33 7.13 Favored 'General case' 0 N--CA 1.501 2.121 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -179.15 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.659 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.8 m -143.87 -168.12 2.77 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 120.109 -1.619 . . . . 0.0 110.019 179.315 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.512 HD21 ' HA ' ' A' ' 91' ' ' LEU . 16.7 mt -96.35 -38.87 9.89 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.218 -0.926 . . . . 0.0 110.128 179.02 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -102.1 30.3 4.56 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 120.999 -1.063 . . . . 0.0 109.866 178.239 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.659 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.7 t -127.37 17.18 7.08 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.043 -1.035 . . . . 0.0 108.833 -179.545 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.469 HG23 ' O ' ' A' ' 108' ' ' CYS . 1.1 pt -158.99 38.91 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 O-C-N 120.957 -1.09 . . . . 0.0 110.24 -178.768 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.752 ' C ' HG23 ' A' ' 119' ' ' THR . 7.3 tt0 -103.75 101.22 11.04 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.868 -1.145 . . . . 0.0 111.201 -178.66 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.402 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 1.9 tttt -113.01 -179.61 3.69 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.353 -0.842 . . . . 0.0 110.022 179.368 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -144.77 164.57 30.62 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.173 -0.955 . . . . 0.0 110.324 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -115.61 39.52 2.97 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.102 -0.998 . . . . 0.0 110.246 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 62.7 m -160.13 -56.37 0.06 Allowed 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.176 -0.952 . . . . 0.0 110.735 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -116.94 -171.1 1.96 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.217 -0.927 . . . . 0.0 109.98 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -110.08 85.09 2.04 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.187 -0.946 . . . . 0.0 110.138 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -72.15 -113.75 0.05 OUTLIER Glycine 0 N--CA 1.493 2.438 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 1.8 m -146.39 103.67 3.71 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.24 -1.153 . . . . 0.0 110.454 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.752 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.1 m -119.07 172.84 7.28 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.133 -0.98 . . . . 0.0 110.135 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.438 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 49.6 t -103.87 154.93 19.05 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.26 -0.9 . . . . 0.0 109.207 178.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.967 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -75.34 -30.7 22.89 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 O-C-N 121.158 -0.964 . . . . 0.0 111.62 -179.033 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.484 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.3 p -58.58 -35.72 72.85 Favored 'General case' 0 N--CA 1.511 2.608 0 O-C-N 120.705 -1.247 . . . . 0.0 110.765 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.06 -33.24 64.81 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 120.937 -1.102 . . . . 0.0 109.964 178.75 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 58.3 t -81.29 124.28 80.78 Favored Pre-proline 0 N--CA 1.504 2.228 0 O-C-N 121.16 -0.963 . . . . 0.0 109.863 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -66.73 173.48 7.95 Favored 'Trans proline' 0 N--CA 1.488 1.163 0 O-C-N 123.187 1.098 . . . . 0.0 110.874 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.9 tpp85 -75.19 -37.66 61.1 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.292 -0.88 . . . . 0.0 110.421 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.89 -40.96 81.57 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.004 -1.06 . . . . 0.0 110.039 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -69.41 -41.8 75.91 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 119.312 -0.955 . . . . 0.0 109.249 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.604 ' O ' HG11 ' A' ' 140' ' ' VAL . 21.1 mt -65.39 -38.6 90.49 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.215 -0.928 . . . . 0.0 109.558 179.083 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -60.99 -39.88 91.34 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.132 -0.98 . . . . 0.0 109.877 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -60.37 -39.62 87.86 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.147 -0.97 . . . . 0.0 110.082 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -60.85 -41.01 95.0 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.244 -0.91 . . . . 0.0 109.941 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.3 -41.88 94.35 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.15 -0.969 . . . . 0.0 110.06 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 20.8 ttt85 -58.97 -38.44 79.09 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.088 -1.007 . . . . 0.0 109.908 179.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -57.87 -35.99 71.73 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.12 -0.987 . . . . 0.0 110.549 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -106.55 18.5 21.84 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.022 -1.049 . . . . 0.0 111.987 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 56.2 44.61 88.94 Favored Glycine 0 N--CA 1.497 2.729 0 O-C-N 120.612 -1.305 . . . . 0.0 110.327 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.7 t -133.75 -163.31 1.34 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.188 -1.184 . . . . 0.0 109.948 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 10.2 mp0 -139.64 144.43 37.66 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.155 -0.965 . . . . 0.0 110.344 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.604 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.6 p -132.1 161.4 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.284 -0.885 . . . . 0.0 110.018 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 38.4 t -166.78 100.07 0.56 Allowed 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.231 -0.918 . . . . 0.0 111.104 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.967 ' CD1' HD12 ' A' ' 121' ' ' ILE . 77.1 t80 -102.58 160.08 14.88 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.336 -0.852 . . . . 0.0 110.639 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 68.4 m80 -137.83 -61.63 0.62 Allowed 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 178.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.56 150.75 44.07 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.536 -0.727 . . . . 0.0 109.278 178.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' CYS . . . . . 0.422 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.4 p -93.56 154.82 17.66 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.016 -1.053 . . . . 0.0 110.986 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.7 p -73.62 -25.14 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.569 0 O-C-N 121.334 -0.854 . . . . 0.0 111.598 -179.463 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -49.44 -59.06 4.07 Favored 'General case' 0 N--CA 1.517 2.879 0 O-C-N 120.873 -1.142 . . . . 0.0 110.167 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.509 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.9 p -127.65 -164.39 1.36 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.192 -0.942 . . . . 0.0 110.369 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 149' ' ' GLY . . . . . 0.426 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.93 63.38 0.56 Allowed Glycine 0 N--CA 1.492 2.381 0 N-CA-C 107.936 -2.066 . . . . 0.0 107.936 178.422 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 32.8 t -101.83 142.18 33.54 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.332 -1.099 . . . . 0.0 109.797 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 9.3 ttt85 -100.0 46.32 0.96 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.262 -0.899 . . . . 0.0 109.638 179.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 76.38 96.16 0.17 Allowed Glycine 0 N--CA 1.486 2.011 0 N-CA-C 109.883 -1.287 . . . . 0.0 109.883 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.4 p -108.25 126.01 52.33 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.333 -1.098 . . . . 0.0 110.161 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -146.65 148.93 32.57 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.153 -0.967 . . . . 0.0 110.308 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' SER . . . . . 0.412 ' OG ' ' HB2' ' A' ' 102' ' ' LYS . 1.5 m -115.2 -54.14 2.57 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.291 -0.88 . . . . 0.0 110.695 -179.78 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 8.3 p -50.96 -37.63 45.76 Favored 'General case' 0 N--CA 1.513 2.702 0 O-C-N 121.002 -1.061 . . . . 0.0 111.017 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 . . . . . 0 N--CA 1.494 1.766 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.235 179.922 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.348 0 N-CA-C 109.614 -1.394 . . . . 0.0 109.614 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -131.27 62.78 0.64 Allowed Glycine 0 N--CA 1.493 2.46 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 3.2 m -141.34 85.44 11.84 Favored Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.191 -1.182 . . . . 0.0 110.266 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.31 -39.99 2.58 Favored 'Trans proline' 0 C--N 1.317 -1.085 0 O-C-N 123.376 1.198 . . . . 0.0 110.471 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 7.5 ttm-85 -135.75 40.31 2.76 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.2 -0.937 . . . . 0.0 110.219 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 75.8 mt -120.63 133.16 68.22 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 O-C-N 121.154 -0.966 . . . . 0.0 109.985 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -138.31 -59.86 0.62 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.257 -0.902 . . . . 0.0 110.227 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 33.1 m -134.62 161.44 35.11 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.174 -0.954 . . . . 0.0 110.234 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.28 149.03 42.47 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.198 -0.939 . . . . 0.0 110.105 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.26 51.1 1.96 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.11 -0.994 . . . . 0.0 110.269 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 88.6 p -133.84 39.63 3.14 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.185 -0.947 . . . . 0.0 110.407 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -134.04 84.41 42.95 Favored Pre-proline 0 N--CA 1.494 1.728 0 O-C-N 121.19 -0.943 . . . . 0.0 110.121 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.86 158.5 49.96 Favored 'Trans proline' 0 C--N 1.317 -1.094 0 O-C-N 123.373 1.196 . . . . 0.0 110.692 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.724 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -86.59 148.6 46.79 Favored Pre-proline 0 N--CA 1.504 2.233 0 O-C-N 121.391 -0.818 . . . . 0.0 109.63 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.407 ' HG2' HD13 ' A' ' 77' ' ' LEU . 44.1 Cg_endo -70.14 162.83 40.82 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.411 1.216 . . . . 0.0 110.919 -179.527 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -47.62 -32.34 5.45 Favored 'General case' 0 N--CA 1.515 2.796 0 O-C-N 121.431 -0.793 . . . . 0.0 111.596 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.99 -34.73 39.11 Favored Glycine 0 N--CA 1.5 2.918 0 O-C-N 121.039 -1.038 . . . . 0.0 110.514 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.7 t80 -55.84 -32.29 63.47 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.061 -1.258 . . . . 0.0 110.695 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -54.32 -38.65 66.24 Favored 'General case' 0 N--CA 1.513 2.71 0 O-C-N 120.913 -1.117 . . . . 0.0 110.147 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.22 -36.14 72.73 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.209 -0.932 . . . . 0.0 110.164 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.641 ' O ' HD12 ' A' ' 23' ' ' LEU . 3.0 pt -115.34 36.12 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 O-C-N 121.204 -0.935 . . . . 0.0 110.373 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.434 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.3 OUTLIER -84.06 -43.41 0.77 Allowed Pre-proline 0 N--CA 1.509 2.519 0 O-C-N 121.073 -1.017 . . . . 0.0 113.217 -179.187 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.434 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.2 Cg_endo -75.58 -36.39 2.25 Favored 'Trans proline' 0 N--CA 1.486 1.083 0 O-C-N 122.62 0.8 . . . . 0.0 111.634 -178.243 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.872 HG21 ' CE2' ' A' ' 62' ' ' TYR . 85.5 m -61.54 -46.65 89.04 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 120.938 -1.101 . . . . 0.0 109.756 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.692 HD13 ' HE2' ' A' ' 86' ' ' TYR . 4.9 mt -61.81 -39.22 90.99 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.48 -0.888 . . . . 0.0 109.632 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.421 ' O ' HD12 ' A' ' 28' ' ' ILE . 6.5 m -57.2 -35.7 69.95 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.137 -0.977 . . . . 0.0 110.295 179.555 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -57.63 -37.95 74.18 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.068 -1.02 . . . . 0.0 110.248 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.608 ' CD2' HD22 ' A' ' 55' ' ' LEU . 14.2 m-85 -59.0 -38.53 79.43 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.126 -0.984 . . . . 0.0 110.391 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -58.31 -39.36 79.17 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.175 -0.953 . . . . 0.0 110.309 -179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.437 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.4 mp -67.97 -41.19 84.41 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.279 0 C-N-CA 119.225 -0.99 . . . . 0.0 108.734 179.284 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.424 ' HB3' HD11 ' A' ' 55' ' ' LEU . 0.5 OUTLIER -66.74 -49.03 67.3 Favored 'General case' 0 N--CA 1.506 2.329 0 C-N-CA 119.177 -1.009 . . . . 0.0 108.341 178.565 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.085 HD11 HG23 ' A' ' 52' ' ' ILE . 4.3 tp -63.1 -36.21 82.82 Favored 'General case' 0 N--CA 1.508 2.434 0 C-N-CA 119.39 -0.924 . . . . 0.0 108.921 178.289 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.7 -38.03 74.51 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.117 -0.989 . . . . 0.0 110.298 179.618 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -64.56 -50.55 66.85 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.094 -1.004 . . . . 0.0 109.728 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.482 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -70.78 -36.57 73.12 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 119.202 -0.999 . . . . 0.0 109.48 179.051 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -72.2 -30.83 65.33 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.127 -0.983 . . . . 0.0 110.281 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.8 mmtt -95.11 -32.72 12.96 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 120.952 -1.093 . . . . 0.0 111.12 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.405 ' CG ' ' NE2' ' A' ' 48' ' ' GLN . 8.6 t0 -61.21 -39.34 89.86 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.02 -1.05 . . . . 0.0 109.994 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.3 tttt -56.89 -39.06 73.69 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.116 -0.99 . . . . 0.0 110.263 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.2 p -68.42 178.11 2.12 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.228 -0.92 . . . . 0.0 109.683 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.85 -71.01 0.08 Allowed 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.175 -0.953 . . . . 0.0 110.552 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -116.97 124.29 49.01 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.954 -1.091 . . . . 0.0 110.06 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.4 HD23 ' N ' ' A' ' 41' ' ' LEU . 0.6 OUTLIER -136.0 64.55 1.56 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.197 -0.94 . . . . 0.0 110.357 -179.901 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -115.19 -56.18 2.39 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.134 -0.979 . . . . 0.0 110.256 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -122.26 173.63 7.49 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.227 -0.921 . . . . 0.0 110.266 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 32.8 tptt 52.82 62.93 2.44 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.134 -0.979 . . . . 0.0 110.78 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.39 -57.02 2.32 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.179 -0.951 . . . . 0.0 110.07 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.406 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 15.4 m120 -58.4 -41.79 85.71 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.235 -0.916 . . . . 0.0 109.624 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -62.25 -37.4 85.29 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.297 -0.877 . . . . 0.0 109.988 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.405 ' NE2' ' CG ' ' A' ' 36' ' ' ASP . 2.0 tt0 -66.04 -43.2 88.21 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.12 -0.988 . . . . 0.0 109.558 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.422 HD23 ' HA ' ' A' ' 49' ' ' LEU . 43.6 mt -64.47 -34.01 77.21 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.258 -0.901 . . . . 0.0 110.321 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.498 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 46.9 m0 -57.76 -40.73 80.45 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 120.929 -1.107 . . . . 0.0 109.724 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -59.73 -35.05 73.77 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.359 -0.937 . . . . 0.0 109.957 179.049 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 1.085 HG23 HD11 ' A' ' 30' ' ' LEU . 18.3 mt -72.04 -57.24 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.161 0 O-C-N 121.046 -1.034 . . . . 0.0 109.121 179.229 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 ptm -61.58 -26.9 68.26 Favored 'General case' 0 N--CA 1.507 2.421 0 C-N-CA 118.53 -1.268 . . . . 0.0 110.06 178.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -73.49 -39.78 64.6 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 120.723 -1.235 . . . . 0.0 108.708 177.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.608 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.0 mt -53.38 -30.5 40.16 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.087 -1.008 . . . . 0.0 110.303 178.776 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.48 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 15.9 t60 -57.73 -39.92 78.42 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.943 -1.098 . . . . 0.0 110.111 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.413 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 6.8 m170 -60.51 -46.95 88.25 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.172 -0.955 . . . . 0.0 109.442 179.23 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -61.17 -37.38 82.72 Favored 'General case' 0 N--CA 1.505 2.3 0 C-N-CA 119.463 -0.895 . . . . 0.0 109.57 179.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.447 ' HD3' ' CD1' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -67.16 -48.35 68.25 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.097 -1.002 . . . . 0.0 109.31 179.176 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.2 p -61.68 -38.46 87.87 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.185 -0.947 . . . . 0.0 109.383 179.191 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -37.71 88.5 Favored 'General case' 0 N--CA 1.507 2.401 0 C-N-CA 119.261 -0.975 . . . . 0.0 109.464 179.176 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.872 ' CE2' HG21 ' A' ' 22' ' ' THR . 42.2 t80 -61.1 -48.69 80.49 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.118 -0.989 . . . . 0.0 109.454 179.528 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.515 HD12 ' HB2' ' A' ' 87' ' ' ALA . 84.0 mt -76.25 -43.25 37.21 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 O-C-N 121.189 -0.944 . . . . 0.0 108.854 179.09 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.437 ' CE1' HG23 ' A' ' 92' ' ' ILE . 40.7 t80 -59.75 -24.94 64.46 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.408 -0.808 . . . . 0.0 110.39 178.723 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.417 HG23 ' HD3' ' A' ' 69' ' ' LYS . 85.5 m -88.35 -34.99 17.42 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.692 -1.255 . . . . 0.0 110.441 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.566 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.6 pp -82.88 -32.95 27.11 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 120.806 -1.184 . . . . 0.0 112.025 -179.185 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.506 ' N ' HD12 ' A' ' 66' ' ' LEU . 33.3 t80 -86.45 -37.16 18.59 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 120.714 -1.241 . . . . 0.0 111.835 -179.317 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.404 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 16.8 m-85 -93.22 -19.58 21.29 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 120.897 -1.127 . . . . 0.0 113.086 -178.116 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.417 ' HD3' HG23 ' A' ' 65' ' ' THR . 15.5 mtpt -116.54 -58.6 2.07 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.518 -1.364 . . . . 0.0 110.97 -179.543 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.406 ' HB2' ' HA ' ' A' ' 66' ' ' LEU . 0.8 OUTLIER -68.67 -29.21 67.63 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.082 -1.011 . . . . 0.0 110.873 -179.54 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.6 tttt 58.53 42.84 20.22 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.796 -1.19 . . . . 0.0 109.957 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.72 34.32 4.05 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.447 -0.783 . . . . 0.0 109.949 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.781 HG13 HD23 ' A' ' 77' ' ' LEU . 14.1 tt -153.41 162.41 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.156 -0.965 . . . . 0.0 109.728 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 49.7 m -107.93 148.35 29.76 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.056 -1.027 . . . . 0.0 110.406 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.0 ttmm -46.81 -32.34 3.63 Favored 'General case' 0 N--CA 1.514 2.763 0 O-C-N 121.262 -0.898 . . . . 0.0 111.417 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -62.27 -51.15 68.86 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 120.976 -1.078 . . . . 0.0 109.29 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.781 HD23 HG13 ' A' ' 73' ' ' ILE . 35.0 tp -65.94 -43.84 86.85 Favored 'General case' 0 N--CA 1.506 2.351 0 C-N-CA 119.202 -0.999 . . . . 0.0 108.528 178.868 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.418 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 19.3 t80 -60.73 -39.94 90.53 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.279 -0.888 . . . . 0.0 109.335 179.1 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -71.62 -42.22 67.91 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.11 -0.994 . . . . 0.0 108.823 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.724 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 81.7 t90 -56.76 -36.99 70.44 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 121.301 -0.874 . . . . 0.0 109.687 179.008 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.701 HD22 ' CD2' ' A' ' 86' ' ' TYR . 51.9 mt -68.85 -47.28 66.36 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.22 -0.925 . . . . 0.0 109.122 179.156 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 37.0 mm -57.77 -33.3 45.02 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.535 0 O-C-N 121.258 -0.901 . . . . 0.0 110.032 179.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.6 tmtt? -89.32 -11.77 42.47 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.965 -1.084 . . . . 0.0 112.48 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.449 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 71.5 mm-40 -108.52 22.68 15.6 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 120.475 -1.39 . . . . 0.0 112.206 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 15.8 tttt 74.96 73.99 0.1 Allowed 'General case' 0 N--CA 1.512 2.672 0 O-C-N 121.102 -0.998 . . . . 0.0 111.799 179.113 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.701 ' CD2' HD22 ' A' ' 81' ' ' LEU . 34.1 m-85 -134.54 -62.51 0.74 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.449 -0.782 . . . . 0.0 109.196 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.515 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -132.59 160.85 35.42 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.402 -0.811 . . . . 0.0 109.257 179.038 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.48 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.4 t70 -105.65 119.1 38.27 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.047 -1.033 . . . . 0.0 110.421 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.1 mmtt -60.87 -38.08 84.36 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 119.478 -0.889 . . . . 0.0 109.825 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.467 HD12 ' HA ' ' A' ' 90' ' ' LEU . 8.3 tp -60.29 -37.93 82.02 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.096 -1.003 . . . . 0.0 109.707 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.684 HD12 ' CZ3' ' A' ' 95' ' ' TRP . 0.2 OUTLIER -65.81 -55.82 15.15 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.096 -1.003 . . . . 0.0 108.895 179.21 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.437 HG23 ' CE1' ' A' ' 64' ' ' TYR . 39.6 mt -61.75 -36.02 71.11 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.475 0 C-N-CA 119.342 -0.943 . . . . 0.0 108.888 178.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.92 -39.95 91.02 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.09 -1.006 . . . . 0.0 109.354 178.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.427 ' HD2' ' CE1' ' A' ' 100' ' ' TYR . 10.8 mmtm -58.68 -44.25 90.2 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 121.154 -0.966 . . . . 0.0 109.501 179.233 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.684 ' CZ3' HD12 ' A' ' 91' ' ' LEU . 2.6 m0 -62.58 -34.97 78.04 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.192 -0.942 . . . . 0.0 110.153 179.378 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.41 ' NH1' ' OH ' ' A' ' 64' ' ' TYR . 0.3 OUTLIER -81.25 -31.9 33.54 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.02 -1.05 . . . . 0.0 110.79 179.757 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 23.6 mmtt -53.91 -176.73 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.711 0 O-C-N 120.899 -1.126 . . . . 0.0 110.582 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -103.38 134.52 46.62 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.241 -0.912 . . . . 0.0 109.808 179.201 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.42 14.2 45.36 Favored Glycine 0 N--CA 1.493 2.494 0 C-N-CA 120.2 -1.0 . . . . 0.0 110.863 -179.437 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.526 ' HB3' HD23 ' A' ' 103' ' ' LEU . 51.3 m-85 -123.03 72.49 1.1 Allowed 'General case' 0 N--CA 1.493 1.676 0 CA-C-N 119.43 1.615 . . . . 0.0 109.983 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.12 -36.46 12.65 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.159 -0.963 . . . . 0.0 110.468 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.77 77.21 1.74 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.006 -1.059 . . . . 0.0 110.565 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.526 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.0 OUTLIER -120.85 150.54 40.88 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.036 -1.04 . . . . 0.0 110.059 179.632 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.413 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.7 p -111.91 -32.59 6.55 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.173 -0.954 . . . . 0.0 112.98 -179.341 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.628 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.0 m -142.05 -168.5 2.71 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.204 -1.56 . . . . 0.0 110.156 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 62.1 mt -96.73 -38.46 9.9 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.252 -0.905 . . . . 0.0 110.122 178.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 22.9 ttt-85 -101.27 28.9 5.05 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 120.952 -1.093 . . . . 0.0 109.943 178.044 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.628 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.308 1.8 t -127.05 17.29 7.24 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.065 -1.022 . . . . 0.0 108.623 -179.801 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.47 HG23 ' C ' ' A' ' 108' ' ' CYS . 2.0 pt -156.35 34.38 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.062 0 O-C-N 120.806 -1.184 . . . . 0.0 111.05 -178.302 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.587 ' C ' HG23 ' A' ' 119' ' ' THR . 1.6 mt-30 -152.37 150.12 29.36 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.711 -1.243 . . . . 0.0 111.147 -178.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.428 ' HE3' ' OG1' ' A' ' 119' ' ' THR . 0.2 OUTLIER -101.29 -178.83 3.85 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.282 -0.886 . . . . 0.0 110.334 179.836 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -144.3 -59.44 0.38 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.27 -0.894 . . . . 0.0 110.182 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -115.37 -173.06 2.26 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.138 -0.976 . . . . 0.0 110.149 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 3.6 m -124.81 48.14 2.03 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.143 -0.973 . . . . 0.0 110.303 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 47.4 m-20 -145.56 -65.72 0.31 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.207 -0.933 . . . . 0.0 110.306 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -116.73 139.52 50.47 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.249 -0.907 . . . . 0.0 110.183 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 66.81 123.4 0.02 OUTLIER Glycine 0 N--CA 1.492 2.416 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.4 m -143.29 95.6 2.78 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.269 -1.136 . . . . 0.0 110.235 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.587 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.2 OUTLIER 56.68 171.94 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.086 -1.008 . . . . 0.0 110.373 -179.925 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 42.7 t -86.9 153.58 21.5 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.12 -0.988 . . . . 0.0 108.661 178.765 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.948 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -72.5 -30.89 35.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.378 0 O-C-N 121.079 -1.013 . . . . 0.0 111.627 -178.695 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.49 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.8 p -60.0 -35.73 75.67 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 120.593 -1.317 . . . . 0.0 110.396 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 7.0 ttt-85 -57.2 -32.85 66.91 Favored 'General case' 0 N--CA 1.512 2.626 0 O-C-N 121.077 -1.014 . . . . 0.0 109.925 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 61.9 t -79.99 124.4 83.07 Favored Pre-proline 0 N--CA 1.506 2.333 0 O-C-N 121.056 -1.028 . . . . 0.0 109.913 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -67.56 -179.73 2.12 Favored 'Trans proline' 0 N--CA 1.488 1.153 0 O-C-N 123.112 1.059 . . . . 0.0 110.87 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.19 -37.85 61.02 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.22 -0.925 . . . . 0.0 110.419 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.97 -40.83 81.57 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.025 -1.047 . . . . 0.0 110.092 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 22.7 tp60 -69.19 -41.54 77.01 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.339 -0.944 . . . . 0.0 109.238 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.608 HD11 HD11 ' A' ' 121' ' ' ILE . 9.4 mt -66.01 -38.73 89.19 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 121.21 -0.931 . . . . 0.0 109.517 179.023 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -60.61 -38.81 85.93 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.184 -0.947 . . . . 0.0 109.907 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -58.76 -37.9 77.27 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.141 -0.974 . . . . 0.0 110.382 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -64.35 -40.47 95.93 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.094 -1.004 . . . . 0.0 110.098 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.404 ' HA ' HG23 ' A' ' 138' ' ' THR . . . -66.48 -41.33 89.13 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.067 -1.021 . . . . 0.0 109.675 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 11.3 mmp_? -63.89 -34.81 78.8 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.227 -0.921 . . . . 0.0 110.254 179.488 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 9.9 mmmt -74.41 -31.81 62.46 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 120.958 -1.089 . . . . 0.0 110.956 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 29.2 mttm -99.76 22.28 11.25 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 120.882 -1.136 . . . . 0.0 111.804 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.0 46.42 55.71 Favored Glycine 0 N--CA 1.499 2.884 0 O-C-N 120.607 -1.308 . . . . 0.0 110.743 179.23 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.404 HG23 ' HA ' ' A' ' 133' ' ' ALA . 9.7 t -145.68 -163.79 1.8 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.145 -1.209 . . . . 0.0 110.32 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 12.6 mt-30 -131.85 171.44 13.54 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.132 -0.98 . . . . 0.0 110.213 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.7 p -159.18 160.96 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.209 -0.932 . . . . 0.0 110.859 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 30.3 t -168.63 96.87 0.39 Allowed 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.319 -0.863 . . . . 0.0 110.924 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.948 ' CD1' HD12 ' A' ' 121' ' ' ILE . 73.4 t80 -97.16 159.6 14.82 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.202 -0.936 . . . . 0.0 110.518 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 17.7 m170 -138.3 -61.24 0.6 Allowed 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 178.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -139.48 151.13 45.94 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.526 -0.734 . . . . 0.0 109.264 178.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 145' ' ' CYS . . . . . 0.416 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.0 p -92.52 155.71 17.63 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.065 -1.022 . . . . 0.0 111.024 -179.751 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.4 p -74.78 -23.09 17.51 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.435 -0.79 . . . . 0.0 111.7 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -51.72 -57.24 9.8 Favored 'General case' 0 N--CA 1.514 2.751 0 O-C-N 120.81 -1.181 . . . . 0.0 110.002 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.498 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.2 p -128.91 -164.15 1.36 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.281 -0.887 . . . . 0.0 110.385 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -102.11 62.43 0.51 Allowed Glycine 0 N--CA 1.493 2.459 0 N-CA-C 107.81 -2.116 . . . . 0.0 107.81 178.225 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 21.6 t -99.54 146.01 26.88 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.32 -1.106 . . . . 0.0 109.792 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 11.1 mtt85 -100.92 44.14 1.03 Allowed 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.219 -0.926 . . . . 0.0 109.689 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 76.67 97.18 0.17 Allowed Glycine 0 N--CA 1.486 2.033 0 N-CA-C 109.846 -1.302 . . . . 0.0 109.846 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.4 p -110.39 125.78 53.58 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.344 -1.092 . . . . 0.0 110.202 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -142.16 137.34 30.8 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.13 -0.981 . . . . 0.0 109.949 -179.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 1.1 m -105.27 42.07 1.28 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.137 -0.977 . . . . 0.0 109.689 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 2.3 m -157.43 -56.14 0.08 Allowed 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.246 -0.909 . . . . 0.0 110.634 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 . . . . . 0 N--CA 1.495 1.821 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.211 179.954 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.374 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -93.07 179.21 39.37 Favored Glycine 0 N--CA 1.494 2.5 0 N-CA-C 109.556 -1.417 . . . . 0.0 109.556 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.9 t -124.24 148.79 58.9 Favored Pre-proline 0 N--CA 1.495 1.779 0 O-C-N 121.246 -1.149 . . . . 0.0 110.177 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -72.89 120.9 6.91 Favored 'Trans proline' 0 C--N 1.318 -1.056 0 O-C-N 123.35 1.184 . . . . 0.0 110.506 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.86 119.27 9.01 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.177 -0.952 . . . . 0.0 110.36 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.441 HG23 ' O ' ' A' ' 4' ' ' ILE . 4.0 tt -155.19 57.4 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.161 -0.962 . . . . 0.0 110.645 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.5 mttm -116.29 -58.27 2.11 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.188 -0.945 . . . . 0.0 110.289 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 11.2 p -118.73 96.23 5.18 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.148 -0.97 . . . . 0.0 110.335 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 18.3 ttm-85 -122.0 -57.09 1.81 Allowed 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.174 -0.954 . . . . 0.0 110.344 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -121.38 154.67 36.18 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.151 -0.968 . . . . 0.0 110.228 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.5 m -130.05 -178.94 4.95 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.273 -0.892 . . . . 0.0 110.236 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.9 79.65 32.6 Favored Pre-proline 0 N--CA 1.494 1.739 0 O-C-N 121.212 -0.93 . . . . 0.0 110.209 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.482 ' O ' ' HB3' ' A' ' 12' ' ' ALA . 46.9 Cg_endo -73.01 158.05 50.17 Favored 'Trans proline' 0 C--N 1.317 -1.112 0 O-C-N 123.369 1.194 . . . . 0.0 110.588 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.758 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . 61.69 148.74 0.09 OUTLIER Pre-proline 0 N--CA 1.503 2.222 0 O-C-N 121.408 -0.808 . . . . 0.0 110.636 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.12 163.95 37.15 Favored 'Trans proline' 0 C--N 1.318 -1.059 0 O-C-N 123.307 1.162 . . . . 0.0 110.652 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -48.46 -32.23 7.48 Favored 'General case' 0 N--CA 1.515 2.801 0 O-C-N 121.483 -0.761 . . . . 0.0 111.375 -179.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.86 -34.12 50.84 Favored Glycine 0 N--CA 1.498 2.779 0 O-C-N 121.018 -1.051 . . . . 0.0 110.502 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.43 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 28.6 t80 -54.63 -32.55 59.16 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 120.999 -1.295 . . . . 0.0 110.76 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 -54.18 -37.9 65.0 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 121.006 -1.059 . . . . 0.0 110.18 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.0 mptt -58.63 -36.52 74.21 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.179 -0.951 . . . . 0.0 110.25 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.718 ' O ' HD12 ' A' ' 23' ' ' LEU . 3.3 pt -117.06 35.69 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.152 -0.968 . . . . 0.0 110.514 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.421 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 6.6 tmtt? -84.64 -43.21 0.71 Allowed Pre-proline 0 N--CA 1.508 2.451 0 O-C-N 121.093 -1.004 . . . . 0.0 113.265 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.421 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.8 Cg_endo -76.44 -38.01 1.17 Allowed 'Trans proline' 0 N--CA 1.487 1.134 0 O-C-N 122.603 0.791 . . . . 0.0 111.582 -178.335 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.781 HG21 ' CE2' ' A' ' 62' ' ' TYR . 86.0 m -59.73 -43.18 94.3 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 120.86 -1.15 . . . . 0.0 109.992 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.718 HD12 ' O ' ' A' ' 19' ' ' ILE . 1.6 mt -63.12 -37.98 89.35 Favored 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 119.487 -0.885 . . . . 0.0 109.772 179.432 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.439 ' O ' HD12 ' A' ' 28' ' ' ILE . 0.6 OUTLIER -57.6 -36.63 72.01 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.091 -1.005 . . . . 0.0 110.394 179.652 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -57.26 -37.38 72.25 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.091 -1.005 . . . . 0.0 110.256 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.752 ' CD2' HD22 ' A' ' 55' ' ' LEU . 13.3 m-85 -58.42 -38.98 78.54 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.091 -1.006 . . . . 0.0 110.556 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -60.84 -38.91 87.11 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.233 -0.917 . . . . 0.0 110.864 -179.07 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.439 HD12 ' O ' ' A' ' 24' ' ' THR . 3.2 mp -65.71 -39.23 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.415 0 C-N-CA 119.119 -1.032 . . . . 0.0 109.591 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.8 tt0 -72.16 -46.0 58.19 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.034 -1.041 . . . . 0.0 108.831 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.698 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -65.29 -33.76 76.75 Favored 'General case' 0 N--CA 1.508 2.44 0 C-N-CA 119.27 -0.972 . . . . 0.0 108.902 178.231 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -57.17 -39.51 75.46 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 120.994 -1.066 . . . . 0.0 110.011 179.349 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.83 -49.86 73.25 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.25 -0.98 . . . . 0.0 109.605 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.601 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -69.33 -39.39 78.23 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.18 -0.95 . . . . 0.0 109.352 179.202 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.642 ' HG3' HD23 ' A' ' 30' ' ' LEU . 10.8 mm-40 -69.73 -30.8 68.5 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.231 -0.918 . . . . 0.0 110.446 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -94.79 -31.24 13.84 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.85 -1.156 . . . . 0.0 111.261 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -56.68 -36.72 69.93 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 120.873 -1.142 . . . . 0.0 110.282 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.3 ttmt -53.79 -36.74 62.77 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 121.047 -1.033 . . . . 0.0 110.528 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.5 t -106.41 39.49 1.81 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.043 -1.036 . . . . 0.0 110.118 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -150.52 -58.84 0.18 Allowed 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.211 -0.931 . . . . 0.0 110.298 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -122.63 100.1 6.75 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.232 -0.918 . . . . 0.0 109.978 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.5 tt -117.71 69.43 0.77 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.123 -0.985 . . . . 0.0 110.076 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -112.13 -54.33 2.63 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.204 -0.935 . . . . 0.0 110.262 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -135.55 159.3 42.04 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.139 -0.976 . . . . 0.0 110.291 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 52.2 mmtt 52.87 95.26 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.095 -1.003 . . . . 0.0 110.935 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -121.53 -58.45 1.76 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.21 -0.931 . . . . 0.0 110.222 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -55.47 -38.41 69.06 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.202 -0.936 . . . . 0.0 109.821 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -58.0 -34.67 70.25 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.229 -0.919 . . . . 0.0 110.166 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -57.46 -41.02 79.77 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 120.948 -1.095 . . . . 0.0 109.953 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 93.4 mt -64.71 -38.62 91.6 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.254 -0.904 . . . . 0.0 109.885 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.502 ' O ' ' HE3' ' A' ' 53' ' ' MET . 39.9 m0 -58.18 -32.13 67.95 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.151 -0.968 . . . . 0.0 109.865 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -69.37 -33.33 72.9 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.643 -1.286 . . . . 0.0 109.624 178.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.698 HG23 ' CG ' ' A' ' 30' ' ' LEU . 68.4 mt -72.54 -51.1 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.298 0 O-C-N 120.904 -1.122 . . . . 0.0 109.39 179.305 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.502 ' HE3' ' O ' ' A' ' 50' ' ' TRP . 0.0 OUTLIER -61.02 -33.31 73.07 Favored 'General case' 0 N--CA 1.508 2.464 0 C-N-CA 118.799 -1.16 . . . . 0.0 109.648 179.07 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -62.48 -38.16 88.78 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.93 -1.106 . . . . 0.0 109.608 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.752 HD22 ' CD2' ' A' ' 26' ' ' PHE . 19.6 mt -53.79 -35.16 61.06 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.113 -0.992 . . . . 0.0 110.017 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.466 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 38.5 t60 -56.19 -38.81 71.47 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 120.98 -1.075 . . . . 0.0 109.881 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.428 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 10.4 m170 -61.42 -50.39 73.0 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.224 -0.923 . . . . 0.0 109.051 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.8 tt0 -60.93 -38.7 86.72 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 119.468 -0.893 . . . . 0.0 109.271 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.415 ' HG3' ' CE2' ' A' ' 26' ' ' PHE . 5.2 mtt180 -62.23 -48.06 81.65 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.164 -0.96 . . . . 0.0 109.33 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 94.6 p -65.44 -39.09 91.65 Favored 'General case' 0 N--CA 1.503 2.204 0 C-N-CA 119.306 -0.958 . . . . 0.0 109.159 179.107 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 34.9 ttt85 -65.52 -39.82 92.24 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.111 -0.993 . . . . 0.0 109.134 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.781 ' CE2' HG21 ' A' ' 22' ' ' THR . 28.4 t80 -62.46 -50.41 71.59 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.119 -0.988 . . . . 0.0 109.344 179.373 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.563 HD12 ' HB2' ' A' ' 87' ' ' ALA . 91.6 mt -71.8 -39.49 68.15 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 O-C-N 121.221 -0.924 . . . . 0.0 109.255 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.454 ' HD2' HD13 ' A' ' 92' ' ' ILE . 13.5 t80 -65.15 -42.58 93.63 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.214 -0.929 . . . . 0.0 109.036 179.216 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 95.6 m -61.67 -41.45 97.57 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.134 -0.979 . . . . 0.0 110.389 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.554 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.17 -32.28 26.69 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 120.874 -1.141 . . . . 0.0 112.391 -178.872 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.451 ' N ' HD12 ' A' ' 66' ' ' LEU . 40.3 t80 -86.27 -32.24 21.22 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 120.755 -1.216 . . . . 0.0 111.714 -179.469 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -98.01 -19.42 18.02 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 120.806 -1.184 . . . . 0.0 112.487 -178.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.4 mttm -119.4 -58.5 1.91 Allowed 'General case' 0 N--CA 1.503 2.207 0 O-C-N 120.509 -1.369 . . . . 0.0 110.621 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 23.9 ttt-85 -65.14 -31.26 72.37 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.112 -0.992 . . . . 0.0 110.878 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.1 tptt 57.44 42.18 25.01 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.897 -1.127 . . . . 0.0 110.036 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.88 35.02 3.68 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.356 -0.84 . . . . 0.0 109.817 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.785 HG13 HD23 ' A' ' 77' ' ' LEU . 13.8 tt -154.14 162.53 2.0 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.235 -0.915 . . . . 0.0 109.84 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.1 t -108.85 147.44 32.11 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.13 -0.981 . . . . 0.0 110.299 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.7 ttmt -45.79 -31.96 2.31 Favored 'General case' 0 N--CA 1.516 2.837 0 O-C-N 121.289 -0.882 . . . . 0.0 111.604 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -62.35 -51.23 68.46 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 120.956 -1.09 . . . . 0.0 109.234 179.526 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.785 HD23 HG13 ' A' ' 73' ' ' ILE . 46.5 tp -66.25 -42.96 87.83 Favored 'General case' 0 N--CA 1.506 2.334 0 C-N-CA 119.274 -0.971 . . . . 0.0 108.52 178.683 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.547 ' HA ' HD12 ' A' ' 81' ' ' LEU . 17.0 t80 -61.41 -39.71 91.75 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 121.341 -0.849 . . . . 0.0 109.3 179.229 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -71.42 -42.45 68.27 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.059 -1.026 . . . . 0.0 108.724 178.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.758 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 80.9 t90 -56.34 -36.42 68.74 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.307 -0.871 . . . . 0.0 109.725 178.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.547 HD12 ' HA ' ' A' ' 78' ' ' TYR . 18.3 mt -69.04 -49.95 53.0 Favored 'General case' 0 N--CA 1.505 2.299 0 C-N-CA 119.393 -0.923 . . . . 0.0 108.916 179.029 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.1 mm -56.59 -32.86 38.28 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.584 0 O-C-N 121.202 -0.937 . . . . 0.0 109.954 179.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.9 mtpp -89.34 -14.89 34.64 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 120.877 -1.139 . . . . 0.0 112.208 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.441 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 5.6 mm-40 -105.73 22.36 15.68 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.593 -1.317 . . . . 0.0 112.069 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt 75.43 71.59 0.09 Allowed 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.041 -1.037 . . . . 0.0 111.916 179.242 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.636 ' HE2' HD13 ' A' ' 23' ' ' LEU . 32.6 m-85 -133.63 -62.77 0.77 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.488 -0.757 . . . . 0.0 108.977 179.272 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.563 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -134.03 163.02 30.48 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.451 -0.781 . . . . 0.0 109.202 179.215 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.466 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 16.4 t0 -112.19 111.53 22.49 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.088 -1.008 . . . . 0.0 110.482 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 28.0 mttt -57.94 -37.0 73.33 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.245 -0.909 . . . . 0.0 110.114 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.443 HD23 HD13 ' A' ' 106' ' ' LEU . 18.2 tp -57.88 -37.46 73.99 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.091 -1.006 . . . . 0.0 110.192 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.546 ' HA ' HD21 ' A' ' 106' ' ' LEU . 64.2 tp -72.79 -47.62 45.05 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.052 -1.03 . . . . 0.0 108.512 179.065 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.454 HD13 ' HD2' ' A' ' 64' ' ' TYR . 54.5 mt -60.55 -36.55 70.74 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.38 0 O-C-N 121.184 -0.947 . . . . 0.0 108.641 178.291 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.74 -39.27 84.23 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.086 -1.009 . . . . 0.0 109.275 178.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.408 ' HB3' ' CD2' ' A' ' 103' ' ' LEU . 8.7 mmtt -58.24 -42.65 86.82 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.062 -1.024 . . . . 0.0 109.434 179.344 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 6.9 m0 -68.29 -38.64 81.87 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.28 -0.888 . . . . 0.0 109.875 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.78 -31.94 67.13 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.225 -0.922 . . . . 0.0 110.476 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.0 mmtm -54.37 -176.56 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.671 0 O-C-N 120.927 -1.108 . . . . 0.0 110.498 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -104.76 134.24 48.24 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.184 -0.947 . . . . 0.0 109.823 179.274 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.69 10.19 55.64 Favored Glycine 0 N--CA 1.493 2.458 0 C-N-CA 120.19 -1.005 . . . . 0.0 111.129 -179.448 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -114.13 68.72 0.7 Allowed 'General case' 0 N--CA 1.495 1.808 0 CA-C-N 119.485 1.643 . . . . 0.0 110.044 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -90.22 -38.61 13.33 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.15 -0.969 . . . . 0.0 109.963 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.37 84.25 1.94 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.159 -0.963 . . . . 0.0 109.728 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.949 HD13 HD13 ' A' ' 109' ' ' ILE . 9.0 tp -125.86 137.13 53.73 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.373 -0.829 . . . . 0.0 109.881 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.428 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.6 p -111.37 -38.97 4.82 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.211 -0.931 . . . . 0.0 112.434 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.83 ' O ' HD11 ' A' ' 103' ' ' LEU . 5.9 m -138.75 -168.16 2.35 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 120.213 -1.554 . . . . 0.0 109.678 179.04 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.546 HD21 ' HA ' ' A' ' 91' ' ' LEU . 13.3 mt -97.99 -38.12 9.51 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 120.973 -1.079 . . . . 0.0 110.541 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 11.8 tpt85 -101.97 32.2 3.56 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 120.991 -1.068 . . . . 0.0 109.498 178.092 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.667 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.306 1.7 t -127.05 15.31 7.34 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.19 -0.944 . . . . 0.0 109.216 -179.289 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.949 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -158.26 36.91 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.333 0 O-C-N 120.842 -1.161 . . . . 0.0 110.658 -178.494 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.586 ' O ' HG23 ' A' ' 119' ' ' THR . 5.6 mm-40 -119.15 137.06 53.86 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 120.748 -1.22 . . . . 0.0 111.68 -178.381 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.558 ' HA ' ' HG1' ' A' ' 119' ' ' THR . 15.5 ptpt -137.62 -177.12 4.65 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.353 -0.842 . . . . 0.0 110.012 179.464 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -145.53 -59.32 0.33 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.126 -0.984 . . . . 0.0 110.421 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -120.11 -171.02 2.07 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.225 -0.922 . . . . 0.0 110.339 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 62.7 m -96.78 -36.89 10.49 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.216 -0.928 . . . . 0.0 110.682 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 55.9 t-20 -98.24 -43.29 7.03 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.935 -1.103 . . . . 0.0 110.44 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -113.63 88.63 2.89 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.17 -0.956 . . . . 0.0 110.363 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -142.35 169.77 25.31 Favored Glycine 0 N--CA 1.494 2.522 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.9 m -129.56 103.3 6.79 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.245 -1.15 . . . . 0.0 110.217 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.586 HG23 ' O ' ' A' ' 110' ' ' GLN . 5.4 m -141.92 166.0 25.93 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.296 -0.877 . . . . 0.0 110.316 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.441 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 45.8 t -82.44 154.02 25.37 Favored 'General case' 0 N--CA 1.5 2.067 0 C-N-CA 119.374 -0.93 . . . . 0.0 109.084 178.749 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.787 HD12 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -72.75 -37.16 54.68 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 O-C-N 121.082 -1.011 . . . . 0.0 110.796 -179.389 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.437 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 4.5 p -54.18 -32.74 56.36 Favored 'General case' 0 N--CA 1.512 2.671 0 O-C-N 120.727 -1.233 . . . . 0.0 111.021 -179.08 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.488 ' HG3' HG22 ' A' ' 109' ' ' ILE . 7.3 ttp85 -57.93 -34.06 69.46 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 120.909 -1.12 . . . . 0.0 109.641 178.35 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 62.0 t -81.42 125.09 79.68 Favored Pre-proline 0 N--CA 1.504 2.229 0 O-C-N 121.137 -0.977 . . . . 0.0 109.725 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.518 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.4 Cg_endo -65.77 172.87 7.61 Favored 'Trans proline' 0 N--CA 1.488 1.16 0 O-C-N 123.142 1.075 . . . . 0.0 110.772 179.604 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 2.0 tpt180 -75.07 -36.42 61.78 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.188 -0.945 . . . . 0.0 110.901 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.88 -44.01 91.06 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 120.943 -1.098 . . . . 0.0 109.985 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -65.27 -40.71 94.26 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.191 -0.943 . . . . 0.0 109.385 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.518 HD12 ' O ' ' A' ' 125' ' ' PRO . 1.4 mt -61.82 -40.85 96.7 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.199 -0.938 . . . . 0.0 109.757 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -58.18 -39.93 80.16 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.158 -0.964 . . . . 0.0 109.988 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -60.36 -36.8 78.86 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.19 -0.943 . . . . 0.0 110.056 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -62.75 -47.15 84.79 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.158 -0.964 . . . . 0.0 109.946 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.443 ' HA ' HG23 ' A' ' 138' ' ' THR . . . -63.29 -41.19 98.96 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.14 -0.975 . . . . 0.0 109.788 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 6.8 ttt85 -65.06 -32.59 74.38 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.226 -0.921 . . . . 0.0 110.378 179.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 31.7 mttt -81.78 -29.79 32.59 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 120.86 -1.15 . . . . 0.0 111.077 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 36.3 mttt -98.71 24.35 7.66 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 120.82 -1.175 . . . . 0.0 111.712 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.15 46.94 42.56 Favored Glycine 0 N--CA 1.5 2.951 0 O-C-N 120.772 -1.205 . . . . 0.0 111.119 179.223 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.443 HG23 ' HA ' ' A' ' 133' ' ' ALA . 9.3 t -148.35 -164.76 2.09 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.114 -1.227 . . . . 0.0 110.422 179.813 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' GLN . . . . . 0.408 ' HA ' ' HB1' ' A' ' 133' ' ' ALA . 58.6 mt-30 -132.65 159.57 39.22 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.185 -0.947 . . . . 0.0 110.283 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.8 p -147.34 161.01 8.3 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.227 -0.921 . . . . 0.0 110.24 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 25.5 t -170.57 83.51 0.1 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.188 -0.945 . . . . 0.0 111.167 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.787 ' CG ' HD12 ' A' ' 121' ' ' ILE . 52.0 t80 -95.02 159.07 15.19 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.139 -0.976 . . . . 0.0 110.263 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -135.81 -60.37 0.74 Allowed 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -138.71 151.9 47.54 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.401 -0.812 . . . . 0.0 109.518 179.118 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 26.5 p -93.6 156.1 16.92 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.157 -0.964 . . . . 0.0 110.891 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.8 p -74.55 -25.09 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 121.314 -0.866 . . . . 0.0 111.637 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 -50.88 -45.84 60.17 Favored 'General case' 0 N--CA 1.517 2.883 0 O-C-N 120.756 -1.215 . . . . 0.0 109.457 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.501 ' HB2' ' CE ' ' A' ' 53' ' ' MET . 29.1 p -143.43 177.52 8.39 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.348 -0.845 . . . . 0.0 110.537 179.507 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 149' ' ' GLY . . . . . 0.447 ' CA ' ' CE3' ' A' ' 50' ' ' TRP . . . -87.77 64.26 3.71 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 107.957 -2.057 . . . . 0.0 107.957 178.114 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 28.1 t -106.18 139.29 40.92 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.306 -1.114 . . . . 0.0 109.694 -179.093 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 31.1 mtt-85 -92.31 56.63 2.83 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.163 -0.961 . . . . 0.0 109.776 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 61.15 96.13 0.01 OUTLIER Glycine 0 N--CA 1.488 2.149 0 N-CA-C 109.764 -1.335 . . . . 0.0 109.764 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.8 p -105.13 129.21 53.58 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.288 -1.124 . . . . 0.0 110.4 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' ALA . . . . . 0.47 ' HB1' ' HD3' ' A' ' 125' ' ' PRO . . . -143.7 138.34 28.82 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.15 -0.968 . . . . 0.0 109.926 -179.81 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -103.03 -47.23 4.42 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.158 -0.964 . . . . 0.0 110.484 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 19.7 m -55.77 -39.81 71.74 Favored 'General case' 0 N--CA 1.512 2.646 0 O-C-N 121.142 -0.974 . . . . 0.0 110.521 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 . . . . . 0 N--CA 1.494 1.739 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.348 -179.914 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.366 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -85.64 167.27 40.45 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 45.3 t -121.32 81.55 37.99 Favored Pre-proline 0 N--CA 1.494 1.741 0 O-C-N 121.232 -1.157 . . . . 0.0 110.184 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.85 88.25 0.94 Allowed 'Trans proline' 0 C--N 1.315 -1.194 0 O-C-N 123.339 1.178 . . . . 0.0 110.444 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 36.2 mtt-85 -118.09 124.89 49.16 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.237 -0.915 . . . . 0.0 110.184 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 12.9 mt -117.76 126.43 74.78 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.264 -0.897 . . . . 0.0 109.935 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -121.99 85.05 2.35 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.17 -0.956 . . . . 0.0 110.131 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.1 t -142.35 179.67 6.8 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.286 -0.884 . . . . 0.0 110.299 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.1 mtt85 -126.89 98.88 5.51 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.243 -0.91 . . . . 0.0 110.151 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.5 mmt85 -132.78 165.38 24.68 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.189 -0.944 . . . . 0.0 110.249 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.8 t -116.45 141.26 48.41 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.305 -0.872 . . . . 0.0 110.006 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.2 mttt -142.39 171.21 7.5 Favored Pre-proline 0 N--CA 1.494 1.768 0 O-C-N 121.217 -0.927 . . . . 0.0 110.395 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.4 161.37 44.48 Favored 'Trans proline' 0 C--N 1.316 -1.145 0 O-C-N 123.509 1.268 . . . . 0.0 110.681 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.721 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -85.76 145.65 41.97 Favored Pre-proline 0 N--CA 1.505 2.294 0 C-N-CA 119.803 -0.759 . . . . 0.0 109.759 179.634 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.78 162.8 41.34 Favored 'Trans proline' 0 C--N 1.315 -1.185 0 O-C-N 123.34 1.179 . . . . 0.0 110.759 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -48.61 -31.87 7.31 Favored 'General case' 0 N--CA 1.514 2.772 0 O-C-N 121.444 -0.785 . . . . 0.0 111.408 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.78 -34.19 36.44 Favored Glycine 0 N--CA 1.5 2.947 0 O-C-N 120.871 -1.143 . . . . 0.0 110.569 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -55.16 -33.4 62.92 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 120.978 -1.307 . . . . 0.0 110.568 179.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -54.12 -37.12 63.99 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.064 -1.022 . . . . 0.0 110.227 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.9 mmtt -57.81 -35.63 71.1 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.155 -0.966 . . . . 0.0 110.27 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.868 HD12 HD11 ' A' ' 23' ' ' LEU . 3.7 pt -116.23 36.68 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.138 -0.976 . . . . 0.0 110.454 179.587 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.431 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.2 OUTLIER -84.68 -43.49 0.7 Allowed Pre-proline 0 N--CA 1.508 2.442 0 O-C-N 121.038 -1.039 . . . . 0.0 113.392 -179.21 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.2 Cg_endo -76.13 -38.33 1.19 Allowed 'Trans proline' 0 N--CA 1.488 1.149 0 O-C-N 122.51 0.742 . . . . 0.0 111.922 -178.037 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.675 HG21 ' CE2' ' A' ' 62' ' ' TYR . 85.0 m -59.56 -42.95 93.61 Favored 'General case' 0 N--CA 1.512 2.654 0 O-C-N 120.925 -1.11 . . . . 0.0 109.952 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.868 HD11 HD12 ' A' ' 19' ' ' ILE . 45.2 mt -65.55 -38.75 90.52 Favored 'General case' 0 N--CA 1.506 2.347 0 C-N-CA 119.404 -0.919 . . . . 0.0 109.31 179.296 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.0 m -57.7 -34.93 69.97 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.143 -0.973 . . . . 0.0 110.227 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -56.16 -36.87 68.81 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 121.015 -1.053 . . . . 0.0 110.235 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.624 ' CD1' HD22 ' A' ' 55' ' ' LEU . 15.4 m-85 -55.89 -36.79 68.02 Favored 'General case' 0 N--CA 1.511 2.621 0 O-C-N 121.108 -0.995 . . . . 0.0 110.256 179.606 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -57.13 -27.74 62.09 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.184 -0.947 . . . . 0.0 111.001 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.477 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.7 mp -76.67 -37.37 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 O-C-N 121.001 -1.062 . . . . 0.0 109.403 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.454 ' CG ' HD11 ' A' ' 55' ' ' LEU . 34.9 tp60 -79.24 -39.55 32.82 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 120.945 -1.097 . . . . 0.0 108.746 178.46 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.072 HD11 HG23 ' A' ' 52' ' ' ILE . 7.2 tp -70.21 -34.0 72.38 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.491 -0.884 . . . . 0.0 110.399 179.084 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.7 ptm85 -71.85 -36.14 70.07 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 120.824 -1.173 . . . . 0.0 109.746 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.14 -39.49 94.84 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.06 -1.025 . . . . 0.0 109.662 179.434 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.462 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -74.81 -40.98 60.79 Favored 'General case' 0 N--CA 1.505 2.287 0 C-N-CA 119.162 -1.015 . . . . 0.0 109.15 179.026 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -67.75 -29.97 69.32 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 119.531 -0.868 . . . . 0.0 110.423 179.357 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -87.08 -32.82 19.73 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.777 -1.202 . . . . 0.0 110.89 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -55.72 -37.55 68.57 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 120.923 -1.111 . . . . 0.0 110.386 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.44 -39.35 76.07 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 121.177 -0.952 . . . . 0.0 110.158 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 38.4 t 52.87 -166.85 0.06 Allowed 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.068 -1.02 . . . . 0.0 110.933 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.8 m -109.25 -51.93 2.82 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.281 -0.887 . . . . 0.0 110.311 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.9 mmmt -101.22 71.55 1.39 Allowed 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.205 -0.935 . . . . 0.0 109.789 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 15.8 tp -168.13 94.19 0.38 Allowed 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.254 -0.904 . . . . 0.0 110.762 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -98.0 106.11 18.36 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.229 -0.92 . . . . 0.0 110.325 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -168.49 109.81 0.54 Allowed 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.242 -0.911 . . . . 0.0 110.732 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 52.91 68.72 0.79 Allowed 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.013 -1.054 . . . . 0.0 110.546 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.1 m -98.3 -42.87 7.19 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.151 -0.968 . . . . 0.0 110.579 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.405 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 31.1 m-80 -58.82 -40.12 83.21 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.171 -0.956 . . . . 0.0 109.977 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.426 ' HA ' ' CE3' ' A' ' 50' ' ' TRP . 20.7 mt-10 -60.12 -43.53 95.55 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.132 -0.98 . . . . 0.0 109.813 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.404 ' CG ' ' HA ' ' A' ' 33' ' ' ALA . 41.4 tp60 -62.89 -45.02 94.49 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.233 -0.917 . . . . 0.0 109.538 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.442 HD23 HD12 ' A' ' 52' ' ' ILE . 43.8 mt -59.29 -33.81 71.54 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.279 -0.888 . . . . 0.0 110.372 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.501 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 48.3 m0 -57.78 -40.55 80.07 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 120.834 -1.166 . . . . 0.0 109.581 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -62.41 -32.8 73.68 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 119.183 -1.007 . . . . 0.0 109.423 178.314 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 1.072 HG23 HD11 ' A' ' 30' ' ' LEU . 21.4 mt -71.04 -58.31 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.198 0 O-C-N 121.001 -1.062 . . . . 0.0 109.007 179.161 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 ptm -62.36 -29.11 70.23 Favored 'General case' 0 N--CA 1.508 2.448 0 C-N-CA 118.555 -1.258 . . . . 0.0 109.752 178.691 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -70.59 -38.75 74.08 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 120.859 -1.15 . . . . 0.0 109.124 178.233 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.624 HD22 ' CD1' ' A' ' 26' ' ' PHE . 11.0 mt -54.15 -32.87 56.47 Favored 'General case' 0 N--CA 1.513 2.696 0 O-C-N 121.054 -1.029 . . . . 0.0 110.214 178.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.44 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 6.7 t60 -55.94 -36.73 68.08 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.065 -1.022 . . . . 0.0 110.173 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.435 ' NE2' HD21 ' A' ' 91' ' ' LEU . 6.8 m170 -59.04 -47.32 85.65 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 121.023 -1.048 . . . . 0.0 109.544 179.352 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -59.73 -37.18 78.21 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.529 -0.868 . . . . 0.0 109.801 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.438 ' HG2' ' CE1' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -62.66 -48.29 79.99 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.096 -1.003 . . . . 0.0 109.447 179.421 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 26.6 p -62.99 -41.66 99.63 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.103 -0.998 . . . . 0.0 109.301 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.9 ttt85 -62.22 -40.27 95.57 Favored 'General case' 0 N--CA 1.505 2.314 0 C-N-CA 119.381 -0.928 . . . . 0.0 109.291 179.121 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.675 ' CE2' HG21 ' A' ' 22' ' ' THR . 43.5 t80 -63.3 -51.49 65.86 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.117 -0.989 . . . . 0.0 109.446 179.438 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.998 HD12 ' HB2' ' A' ' 87' ' ' ALA . 71.6 mt -68.99 -36.41 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.384 0 C-N-CA 119.303 -0.959 . . . . 0.0 109.422 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.45 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 10.3 t80 -67.54 -41.81 83.68 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.044 -1.035 . . . . 0.0 108.97 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 91.5 m -60.75 -40.97 94.45 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.071 -1.018 . . . . 0.0 110.143 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.632 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.8 pp -83.26 -36.36 24.61 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 120.966 -1.084 . . . . 0.0 112.411 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.607 ' N ' HD12 ' A' ' 66' ' ' LEU . 55.3 t80 -86.63 -35.26 19.49 Favored 'General case' 0 N--CA 1.512 2.641 0 O-C-N 120.608 -1.308 . . . . 0.0 111.826 -179.419 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.45 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 6.9 m-85 -98.36 -3.4 37.11 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 120.904 -1.123 . . . . 0.0 113.219 -178.458 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.79 -58.73 0.61 Allowed 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.352 -1.468 . . . . 0.0 110.8 179.437 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.412 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 11.7 tpt85 -62.52 -29.55 70.64 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 121.03 -1.043 . . . . 0.0 110.696 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 ttmm 59.72 44.26 14.4 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.819 -1.175 . . . . 0.0 110.021 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -118.2 37.73 3.92 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.389 -0.819 . . . . 0.0 109.87 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.72 HG13 HD23 ' A' ' 77' ' ' LEU . 14.8 tt -156.46 162.74 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.198 -0.939 . . . . 0.0 110.154 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 63.3 m -110.18 147.39 33.83 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.204 -0.935 . . . . 0.0 110.153 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.4 tttt -46.02 -32.21 2.69 Favored 'General case' 0 N--CA 1.516 2.864 0 O-C-N 121.328 -0.858 . . . . 0.0 111.606 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -62.11 -49.82 74.38 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.037 -1.039 . . . . 0.0 109.511 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.72 HD23 HG13 ' A' ' 73' ' ' ILE . 27.8 tp -67.39 -43.73 80.61 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 119.161 -1.016 . . . . 0.0 108.712 178.847 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.487 ' HA ' HD12 ' A' ' 81' ' ' LEU . 18.2 t80 -61.9 -38.13 87.21 Favored 'General case' 0 N--CA 1.506 2.327 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.325 179.135 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -73.73 -42.51 61.05 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.123 -0.986 . . . . 0.0 108.802 178.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.721 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 85.8 t90 -57.52 -37.01 72.32 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.31 -0.869 . . . . 0.0 109.712 178.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.541 HD22 ' CD2' ' A' ' 86' ' ' TYR . 14.6 mt -69.23 -48.57 61.6 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.21 -0.932 . . . . 0.0 108.897 179.089 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.497 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 32.4 mm -56.72 -31.74 35.95 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.614 0 O-C-N 121.124 -0.985 . . . . 0.0 109.911 179.239 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.7 mttt -86.67 -22.62 25.99 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 120.918 -1.114 . . . . 0.0 111.611 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.449 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 76.3 mm-40 -99.18 20.49 13.4 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 120.756 -1.215 . . . . 0.0 112.015 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.401 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 0.3 OUTLIER 74.03 77.22 0.12 Allowed 'General case' 0 N--CA 1.511 2.599 0 O-C-N 121.01 -1.056 . . . . 0.0 111.484 179.257 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.602 ' HE2' HD13 ' A' ' 23' ' ' LEU . 30.3 m-85 -135.69 -65.04 0.61 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.539 -0.726 . . . . 0.0 109.642 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.998 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -118.03 174.53 6.15 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.276 -0.89 . . . . 0.0 109.653 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.44 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 12.6 t0 -114.42 102.77 10.4 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.261 -0.899 . . . . 0.0 109.962 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.494 ' HG3' HD12 ' A' ' 82' ' ' ILE . 16.7 mttt -66.8 -40.21 88.02 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.303 -0.873 . . . . 0.0 109.886 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.759 HD23 HD13 ' A' ' 106' ' ' LEU . 60.7 tp -61.85 -40.3 94.85 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.188 -0.945 . . . . 0.0 109.735 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.657 ' N ' HD11 ' A' ' 106' ' ' LEU . 59.6 tp -71.93 -43.44 65.28 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.097 -1.002 . . . . 0.0 108.674 179.229 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 54.2 mt -58.36 -35.75 55.31 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.479 0 O-C-N 121.206 -0.934 . . . . 0.0 108.702 178.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.85 -39.52 83.8 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.17 -0.956 . . . . 0.0 109.091 178.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.432 ' CD ' ' CZ ' ' A' ' 100' ' ' TYR . 8.1 mmtm -57.17 -42.57 81.36 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.031 -1.043 . . . . 0.0 109.484 179.186 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.41 ' CZ3' ' HG ' ' A' ' 91' ' ' LEU . 2.7 m0 -65.36 -35.79 82.04 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.342 -0.849 . . . . 0.0 110.053 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.23 -31.78 38.49 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.125 -0.985 . . . . 0.0 110.655 179.408 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 20.4 mmtm -53.64 -176.86 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.706 0 O-C-N 120.996 -1.065 . . . . 0.0 110.745 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -104.62 135.46 45.99 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.211 -0.931 . . . . 0.0 109.765 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.04 11.94 53.52 Favored Glycine 0 N--CA 1.492 2.428 0 C-N-CA 120.262 -0.971 . . . . 0.0 110.993 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.563 ' HB3' HD23 ' A' ' 103' ' ' LEU . 48.4 m-85 -119.95 72.15 0.92 Allowed 'General case' 0 N--CA 1.492 1.664 0 CA-C-N 119.435 1.617 . . . . 0.0 109.973 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -93.69 -35.82 12.63 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.094 -1.004 . . . . 0.0 110.491 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -123.86 80.14 1.78 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.979 -1.075 . . . . 0.0 110.662 -179.7 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.563 HD23 ' HB3' ' A' ' 100' ' ' TYR . 2.8 pp -124.55 146.38 49.04 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.107 -0.996 . . . . 0.0 110.033 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.426 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.6 p -109.94 -30.87 7.61 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.154 -0.966 . . . . 0.0 112.967 -179.349 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.705 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.4 m -145.15 -169.79 3.28 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 120.194 -1.566 . . . . 0.0 110.098 179.39 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.759 HD13 HD23 ' A' ' 90' ' ' LEU . 16.7 mt -99.76 -35.99 9.61 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.295 -0.878 . . . . 0.0 110.227 178.518 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 3.3 ttt85 -103.06 33.69 3.17 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.869 -1.145 . . . . 0.0 109.653 178.207 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.705 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.276 1.6 t -124.82 -60.75 1.35 Allowed 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 105.18 -2.155 . . . . 0.0 105.18 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.718 ' O ' HG21 ' A' ' 119' ' ' THR . 4.2 pt -69.01 -21.95 25.9 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.671 0 O-C-N 120.879 -1.138 . . . . 0.0 110.784 176.47 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -130.61 151.83 50.65 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.837 -1.164 . . . . 0.0 109.756 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -116.26 -56.59 2.29 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.096 -1.002 . . . . 0.0 110.269 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -146.34 139.92 26.03 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.246 -0.909 . . . . 0.0 110.34 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 52.41 -173.57 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.036 -1.04 . . . . 0.0 110.668 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 16.2 m -106.86 76.99 1.14 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.151 -0.968 . . . . 0.0 110.086 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -140.36 -178.59 5.56 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.175 -0.953 . . . . 0.0 110.078 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -122.27 86.82 2.64 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.121 -0.987 . . . . 0.0 110.218 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -137.54 -73.91 0.06 OUTLIER Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.665 -1.374 . . . . 0.0 109.665 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 2.0 m -115.32 126.53 54.57 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.184 -1.186 . . . . 0.0 110.205 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.718 HG21 ' O ' ' A' ' 109' ' ' ILE . 0.4 OUTLIER -158.78 177.93 10.65 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.197 -0.939 . . . . 0.0 110.548 -179.922 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 34.2 t -59.35 154.97 15.59 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.137 -0.977 . . . . 0.0 109.485 179.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.956 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -76.84 -30.11 18.2 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.384 0 O-C-N 121.066 -1.021 . . . . 0.0 111.63 -179.013 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.48 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.7 p -58.67 -35.81 73.17 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 120.684 -1.26 . . . . 0.0 110.861 -178.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.18 -30.3 64.4 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 120.914 -1.116 . . . . 0.0 110.196 178.79 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.6 t -83.55 122.66 76.9 Favored Pre-proline 0 N--CA 1.505 2.303 0 O-C-N 120.976 -1.078 . . . . 0.0 110.217 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -66.08 179.2 2.0 Favored 'Trans proline' 0 N--CA 1.49 1.277 0 O-C-N 123.175 1.092 . . . . 0.0 110.94 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.26 -37.68 60.84 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.256 -0.902 . . . . 0.0 110.511 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.29 -40.62 78.19 Favored 'General case' 0 N--CA 1.511 2.622 0 O-C-N 121.047 -1.033 . . . . 0.0 110.057 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -70.41 -41.7 72.62 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 119.346 -0.941 . . . . 0.0 109.113 179.147 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.546 ' O ' HG11 ' A' ' 140' ' ' VAL . 4.3 mt -66.02 -38.77 89.27 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 121.288 -0.882 . . . . 0.0 109.402 178.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -59.95 -38.11 81.51 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.113 -0.992 . . . . 0.0 109.958 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -58.58 -37.75 76.46 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.064 -1.022 . . . . 0.0 110.379 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -63.84 -45.72 88.3 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.139 -0.976 . . . . 0.0 109.807 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.421 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -61.68 -40.97 96.84 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.169 -0.957 . . . . 0.0 109.776 179.805 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 34.7 mtt-85 -59.88 -36.12 76.25 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.245 -0.909 . . . . 0.0 110.121 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 20.7 mttm -70.54 -32.91 70.54 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.042 -1.036 . . . . 0.0 110.879 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 2.1 ttmm -100.59 22.01 12.48 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 120.97 -1.081 . . . . 0.0 111.713 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.18 45.98 57.04 Favored Glycine 0 N--CA 1.499 2.87 0 O-C-N 120.592 -1.318 . . . . 0.0 110.688 179.338 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.421 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.3 t -143.04 -165.46 2.07 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.186 -1.185 . . . . 0.0 110.164 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -134.35 149.48 50.85 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.147 -0.971 . . . . 0.0 110.302 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.546 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.7 p -130.98 161.34 41.17 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 121.241 -0.912 . . . . 0.0 109.954 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 30.3 t -166.17 100.2 0.63 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.187 -0.946 . . . . 0.0 111.19 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.956 ' CD1' HD12 ' A' ' 121' ' ' ILE . 74.3 t80 -101.31 160.54 14.32 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.311 -0.868 . . . . 0.0 110.371 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -138.44 -60.88 0.6 Allowed 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.899 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.05 149.25 41.43 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.392 -0.817 . . . . 0.0 109.419 179.122 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 145' ' ' CYS . . . . . 0.453 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.7 p -91.65 157.96 16.67 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 120.992 -1.067 . . . . 0.0 110.765 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 12.5 p -78.42 -23.06 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 O-C-N 121.29 -0.881 . . . . 0.0 111.906 -179.311 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 62.8 m170 -51.77 -57.92 7.88 Favored 'General case' 0 N--CA 1.515 2.825 0 O-C-N 120.725 -1.234 . . . . 0.0 109.956 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.501 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 24.2 p -126.78 -165.49 1.46 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.296 -0.878 . . . . 0.0 110.387 179.634 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 149' ' ' GLY . . . . . 0.416 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.42 65.07 0.58 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 107.891 -2.084 . . . . 0.0 107.891 178.313 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 33.6 t -101.72 141.76 34.09 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.344 -1.092 . . . . 0.0 109.813 -179.082 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 66.0 mtm-85 -100.38 43.56 1.05 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.18 -0.95 . . . . 0.0 109.772 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 80.61 95.55 0.39 Allowed Glycine 0 N--CA 1.486 2.002 0 N-CA-C 109.99 -1.244 . . . . 0.0 109.99 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.6 p -109.31 126.97 53.93 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.202 -1.176 . . . . 0.0 110.136 179.427 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -154.32 147.6 24.88 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.118 -0.989 . . . . 0.0 110.415 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -101.07 -45.32 5.43 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.228 -0.92 . . . . 0.0 110.542 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 2.4 m -57.8 -39.52 77.73 Favored 'General case' 0 N--CA 1.51 2.525 0 O-C-N 121.059 -1.026 . . . . 0.0 110.257 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 . . . . . 0 N--CA 1.495 1.781 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.254 179.917 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.296 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 135.98 -106.92 0.59 Allowed Glycine 0 N--CA 1.493 2.45 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 21.9 t -139.99 95.37 8.58 Favored Pre-proline 0 N--CA 1.494 1.733 0 O-C-N 121.202 -1.175 . . . . 0.0 110.222 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.72 78.54 2.06 Favored 'Trans proline' 0 C--N 1.317 -1.116 0 O-C-N 123.483 1.254 . . . . 0.0 110.449 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 11.6 mmt85 -134.87 -64.55 0.66 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.179 -0.951 . . . . 0.0 110.279 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 42.7 pt -133.65 40.88 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.321 -0.862 . . . . 0.0 110.25 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.6 mttt -131.78 98.75 4.56 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.193 -0.942 . . . . 0.0 110.232 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 10.4 m -131.92 158.95 40.07 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.204 -0.935 . . . . 0.0 110.276 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.6 ptt-85 -136.24 62.62 1.61 Allowed 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.261 -0.9 . . . . 0.0 110.197 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.0 ttt180 54.61 47.82 21.75 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.019 -1.05 . . . . 0.0 110.572 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.1 m -147.34 86.98 1.63 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.232 -0.918 . . . . 0.0 110.464 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.6 tptt -120.96 66.2 14.0 Favored Pre-proline 0 N--CA 1.494 1.73 0 O-C-N 121.173 -0.954 . . . . 0.0 110.019 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -73.13 158.57 48.97 Favored 'Trans proline' 0 C--N 1.318 -1.066 0 O-C-N 123.317 1.167 . . . . 0.0 110.846 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.685 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -104.65 149.68 37.72 Favored Pre-proline 0 N--CA 1.499 1.988 0 O-C-N 121.391 -0.818 . . . . 0.0 109.738 179.559 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.435 ' HG2' HD13 ' A' ' 77' ' ' LEU . 43.7 Cg_endo -69.72 162.76 40.82 Favored 'Trans proline' 0 C--N 1.314 -1.238 0 O-C-N 123.435 1.229 . . . . 0.0 110.84 -179.66 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -48.61 -31.43 6.63 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.417 -0.802 . . . . 0.0 111.532 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.41 -35.73 36.54 Favored Glycine 0 N--CA 1.499 2.881 0 O-C-N 120.958 -1.089 . . . . 0.0 110.6 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.427 ' CE2' ' HG2' ' A' ' 20' ' ' LYS . 22.7 t80 -56.98 -33.48 67.14 Favored 'General case' 0 N--CA 1.511 2.617 0 O-C-N 121.034 -1.274 . . . . 0.0 110.579 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -53.78 -38.71 64.76 Favored 'General case' 0 N--CA 1.512 2.647 0 O-C-N 120.991 -1.068 . . . . 0.0 110.166 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 79.6 mttt -60.73 -36.59 79.25 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.366 -0.833 . . . . 0.0 110.081 179.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.694 HD12 HD11 ' A' ' 23' ' ' LEU . 1.8 pt -114.32 33.49 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 O-C-N 121.247 -0.908 . . . . 0.0 110.757 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.427 ' HG2' ' CE2' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -83.99 -45.54 0.76 Allowed Pre-proline 0 N--CA 1.51 2.525 0 O-C-N 121.056 -1.027 . . . . 0.0 112.872 -179.279 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.412 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.3 Cg_endo -76.78 -36.45 1.55 Allowed 'Trans proline' 0 N--CA 1.485 1.017 0 O-C-N 122.688 0.836 . . . . 0.0 111.46 -178.383 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.789 HG21 ' CE2' ' A' ' 62' ' ' TYR . 87.1 m -59.08 -42.64 90.89 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 120.935 -1.103 . . . . 0.0 109.893 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.694 HD11 HD12 ' A' ' 19' ' ' ILE . 93.6 mt -66.11 -39.95 90.33 Favored 'General case' 0 N--CA 1.505 2.302 0 C-N-CA 119.442 -0.903 . . . . 0.0 109.468 179.314 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.9 m -57.95 -34.5 69.97 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.167 -0.958 . . . . 0.0 110.072 179.116 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -55.84 -35.14 66.07 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 121.018 -1.051 . . . . 0.0 110.332 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.724 ' CD2' HD22 ' A' ' 55' ' ' LEU . 15.0 m-85 -57.67 -39.45 77.12 Favored 'General case' 0 N--CA 1.51 2.526 0 O-C-N 121.006 -1.059 . . . . 0.0 110.486 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -59.99 -34.36 73.21 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.238 -0.914 . . . . 0.0 111.022 -179.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.4 mp -71.43 -39.62 71.53 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.369 0 O-C-N 121.017 -1.052 . . . . 0.0 109.265 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 -70.52 -43.77 68.94 Favored 'General case' 0 N--CA 1.507 2.378 0 C-N-CA 119.199 -1.0 . . . . 0.0 108.725 178.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.707 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -66.35 -34.92 79.06 Favored 'General case' 0 N--CA 1.506 2.357 0 C-N-CA 119.366 -0.933 . . . . 0.0 108.974 178.286 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -57.62 -40.61 79.53 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.102 -0.999 . . . . 0.0 109.962 179.392 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.95 -46.37 88.06 Favored 'General case' 0 N--CA 1.506 2.371 0 C-N-CA 119.301 -0.96 . . . . 0.0 109.829 -179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.549 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -67.89 -40.43 83.51 Favored 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 119.237 -0.985 . . . . 0.0 109.215 179.081 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -59.62 -35.06 73.62 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.249 -0.907 . . . . 0.0 110.346 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 46.4 mmtt -95.29 -38.49 10.51 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 120.992 -1.067 . . . . 0.0 110.641 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -57.41 -38.74 74.83 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 121.059 -1.025 . . . . 0.0 110.099 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.734 ' HE3' HD11 ' A' ' 49' ' ' LEU . 8.8 tttm -59.47 -49.5 77.55 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.139 -0.976 . . . . 0.0 109.952 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 6.2 t 51.04 -165.11 0.05 OUTLIER 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.024 -1.047 . . . . 0.0 110.803 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -112.87 -55.47 2.52 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.198 -0.939 . . . . 0.0 110.186 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.2 mtmm -142.16 54.9 1.46 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.269 -0.894 . . . . 0.0 110.2 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.9 tt -116.74 -56.65 2.26 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.099 -1.001 . . . . 0.0 110.293 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -117.12 -165.19 1.04 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.121 -0.987 . . . . 0.0 110.263 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -112.59 -169.96 1.58 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.116 -0.99 . . . . 0.0 110.157 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.0 mtmt 53.03 80.03 0.11 Allowed 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.977 -1.077 . . . . 0.0 110.731 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.423 ' OG ' ' N ' ' A' ' 46' ' ' ASN . 5.7 p -109.26 -53.57 2.64 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.271 -0.893 . . . . 0.0 110.228 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.423 ' N ' ' OG ' ' A' ' 45' ' ' SER . 3.1 m120 -57.09 -38.55 73.51 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.256 -0.902 . . . . 0.0 109.967 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.421 ' HA ' ' CE3' ' A' ' 50' ' ' TRP . 20.0 mt-10 -63.24 -41.09 99.04 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.155 -0.966 . . . . 0.0 109.797 179.586 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.0 tp60 -61.87 -39.99 93.83 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.141 -0.974 . . . . 0.0 109.782 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.734 HD11 ' HE3' ' A' ' 37' ' ' LYS . 12.5 mt -62.66 -36.87 84.24 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.188 -0.945 . . . . 0.0 110.283 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.514 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.9 m0 -54.41 -39.57 67.43 Favored 'General case' 0 N--CA 1.512 2.639 0 O-C-N 120.909 -1.119 . . . . 0.0 109.724 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -63.45 -38.08 89.77 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.258 -0.901 . . . . 0.0 109.635 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.707 HG23 ' CG ' ' A' ' 30' ' ' LEU . 78.8 mt -64.86 -44.96 96.23 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.394 0 O-C-N 121.135 -0.978 . . . . 0.0 109.173 179.632 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.463 ' CE ' ' HB3' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -68.17 -30.55 69.69 Favored 'General case' 0 N--CA 1.501 2.101 0 C-N-CA 118.889 -1.124 . . . . 0.0 109.743 178.999 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.446 ' N ' ' HG3' ' A' ' 53' ' ' MET . 48.1 mt-30 -67.39 -37.4 83.08 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.898 -1.126 . . . . 0.0 109.111 178.653 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.724 HD22 ' CD2' ' A' ' 26' ' ' PHE . 13.6 mt -52.35 -32.33 37.76 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.115 -0.99 . . . . 0.0 109.917 178.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.453 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 13.3 t60 -56.92 -40.27 76.01 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.023 -1.048 . . . . 0.0 109.389 179.024 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.423 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 8.0 m170 -60.44 -49.16 78.67 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.154 -0.966 . . . . 0.0 109.137 178.583 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -59.59 -39.45 84.19 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.343 -0.848 . . . . 0.0 109.365 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.426 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -62.42 -48.13 81.06 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.138 -0.976 . . . . 0.0 108.928 178.955 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 12.6 p -66.81 -40.57 88.09 Favored 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 119.384 -0.926 . . . . 0.0 108.699 178.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.8 ttt85 -63.01 -37.52 87.53 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.13 -0.981 . . . . 0.0 109.413 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.789 ' CE2' HG21 ' A' ' 22' ' ' THR . 44.5 t80 -61.1 -50.83 71.67 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.124 -0.985 . . . . 0.0 109.293 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.675 HD12 ' HB2' ' A' ' 87' ' ' ALA . 88.6 mt -73.33 -42.01 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.344 0 C-N-CA 119.37 -0.932 . . . . 0.0 108.855 179.06 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.507 ' CE1' HG23 ' A' ' 92' ' ' ILE . 47.7 t80 -57.85 -32.56 67.76 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.331 -0.855 . . . . 0.0 110.235 178.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 61.9 m -80.78 -36.97 31.08 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 120.881 -1.137 . . . . 0.0 110.59 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.622 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -82.93 -32.05 27.4 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 120.954 -1.092 . . . . 0.0 112.25 -179.173 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.503 ' HD1' HG23 ' A' ' 73' ' ' ILE . 90.3 t80 -86.47 -36.16 19.21 Favored 'General case' 0 N--CA 1.512 2.655 0 O-C-N 120.658 -1.277 . . . . 0.0 111.731 -179.37 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -98.56 -20.6 16.95 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 120.896 -1.128 . . . . 0.0 112.951 -178.278 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -119.27 -56.45 2.07 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 120.48 -1.387 . . . . 0.0 111.637 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.425 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 8.4 ttt-85 -66.76 -29.72 69.76 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.056 -1.027 . . . . 0.0 110.805 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 59.5 44.6 14.6 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.822 -1.174 . . . . 0.0 110.042 -179.61 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.52 37.17 3.3 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.336 -0.853 . . . . 0.0 109.523 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.774 HG13 HD23 ' A' ' 77' ' ' LEU . 13.6 tt -160.43 162.69 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 121.243 -0.911 . . . . 0.0 110.139 -179.583 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.8 p -108.26 148.83 29.43 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.135 -0.978 . . . . 0.0 110.024 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.8 tttt -46.71 -32.2 3.43 Favored 'General case' 0 N--CA 1.515 2.799 0 O-C-N 121.271 -0.893 . . . . 0.0 111.556 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -61.69 -50.32 72.94 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.917 -1.114 . . . . 0.0 109.337 179.542 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.774 HD23 HG13 ' A' ' 73' ' ' ILE . 34.8 tp -67.33 -42.16 84.04 Favored 'General case' 0 N--CA 1.504 2.235 0 C-N-CA 119.118 -1.033 . . . . 0.0 108.657 178.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.643 ' HA ' HD12 ' A' ' 81' ' ' LEU . 19.1 t80 -61.6 -39.71 92.19 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.227 -0.921 . . . . 0.0 109.194 178.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -70.36 -42.44 71.8 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.142 -0.974 . . . . 0.0 108.728 178.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.685 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 68.3 t90 -56.95 -35.16 68.79 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.215 -0.928 . . . . 0.0 109.859 178.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.643 HD12 ' HA ' ' A' ' 78' ' ' TYR . 13.2 mt -70.37 -49.82 45.24 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.077 -1.015 . . . . 0.0 108.902 179.116 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 36.1 mm -58.37 -32.52 45.36 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.567 0 O-C-N 121.26 -0.9 . . . . 0.0 110.032 179.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.9 mttm -89.27 -15.74 32.81 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 120.894 -1.128 . . . . 0.0 112.108 -179.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.426 ' HB2' ' CE1' ' A' ' 86' ' ' TYR . 26.3 mm-40 -105.36 20.64 18.54 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 120.581 -1.324 . . . . 0.0 112.063 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt 73.85 77.36 0.13 Allowed 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.05 -1.031 . . . . 0.0 111.578 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.466 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 28.6 m-85 -135.01 -63.45 0.69 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.531 -0.73 . . . . 0.0 109.711 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.675 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -120.23 -174.48 2.79 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.377 -0.827 . . . . 0.0 109.894 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.453 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.7 t0 -124.04 112.78 17.56 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.134 -0.979 . . . . 0.0 110.435 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -63.74 -40.74 97.46 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.117 -0.989 . . . . 0.0 109.395 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.488 ' HB3' HD13 ' A' ' 106' ' ' LEU . 13.0 tp -59.59 -40.64 88.11 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.126 -0.984 . . . . 0.0 109.596 179.5 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.688 HD12 ' CZ3' ' A' ' 95' ' ' TRP . 0.2 OUTLIER -65.22 -53.24 47.57 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.188 -0.945 . . . . 0.0 109.012 179.368 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.507 HG23 ' CE1' ' A' ' 64' ' ' TYR . 55.8 mt -62.32 -34.71 65.64 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.313 0 O-C-N 121.228 -0.92 . . . . 0.0 109.127 178.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.93 -40.07 91.08 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.052 -1.03 . . . . 0.0 109.9 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.652 ' HB3' HD22 ' A' ' 103' ' ' LEU . 9.4 mttp -64.98 -42.53 94.47 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.026 -1.047 . . . . 0.0 110.267 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.688 ' CZ3' HD12 ' A' ' 91' ' ' LEU . 3.1 m0 -62.15 -33.5 74.62 Favored 'General case' 0 N--CA 1.51 2.553 0 C-N-CA 118.983 -1.087 . . . . 0.0 110.107 178.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.12 -35.3 36.97 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 120.963 -1.086 . . . . 0.0 110.452 179.596 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.6 mmtp -53.13 -179.31 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.652 0 O-C-N 121.009 -1.057 . . . . 0.0 110.718 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.1 m -106.6 140.46 39.44 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.289 -0.882 . . . . 0.0 109.544 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 101.23 -24.53 31.5 Favored Glycine 0 N--CA 1.492 2.408 0 C-N-CA 119.834 -1.174 . . . . 0.0 110.45 -179.235 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.59 ' HB3' HD23 ' A' ' 103' ' ' LEU . 63.4 m-85 -91.95 58.56 3.41 Favored 'General case' 0 N--CA 1.503 2.224 0 CA-C-N 119.083 1.441 . . . . 0.0 110.047 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -71.18 -37.46 72.16 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.018 -1.051 . . . . 0.0 110.208 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.62 84.86 2.33 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.046 -1.034 . . . . 0.0 110.617 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.84 ' HB2' HD13 ' A' ' 109' ' ' ILE . 2.3 pp -120.54 140.83 50.9 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.086 -1.009 . . . . 0.0 110.303 179.583 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.423 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.5 p -108.03 -28.82 9.33 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.235 -0.916 . . . . 0.0 112.598 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.715 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 10.6 m -146.68 -169.83 3.37 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 120.366 -1.459 . . . . 0.0 110.005 179.314 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.661 HD21 ' HA ' ' A' ' 91' ' ' LEU . 93.9 mt -100.09 -35.1 9.8 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.211 -0.931 . . . . 0.0 110.583 178.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.92 36.67 2.37 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.757 -1.215 . . . . 0.0 109.187 178.203 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.715 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.284 1.6 t -127.72 -59.01 1.22 Allowed 'General case' 0 N--CA 1.498 1.946 0 N-CA-C 105.788 -1.931 . . . . 0.0 105.788 -179.411 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.84 HD13 ' HB2' ' A' ' 103' ' ' LEU . 18.8 pt -69.15 -26.22 31.49 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.617 0 O-C-N 121.001 -1.062 . . . . 0.0 110.741 177.034 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.414 ' N ' HG13 ' A' ' 109' ' ' ILE . 47.2 tt0 -124.6 161.96 25.1 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.865 -1.147 . . . . 0.0 110.175 -179.406 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.411 ' HE2' ' HA ' ' A' ' 119' ' ' THR . 7.3 tppt? -124.82 -57.93 1.51 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.145 -0.972 . . . . 0.0 110.369 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -115.74 -172.58 2.18 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.126 -0.984 . . . . 0.0 110.146 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -115.39 52.52 0.87 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.205 -0.935 . . . . 0.0 110.218 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.18 -58.8 0.34 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.152 -0.967 . . . . 0.0 110.414 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -144.62 -167.8 2.74 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.076 -1.015 . . . . 0.0 110.314 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -117.57 84.59 2.19 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.189 -0.944 . . . . 0.0 110.172 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -106.66 -55.27 0.66 Allowed Glycine 0 N--CA 1.493 2.465 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 1.5 m -126.46 120.53 29.96 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.221 -1.164 . . . . 0.0 110.306 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.759 HG21 ' O ' ' A' ' 109' ' ' ILE . 0.9 OUTLIER -140.96 177.46 8.03 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.206 -0.934 . . . . 0.0 109.877 179.931 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 35.1 t -55.48 153.68 7.28 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.047 -1.033 . . . . 0.0 110.047 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.801 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -74.22 -36.17 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.469 0 O-C-N 121.144 -0.973 . . . . 0.0 111.279 -179.07 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.483 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 10.7 p -52.72 -30.72 33.93 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.75 -1.219 . . . . 0.0 111.723 -178.345 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 1.5 ttt85 -61.61 -37.01 82.35 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 120.873 -1.142 . . . . 0.0 109.531 178.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 50.5 t -76.12 124.16 88.24 Favored Pre-proline 0 N--CA 1.505 2.286 0 O-C-N 121.109 -0.994 . . . . 0.0 110.031 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -66.09 172.83 8.07 Favored 'Trans proline' 0 N--CA 1.488 1.201 0 O-C-N 123.241 1.127 . . . . 0.0 110.707 179.426 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 27.1 mmm-85 -75.04 -36.2 61.88 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 121.19 -0.944 . . . . 0.0 110.675 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.05 -40.8 77.53 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 120.974 -1.079 . . . . 0.0 110.123 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -68.69 -41.6 78.93 Favored 'General case' 0 N--CA 1.506 2.348 0 C-N-CA 119.349 -0.94 . . . . 0.0 109.276 179.338 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.612 HD11 HD11 ' A' ' 121' ' ' ILE . 1.6 mt -64.53 -39.39 93.69 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.263 -0.898 . . . . 0.0 109.501 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -59.0 -37.82 77.75 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.181 -0.949 . . . . 0.0 110.13 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -58.15 -37.15 74.09 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.046 -1.034 . . . . 0.0 110.454 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.16 -47.67 81.69 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.237 -0.915 . . . . 0.0 109.892 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.582 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -61.2 -39.86 91.78 Favored 'General case' 0 N--CA 1.508 2.456 0 C-N-CA 119.33 -0.948 . . . . 0.0 109.787 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -37.33 79.63 Favored 'General case' 0 N--CA 1.512 2.631 0 O-C-N 121.174 -0.954 . . . . 0.0 110.149 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 13.5 mmtm -87.06 -38.86 16.14 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.084 -1.01 . . . . 0.0 110.261 179.748 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' LYS . . . . . 0.451 ' HB3' HG22 ' A' ' 138' ' ' THR . 0.1 OUTLIER -70.28 -26.71 63.93 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.14 -0.975 . . . . 0.0 111.158 179.668 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 91.69 32.28 8.73 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 110.006 -1.238 . . . . 0.0 110.006 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.582 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.6 t -139.96 -159.67 0.98 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.981 -1.305 . . . . 0.0 109.725 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -134.41 134.73 41.98 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.045 -1.034 . . . . 0.0 110.228 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 13.2 p -120.42 160.55 20.92 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.258 -0.902 . . . . 0.0 110.116 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 35.6 t -168.92 80.51 0.13 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.165 -0.959 . . . . 0.0 111.327 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.777 ' CG ' HD12 ' A' ' 121' ' ' ILE . 40.1 t80 -87.72 160.34 18.13 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.163 -0.961 . . . . 0.0 109.679 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -136.77 -61.26 0.68 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.515 -0.741 . . . . 0.0 109.092 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -135.57 153.25 51.75 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.435 -0.79 . . . . 0.0 109.504 179.184 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' CYS . . . . . 0.405 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.0 p -95.3 155.76 16.6 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.137 -0.977 . . . . 0.0 110.92 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.6 m -73.96 -25.85 20.66 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.522 0 O-C-N 121.271 -0.893 . . . . 0.0 111.814 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -51.64 -48.0 63.52 Favored 'General case' 0 N--CA 1.515 2.815 0 O-C-N 120.835 -1.166 . . . . 0.0 110.04 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.514 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 30.9 p -137.85 -168.87 2.43 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.161 -0.962 . . . . 0.0 111.01 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -98.85 57.41 0.93 Allowed Glycine 0 N--CA 1.492 2.429 0 N-CA-C 107.633 -2.187 . . . . 0.0 107.633 178.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 19.8 t -97.51 141.2 30.85 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.421 -1.046 . . . . 0.0 109.744 -179.112 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.21 51.74 1.11 Allowed 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.312 -0.868 . . . . 0.0 109.506 179.356 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 68.77 98.16 0.04 OUTLIER Glycine 0 N--CA 1.488 2.1 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.8 p -109.6 129.42 55.59 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.213 -1.169 . . . . 0.0 110.332 179.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -145.51 147.65 32.36 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.18 -0.95 . . . . 0.0 110.212 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.49 -48.28 3.47 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.206 -0.933 . . . . 0.0 110.735 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 37.5 p -51.32 -37.24 46.61 Favored 'General case' 0 N--CA 1.515 2.783 0 O-C-N 121.027 -1.045 . . . . 0.0 110.878 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 62.7 m-20 . . . . . 0 N--CA 1.495 1.815 0 CA-C-O 117.969 -1.015 . . . . 0.0 110.156 179.942 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.319 0 N-CA-C 109.489 -1.445 . . . . 0.0 109.489 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -79.27 -110.28 0.23 Allowed Glycine 0 N--CA 1.492 2.426 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.4 t -119.04 150.59 49.11 Favored Pre-proline 0 N--CA 1.494 1.759 0 O-C-N 121.208 -1.172 . . . . 0.0 110.222 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.59 174.72 11.24 Favored 'Trans proline' 0 C--N 1.316 -1.142 0 O-C-N 123.436 1.229 . . . . 0.0 110.388 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 12.7 mtp180 -132.9 118.89 19.47 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.067 -1.02 . . . . 0.0 110.258 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.461 ' N ' HD12 ' A' ' 4' ' ' ILE . 4.8 mp -128.88 71.6 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 O-C-N 121.258 -0.901 . . . . 0.0 109.849 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -158.59 174.53 14.92 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.186 -0.946 . . . . 0.0 110.811 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.426 ' O ' HG23 ' A' ' 6' ' ' THR . 7.7 t -144.42 59.07 1.33 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.153 -0.967 . . . . 0.0 110.41 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.8 ttm-85 59.97 113.51 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.148 -0.97 . . . . 0.0 110.718 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 13.4 mtp85 -107.6 159.83 16.15 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.055 -1.028 . . . . 0.0 110.116 179.666 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -116.38 -60.92 1.8 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.211 -0.931 . . . . 0.0 110.261 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.7 mtmp? -145.24 143.04 19.13 Favored Pre-proline 0 N--CA 1.495 1.789 0 O-C-N 121.127 -0.983 . . . . 0.0 110.392 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.475 ' O ' ' HB3' ' A' ' 12' ' ' ALA . 49.5 Cg_endo -74.89 158.24 42.73 Favored 'Trans proline' 0 C--N 1.318 -1.041 0 O-C-N 123.326 1.171 . . . . 0.0 110.484 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.75 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . 61.31 152.49 0.1 Allowed Pre-proline 0 N--CA 1.501 2.124 0 O-C-N 121.324 -0.86 . . . . 0.0 110.573 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -71.15 163.46 39.12 Favored 'Trans proline' 0 C--N 1.317 -1.113 0 O-C-N 123.309 1.162 . . . . 0.0 110.734 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -48.18 -32.51 7.14 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 121.479 -0.763 . . . . 0.0 111.358 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -54.37 -34.16 54.02 Favored Glycine 0 N--CA 1.497 2.744 0 O-C-N 120.984 -1.072 . . . . 0.0 110.431 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.471 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 27.5 t80 -54.46 -31.88 56.51 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.985 -1.303 . . . . 0.0 110.843 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.17 -37.73 64.78 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.02 -1.05 . . . . 0.0 110.272 179.77 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.7 mmmm -58.02 -35.78 71.76 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.232 -0.917 . . . . 0.0 110.342 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.818 HD12 HD11 ' A' ' 23' ' ' LEU . 2.8 pt -117.97 36.37 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.047 0 O-C-N 121.208 -0.933 . . . . 0.0 110.473 179.733 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.436 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -83.84 -43.64 0.79 Allowed Pre-proline 0 N--CA 1.508 2.448 0 O-C-N 120.998 -1.064 . . . . 0.0 113.132 -179.165 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.436 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.7 Cg_endo -76.66 -35.97 1.81 Allowed 'Trans proline' 0 N--CA 1.486 1.043 0 O-C-N 122.584 0.781 . . . . 0.0 111.869 -178.263 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.817 HG21 ' CE2' ' A' ' 62' ' ' TYR . 61.8 m -61.48 -47.16 86.92 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 120.893 -1.129 . . . . 0.0 110.015 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.818 HD11 HD12 ' A' ' 19' ' ' ILE . 10.9 mt -61.19 -38.07 85.21 Favored 'General case' 0 N--CA 1.509 2.487 0 C-N-CA 119.476 -0.89 . . . . 0.0 109.701 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.7 m -56.88 -35.43 68.93 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.07 -1.018 . . . . 0.0 110.278 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -56.82 -37.64 71.51 Favored 'General case' 0 N--CA 1.512 2.653 0 O-C-N 121.125 -0.985 . . . . 0.0 110.192 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.733 ' CD2' HD22 ' A' ' 55' ' ' LEU . 21.7 m-85 -58.92 -40.28 84.11 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.134 -0.979 . . . . 0.0 110.17 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -60.86 -23.16 64.94 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.269 -0.895 . . . . 0.0 111.471 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.554 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.7 mp -81.14 -34.59 13.65 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.313 0 O-C-N 120.829 -1.169 . . . . 0.0 109.719 179.428 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 57.5 tp60 -81.24 -37.03 29.23 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.898 -1.127 . . . . 0.0 109.211 178.448 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.734 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -73.43 -32.43 64.38 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.115 -0.991 . . . . 0.0 110.12 178.887 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.7 ptm180 -69.92 -36.7 75.57 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 120.842 -1.161 . . . . 0.0 109.742 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -64.82 -39.78 94.14 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.081 -1.012 . . . . 0.0 109.504 179.375 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.575 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -68.97 -41.7 77.56 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.15 -0.969 . . . . 0.0 109.369 179.18 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 9.2 mm-40 -61.64 -34.34 75.52 Favored 'General case' 0 N--CA 1.506 2.343 0 C-N-CA 119.568 -0.853 . . . . 0.0 110.449 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.2 mttt -94.02 -36.16 12.27 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 120.991 -1.068 . . . . 0.0 110.921 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -57.53 -38.38 74.61 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.031 -1.043 . . . . 0.0 110.238 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.1 ttpt -56.28 -40.32 74.09 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.045 -1.034 . . . . 0.0 110.147 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 52.11 -173.18 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.995 -1.066 . . . . 0.0 110.849 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.6 p -114.99 109.8 18.65 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.263 -0.898 . . . . 0.0 110.121 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 55.3 tttt 52.75 82.84 0.07 Allowed 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.069 -1.019 . . . . 0.0 110.714 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 44.1 tp -144.19 -58.95 0.38 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.292 -0.88 . . . . 0.0 110.436 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -120.53 -165.77 1.24 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.155 -0.966 . . . . 0.0 110.309 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -116.87 42.09 2.57 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.119 -0.988 . . . . 0.0 110.19 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.9 mtpt -144.02 64.48 1.32 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.391 -0.818 . . . . 0.0 110.118 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 m -104.58 -48.15 3.88 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.23 -0.919 . . . . 0.0 110.576 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.5 m-80 -57.55 -39.0 75.69 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.12 -0.988 . . . . 0.0 110.186 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -64.63 -44.24 91.14 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.141 -0.974 . . . . 0.0 109.61 179.713 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.8 tp60 -64.17 -41.41 97.15 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.224 -0.923 . . . . 0.0 109.481 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.628 HD23 HD12 ' A' ' 52' ' ' ILE . 12.9 mt -61.08 -36.94 81.0 Favored 'General case' 0 N--CA 1.507 2.412 0 C-N-CA 119.487 -0.885 . . . . 0.0 110.044 179.69 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.504 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 53.6 m0 -58.51 -38.43 77.67 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 120.993 -1.067 . . . . 0.0 110.105 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -62.17 -30.13 70.84 Favored 'General case' 0 N--CA 1.505 2.315 0 C-N-CA 119.147 -1.021 . . . . 0.0 109.802 178.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.734 HG23 ' CG ' ' A' ' 30' ' ' LEU . 77.6 mt -71.21 -57.58 7.24 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.288 0 O-C-N 120.886 -1.134 . . . . 0.0 109.284 179.41 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 ptm -62.44 -30.0 70.91 Favored 'General case' 0 N--CA 1.508 2.466 0 C-N-CA 118.621 -1.232 . . . . 0.0 109.77 179.016 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -67.34 -38.34 84.7 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 120.808 -1.182 . . . . 0.0 109.116 178.148 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.733 HD22 ' CD2' ' A' ' 26' ' ' PHE . 10.9 mt -53.13 -31.02 40.14 Favored 'General case' 0 N--CA 1.511 2.608 0 O-C-N 121.028 -1.045 . . . . 0.0 110.248 179.002 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.467 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 5.3 t60 -56.48 -38.35 71.61 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.007 -1.058 . . . . 0.0 109.965 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.503 ' CD2' HD21 ' A' ' 91' ' ' LEU . 5.4 m170 -60.38 -50.59 73.0 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.122 -0.986 . . . . 0.0 109.284 179.034 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.6 tp60 -59.38 -34.83 72.9 Favored 'General case' 0 N--CA 1.507 2.394 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.402 178.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.442 ' HD3' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -66.52 -52.04 50.2 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.145 -0.972 . . . . 0.0 109.175 178.912 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.0 p -63.01 -38.37 90.91 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.208 -0.932 . . . . 0.0 109.2 179.005 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.426 ' O ' ' OG1' ' A' ' 65' ' ' THR . 1.5 ttt85 -64.59 -40.46 95.56 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.134 -0.979 . . . . 0.0 109.046 178.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.817 ' CE2' HG21 ' A' ' 22' ' ' THR . 38.6 t80 -62.19 -51.28 68.44 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.194 -0.941 . . . . 0.0 109.284 179.307 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.804 HD12 ' HB2' ' A' ' 87' ' ' ALA . 78.8 mt -69.41 -39.27 78.56 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.439 0 C-N-CA 119.453 -0.899 . . . . 0.0 109.247 179.304 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.409 ' HD2' HD13 ' A' ' 92' ' ' ILE . 12.6 t80 -65.12 -43.12 93.03 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.249 -0.907 . . . . 0.0 109.162 179.198 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.426 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 88.4 m -60.88 -41.8 96.69 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.083 -1.01 . . . . 0.0 110.468 -179.53 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.572 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.35 -32.59 26.17 Favored 'General case' 0 N--CA 1.503 2.207 0 C-N-CA 118.887 -1.125 . . . . 0.0 112.541 -178.906 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.455 ' N ' HD12 ' A' ' 66' ' ' LEU . 46.7 t80 -86.38 -32.24 21.06 Favored 'General case' 0 N--CA 1.512 2.666 0 O-C-N 120.605 -1.31 . . . . 0.0 111.851 -179.536 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.407 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 7.8 m-85 -98.27 -19.09 18.02 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 120.814 -1.179 . . . . 0.0 112.622 -178.87 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.404 ' HD3' ' HA ' ' A' ' 65' ' ' THR . 7.8 mtpt -121.18 -58.41 1.79 Allowed 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.501 -1.375 . . . . 0.0 110.916 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.411 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 6.9 ttm180 -64.71 -31.13 72.21 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.19 -0.944 . . . . 0.0 110.774 -179.504 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 57.93 43.16 21.82 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.814 -1.179 . . . . 0.0 110.019 -179.607 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.64 35.78 3.71 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.443 -0.785 . . . . 0.0 109.824 179.276 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.802 HG13 HD23 ' A' ' 77' ' ' LEU . 13.9 tt -154.52 162.67 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.26 -0.9 . . . . 0.0 109.98 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 4.6 t -109.31 146.46 34.29 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.128 -0.982 . . . . 0.0 110.192 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -45.03 -32.69 1.78 Allowed 'General case' 0 N--CA 1.516 2.851 0 O-C-N 121.316 -0.865 . . . . 0.0 111.728 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -61.53 -50.92 70.72 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 120.841 -1.162 . . . . 0.0 109.227 179.384 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.802 HD23 HG13 ' A' ' 73' ' ' ILE . 40.4 tp -66.8 -43.64 83.35 Favored 'General case' 0 N--CA 1.505 2.309 0 C-N-CA 119.252 -0.979 . . . . 0.0 108.46 178.628 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.433 ' HA ' HD12 ' A' ' 81' ' ' LEU . 16.9 t80 -60.38 -38.0 82.54 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.349 -0.844 . . . . 0.0 109.465 179.038 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.501 ' O ' HG22 ' A' ' 82' ' ' ILE . 34.8 t70 -74.8 -41.91 59.08 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.028 -1.045 . . . . 0.0 108.891 178.908 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.75 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 88.6 t90 -58.99 -38.92 80.29 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.168 -0.958 . . . . 0.0 109.245 178.786 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.468 HD23 ' CE2' ' A' ' 86' ' ' TYR . 13.9 mt -65.58 -54.88 21.74 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.226 -0.921 . . . . 0.0 109.244 179.056 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.632 HD12 ' HB3' ' A' ' 87' ' ' ALA . 0.8 OUTLIER -55.81 -27.43 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.512 0 O-C-N 121.077 -1.014 . . . . 0.0 110.751 -179.856 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.6 ttpm? -87.77 -21.99 24.81 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 120.943 -1.098 . . . . 0.0 111.582 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.446 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 27.4 mm-40 -99.87 23.44 9.73 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.684 -1.26 . . . . 0.0 111.866 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.412 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 7.8 ttpt 75.99 72.49 0.08 Allowed 'General case' 0 N--CA 1.512 2.64 0 O-C-N 121.177 -0.952 . . . . 0.0 111.743 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.751 ' HE2' HD13 ' A' ' 23' ' ' LEU . 32.0 m-85 -134.54 -62.55 0.74 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.516 -0.74 . . . . 0.0 109.218 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.804 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -129.67 -179.7 5.33 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.424 -0.798 . . . . 0.0 109.6 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.467 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 7.3 t0 -131.09 127.82 38.95 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.075 -1.016 . . . . 0.0 110.627 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 8.9 mttp -75.09 -37.44 61.54 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.242 -0.911 . . . . 0.0 109.835 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.444 HD12 ' HA ' ' A' ' 90' ' ' LEU . 13.8 tp -60.27 -42.33 95.18 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.079 -1.013 . . . . 0.0 109.932 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.503 HD21 ' CD2' ' A' ' 57' ' ' HIS . 53.6 tp -69.02 -50.05 52.2 Favored 'General case' 0 N--CA 1.505 2.277 0 C-N-CA 119.151 -1.02 . . . . 0.0 108.849 179.24 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.459 HG22 ' HD2' ' A' ' 96' ' ' ARG . 60.7 mt -59.37 -36.56 64.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.426 0 C-N-CA 119.142 -1.023 . . . . 0.0 108.693 178.282 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.88 -39.32 90.58 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.145 -0.972 . . . . 0.0 109.068 178.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.419 ' HD2' ' CE1' ' A' ' 100' ' ' TYR . 9.8 mmtm -57.1 -45.3 83.49 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.105 -0.997 . . . . 0.0 109.268 179.142 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.7 m0 -62.62 -36.68 83.57 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.402 -0.811 . . . . 0.0 110.003 179.427 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.459 ' HD2' HG22 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -75.59 -33.4 60.58 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.063 -1.023 . . . . 0.0 110.649 179.736 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.6 mmtt -53.65 -176.99 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.743 0 O-C-N 121.032 -1.042 . . . . 0.0 110.613 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 31.2 m -103.14 133.52 48.11 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.26 -0.9 . . . . 0.0 109.748 179.202 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.84 11.29 53.71 Favored Glycine 0 N--CA 1.494 2.52 0 C-N-CA 120.233 -0.984 . . . . 0.0 111.043 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.559 ' HB3' HD23 ' A' ' 103' ' ' LEU . 53.6 m-85 -118.71 71.02 0.83 Allowed 'General case' 0 N--CA 1.494 1.731 0 CA-C-N 119.463 1.631 . . . . 0.0 109.68 179.6 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -98.23 -33.87 10.94 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.065 -1.022 . . . . 0.0 111.336 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.58 60.59 1.08 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.99 -1.069 . . . . 0.0 111.088 -179.321 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.559 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.4 pp -108.91 151.76 25.84 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.906 -1.121 . . . . 0.0 109.618 179.082 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.427 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.5 p -112.72 -28.1 7.91 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.173 -0.954 . . . . 0.0 113.521 -178.881 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.638 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.7 m -144.05 -168.5 2.88 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 120.094 -1.629 . . . . 0.0 109.955 179.217 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' A' ' 106' ' ' LEU . 12.5 mt -95.62 -38.76 10.24 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.219 -0.926 . . . . 0.0 109.884 178.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 32.6 ttm-85 -102.22 29.63 5.01 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.032 -1.042 . . . . 0.0 110.129 178.229 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.638 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.8 t -127.67 17.23 6.91 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.053 -1.03 . . . . 0.0 108.935 -179.533 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.498 HG22 ' HG3' ' A' ' 123' ' ' ARG . 1.1 pt -158.07 38.68 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.264 0 O-C-N 120.863 -1.148 . . . . 0.0 110.179 -178.795 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.762 ' C ' HG23 ' A' ' 119' ' ' THR . 7.8 mt-30 -94.48 96.62 9.61 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.884 -1.135 . . . . 0.0 110.829 -178.756 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -110.01 -57.14 2.23 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.236 -0.915 . . . . 0.0 110.012 179.553 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 52.08 -174.14 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.025 -1.047 . . . . 0.0 110.903 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -117.47 40.8 2.97 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.211 -0.931 . . . . 0.0 110.215 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.78 -174.53 3.39 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.137 -0.977 . . . . 0.0 110.042 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -116.37 44.93 1.88 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.162 -0.961 . . . . 0.0 110.209 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -121.4 142.13 50.3 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.235 -0.915 . . . . 0.0 110.21 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 65.18 -163.37 38.43 Favored Glycine 0 N--CA 1.494 2.511 0 N-CA-C 109.471 -1.451 . . . . 0.0 109.471 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 29.4 m -144.34 170.97 15.0 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.209 -1.171 . . . . 0.0 110.398 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.762 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.5 m -116.76 171.37 7.93 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.155 -0.966 . . . . 0.0 110.155 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.423 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 48.8 t -94.48 154.17 17.55 Favored 'General case' 0 N--CA 1.495 1.807 0 C-N-CA 119.505 -0.878 . . . . 0.0 108.853 178.522 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.962 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -74.9 -31.2 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.445 0 O-C-N 121.051 -1.03 . . . . 0.0 111.606 -178.803 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.483 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.2 p -59.12 -35.73 73.97 Favored 'General case' 0 N--CA 1.512 2.625 0 O-C-N 120.663 -1.273 . . . . 0.0 110.594 -179.203 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.498 ' HG3' HG22 ' A' ' 109' ' ' ILE . 13.4 ttt-85 -57.31 -33.34 67.58 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.997 -1.065 . . . . 0.0 109.979 178.883 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.3 t -79.58 123.97 83.95 Favored Pre-proline 0 N--CA 1.506 2.372 0 O-C-N 121.092 -1.005 . . . . 0.0 110.117 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -67.01 178.72 2.72 Favored 'Trans proline' 0 N--CA 1.489 1.212 0 O-C-N 123.164 1.086 . . . . 0.0 110.801 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 25.1 mmm-85 -75.14 -37.39 61.4 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.238 -0.914 . . . . 0.0 110.422 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.36 -40.91 79.07 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.048 -1.033 . . . . 0.0 110.062 -179.798 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -69.64 -41.95 74.9 Favored 'General case' 0 N--CA 1.504 2.267 0 C-N-CA 119.31 -0.956 . . . . 0.0 109.193 179.285 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.61 ' O ' HG11 ' A' ' 140' ' ' VAL . 5.5 mt -66.56 -39.1 88.36 Favored 'General case' 0 N--CA 1.504 2.269 0 C-N-CA 119.41 -0.916 . . . . 0.0 109.422 178.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -60.86 -38.54 85.94 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.168 -0.957 . . . . 0.0 109.936 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -59.64 -38.98 82.85 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.163 -0.96 . . . . 0.0 110.203 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -61.54 -46.46 89.85 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.126 -0.984 . . . . 0.0 109.722 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.458 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -62.12 -43.88 97.86 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.209 -0.932 . . . . 0.0 109.651 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.29 -32.65 70.24 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.171 -0.955 . . . . 0.0 110.358 179.533 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 40.4 mttt -80.72 -30.03 36.3 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.988 -1.07 . . . . 0.0 111.136 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 46.5 mttt -99.05 25.04 7.09 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 120.817 -1.177 . . . . 0.0 111.593 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.16 46.97 50.78 Favored Glycine 0 N--CA 1.5 2.951 0 O-C-N 120.702 -1.249 . . . . 0.0 110.82 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.458 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.6 t -149.54 -165.65 2.34 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.114 -1.227 . . . . 0.0 110.604 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -133.64 153.38 51.72 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.179 -0.951 . . . . 0.0 110.396 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.61 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.8 p -133.21 161.57 41.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 121.215 -0.928 . . . . 0.0 110.161 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 34.3 t -167.43 99.1 0.5 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.195 -0.94 . . . . 0.0 111.149 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.962 ' CD1' HD12 ' A' ' 121' ' ' ILE . 81.5 t80 -103.49 160.06 15.05 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.184 -0.947 . . . . 0.0 110.67 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 6.5 m80 -138.23 -60.3 0.62 Allowed 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.834 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -143.97 148.69 35.67 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.446 -0.784 . . . . 0.0 109.184 178.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' CYS . . . . . 0.408 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.8 p -90.21 154.35 19.81 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.997 -1.064 . . . . 0.0 111.131 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.7 p -73.01 -24.71 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.457 0 C-N-CA 119.788 -0.765 . . . . 0.0 111.474 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -49.9 -60.54 2.82 Favored 'General case' 0 N--CA 1.516 2.871 0 O-C-N 120.933 -1.104 . . . . 0.0 110.047 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.504 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.7 p -126.41 -164.7 1.36 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.313 -0.867 . . . . 0.0 110.291 179.262 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 149' ' ' GLY . . . . . 0.431 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -101.34 65.72 0.49 Allowed Glycine 0 N--CA 1.493 2.481 0 N-CA-C 107.831 -2.108 . . . . 0.0 107.831 178.296 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 31.8 t -103.64 142.78 33.72 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.397 -1.06 . . . . 0.0 109.965 -178.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 26.4 mtt-85 -98.55 49.04 0.98 Allowed 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.247 -0.908 . . . . 0.0 109.42 179.002 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 71.56 99.01 0.06 OUTLIER Glycine 0 N--CA 1.486 2.007 0 N-CA-C 109.749 -1.34 . . . . 0.0 109.749 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 p -110.63 126.02 54.04 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.31 -1.112 . . . . 0.0 110.335 179.711 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -146.3 146.42 30.7 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.087 -1.008 . . . . 0.0 110.141 -179.397 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -103.02 -46.9 4.51 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.171 -0.955 . . . . 0.0 110.506 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 1.8 m -63.86 -40.51 96.73 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.056 -1.027 . . . . 0.0 110.012 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 . . . . . 0 N--CA 1.495 1.824 0 CA-C-O 118.039 -0.981 . . . . 0.0 110.56 179.947 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.235 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 120.41 -102.16 0.85 Allowed Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 35.4 p -129.96 163.01 50.25 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.207 -1.172 . . . . 0.0 110.288 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.88 117.44 5.12 Favored 'Trans proline' 0 C--N 1.317 -1.092 0 O-C-N 123.399 1.21 . . . . 0.0 110.49 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.88 53.04 1.22 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.126 -0.984 . . . . 0.0 110.051 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 69.7 mt -117.5 161.38 16.36 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.236 -0.915 . . . . 0.0 110.068 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.8 mmtp -132.36 133.95 44.58 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.205 -0.934 . . . . 0.0 110.17 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.7 t -149.16 -171.06 3.79 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.151 -0.968 . . . . 0.0 110.576 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 82.4 mtt85 -115.72 86.0 2.39 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.245 -0.909 . . . . 0.0 110.068 179.805 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.1 mmt85 -99.97 -39.65 8.04 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.159 -0.963 . . . . 0.0 110.791 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.3 t -111.33 158.48 18.99 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 120.989 -1.069 . . . . 0.0 110.399 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.06 162.91 53.92 Favored Pre-proline 0 N--CA 1.495 1.822 0 O-C-N 121.166 -0.959 . . . . 0.0 110.219 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.48 ' O ' ' HB3' ' A' ' 12' ' ' ALA . 45.3 Cg_endo -71.11 157.69 56.94 Favored 'Trans proline' 0 C--N 1.316 -1.134 0 O-C-N 123.42 1.221 . . . . 0.0 110.717 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.753 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . 62.52 142.33 0.06 OUTLIER Pre-proline 0 N--CA 1.502 2.158 0 O-C-N 121.332 -0.855 . . . . 0.0 110.704 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -73.97 162.5 38.98 Favored 'Trans proline' 0 C--N 1.318 -1.038 0 O-C-N 123.152 1.08 . . . . 0.0 110.599 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -49.26 -31.68 9.34 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 121.351 -0.843 . . . . 0.0 111.329 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.04 -33.95 45.55 Favored Glycine 0 N--CA 1.498 2.808 0 O-C-N 120.961 -1.087 . . . . 0.0 110.695 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -54.65 -32.92 59.92 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 120.862 -1.375 . . . . 0.0 110.734 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -54.33 -38.16 65.69 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 121.083 -1.011 . . . . 0.0 110.256 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -58.15 -35.07 70.99 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.294 -0.879 . . . . 0.0 110.341 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.649 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.7 pt -117.62 35.71 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.157 -0.965 . . . . 0.0 110.604 179.793 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.427 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -83.36 -43.73 0.84 Allowed Pre-proline 0 N--CA 1.509 2.492 0 O-C-N 121.037 -1.039 . . . . 0.0 113.186 -179.286 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.9 Cg_endo -75.48 -36.9 2.03 Favored 'Trans proline' 0 N--CA 1.486 1.087 0 O-C-N 122.656 0.819 . . . . 0.0 111.666 -178.151 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.805 HG21 ' CE2' ' A' ' 62' ' ' TYR . 69.9 m -61.04 -44.91 96.69 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 121.036 -1.04 . . . . 0.0 109.879 -179.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.649 HD12 ' O ' ' A' ' 19' ' ' ILE . 2.5 mt -62.77 -38.31 90.12 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.428 -0.909 . . . . 0.0 109.676 179.461 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.8 m -56.85 -35.04 68.4 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.096 -1.002 . . . . 0.0 110.371 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -56.9 -38.68 73.17 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.054 -1.029 . . . . 0.0 110.001 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.746 ' CD2' HD22 ' A' ' 55' ' ' LEU . 22.3 m-85 -59.05 -40.08 84.02 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.228 -0.92 . . . . 0.0 110.028 179.678 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -61.05 -22.59 64.72 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.266 -0.896 . . . . 0.0 111.501 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.537 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.9 mp -80.84 -36.1 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.465 0 O-C-N 120.836 -1.165 . . . . 0.0 109.571 179.566 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.511 ' HG2' HD11 ' A' ' 55' ' ' LEU . 23.7 tt0 -80.77 -37.11 30.92 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.028 -1.045 . . . . 0.0 108.9 178.378 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.736 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.4 OUTLIER -72.21 -33.51 67.67 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.18 -0.95 . . . . 0.0 110.135 178.896 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.0 ptm180 -70.71 -37.3 73.52 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.884 -1.135 . . . . 0.0 109.791 179.473 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.1 -39.14 92.74 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.04 -1.038 . . . . 0.0 109.54 179.199 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.529 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -66.65 -40.77 88.82 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.218 -0.927 . . . . 0.0 109.516 179.344 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -59.14 -35.77 74.07 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.213 -0.93 . . . . 0.0 110.475 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.9 mttt -94.96 -36.17 11.69 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 121.068 -1.02 . . . . 0.0 110.925 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -57.09 -37.37 71.82 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.007 -1.058 . . . . 0.0 110.379 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -56.61 -39.79 74.21 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.028 -1.045 . . . . 0.0 110.368 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.2 m 52.52 -166.25 0.06 Allowed 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.002 -1.061 . . . . 0.0 110.715 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.2 t -142.87 121.89 12.84 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.202 -0.936 . . . . 0.0 110.291 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.6 tmtm? 52.34 66.27 1.26 Allowed 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.07 -1.019 . . . . 0.0 110.866 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 tt -144.58 -59.14 0.37 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.094 -1.004 . . . . 0.0 110.29 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -130.29 -164.9 1.47 Allowed 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.189 -0.944 . . . . 0.0 110.088 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -113.52 -170.17 1.64 Allowed 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.207 -0.933 . . . . 0.0 110.176 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt 53.06 47.31 24.87 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.123 -0.985 . . . . 0.0 110.742 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -97.32 -39.48 9.2 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.219 -0.925 . . . . 0.0 110.655 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -57.35 -36.54 71.32 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.112 -0.993 . . . . 0.0 110.34 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.423 ' HA ' ' CE3' ' A' ' 50' ' ' TRP . 16.9 mt-10 -58.11 -39.77 79.51 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.137 -0.977 . . . . 0.0 110.201 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 43.4 tp60 -63.22 -43.05 99.21 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.385 -0.926 . . . . 0.0 109.643 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.643 HD23 HD12 ' A' ' 52' ' ' ILE . 12.5 mt -58.76 -37.78 77.02 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.109 -0.995 . . . . 0.0 110.166 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.499 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.8 m0 -59.81 -37.54 79.44 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.17 -0.956 . . . . 0.0 109.955 179.76 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -60.65 -29.77 69.48 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.012 -1.055 . . . . 0.0 109.705 178.331 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.736 HG23 ' CG ' ' A' ' 30' ' ' LEU . 77.2 mt -70.63 -60.42 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.289 0 O-C-N 121.024 -1.048 . . . . 0.0 108.918 179.157 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.6 ptm -61.24 -29.94 70.14 Favored 'General case' 0 N--CA 1.509 2.478 0 C-N-CA 118.691 -1.204 . . . . 0.0 109.778 178.721 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -68.06 -37.6 81.49 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.909 -1.12 . . . . 0.0 109.208 178.264 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.746 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.4 mt -53.22 -33.26 52.1 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.959 -1.088 . . . . 0.0 110.211 179.069 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.459 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 8.2 t60 -55.12 -36.79 66.1 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.057 -1.027 . . . . 0.0 110.178 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.562 ' CD2' HD21 ' A' ' 91' ' ' LEU . 5.8 m170 -59.86 -49.62 77.0 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.086 -1.008 . . . . 0.0 109.365 179.167 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 -61.06 -37.7 83.57 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.324 -0.95 . . . . 0.0 109.17 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.443 ' HD2' ' CD2' ' A' ' 26' ' ' PHE . 6.9 mtp85 -62.23 -49.16 76.83 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.213 -0.929 . . . . 0.0 109.167 178.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 87.5 p -63.34 -39.02 93.39 Favored 'General case' 0 N--CA 1.504 2.233 0 C-N-CA 119.415 -0.914 . . . . 0.0 109.257 179.198 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 33.6 ttp85 -64.67 -40.49 95.51 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.145 -0.972 . . . . 0.0 109.117 178.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.805 ' CE2' HG21 ' A' ' 22' ' ' THR . 38.0 t80 -63.05 -50.88 68.88 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.192 -0.942 . . . . 0.0 109.319 179.295 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.594 HD12 ' HB2' ' A' ' 87' ' ' ALA . 84.0 mt -69.65 -38.16 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.436 0 C-N-CA 119.386 -0.926 . . . . 0.0 109.341 179.27 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.461 ' HD2' HD13 ' A' ' 92' ' ' ILE . 12.4 t80 -66.42 -42.83 87.18 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.103 -0.998 . . . . 0.0 108.989 179.018 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.402 ' HA ' ' CD ' ' A' ' 69' ' ' LYS . 91.2 m -60.83 -40.64 93.55 Favored 'General case' 0 N--CA 1.502 2.173 0 C-N-CA 119.335 -0.946 . . . . 0.0 110.482 -179.625 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.575 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.22 -34.55 25.85 Favored 'General case' 0 N--CA 1.504 2.245 0 C-N-CA 118.796 -1.162 . . . . 0.0 112.54 -178.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.537 ' N ' HD12 ' A' ' 66' ' ' LEU . 33.5 t80 -86.52 -32.2 20.87 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 120.622 -1.299 . . . . 0.0 112.184 -179.212 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -98.35 -18.06 18.52 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.774 -1.203 . . . . 0.0 113.152 -178.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.402 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 4.6 mtpp -115.85 -57.24 2.25 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 120.46 -1.4 . . . . 0.0 110.993 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.5 mtt85 -76.02 -30.11 58.35 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.173 -0.954 . . . . 0.0 110.761 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.3 tptt 59.96 45.08 12.65 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 120.827 -1.17 . . . . 0.0 109.969 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -107.68 34.97 3.27 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.372 -0.83 . . . . 0.0 109.48 178.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.81 HG13 HD23 ' A' ' 77' ' ' LEU . 13.0 tt -151.82 162.68 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.239 -0.913 . . . . 0.0 109.742 -179.683 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 78.3 p -107.23 145.52 32.57 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.088 -1.008 . . . . 0.0 110.02 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -45.36 -32.84 2.23 Favored 'General case' 0 N--CA 1.518 2.932 0 O-C-N 121.328 -0.858 . . . . 0.0 111.455 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -60.94 -48.69 80.66 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 120.93 -1.106 . . . . 0.0 109.32 179.321 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.81 HD23 HG13 ' A' ' 73' ' ' ILE . 47.3 tp -68.26 -44.41 75.68 Favored 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 119.171 -1.011 . . . . 0.0 108.337 178.532 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.43 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 15.3 t80 -59.51 -37.29 77.92 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.389 -0.819 . . . . 0.0 109.557 179.005 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.418 ' O ' HG22 ' A' ' 82' ' ' ILE . 22.9 t70 -76.08 -41.67 49.81 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.125 -0.985 . . . . 0.0 108.842 178.678 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.753 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 82.9 t90 -58.82 -37.96 77.56 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.135 -0.978 . . . . 0.0 109.198 178.692 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.549 HD23 ' CE2' ' A' ' 86' ' ' TYR . 11.9 mt -66.95 -58.04 5.75 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.223 -0.923 . . . . 0.0 108.984 178.821 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.549 HD12 ' HB3' ' A' ' 87' ' ' ALA . 0.6 OUTLIER -56.19 -27.19 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 121.223 -0.923 . . . . 0.0 110.767 -179.976 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.6 ttpm? -89.13 -16.69 30.85 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 120.915 -1.115 . . . . 0.0 111.905 179.711 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.448 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 43.4 mm-40 -105.46 25.63 10.47 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 120.622 -1.299 . . . . 0.0 111.982 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.403 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 0.8 OUTLIER 76.47 68.37 0.06 Allowed 'General case' 0 N--CA 1.512 2.67 0 O-C-N 121.265 -0.897 . . . . 0.0 111.959 179.413 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.608 ' HE2' HD13 ' A' ' 23' ' ' LEU . 27.3 m-85 -131.12 -62.71 0.88 Allowed 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.594 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -134.84 168.4 19.12 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.476 -0.765 . . . . 0.0 109.303 179.281 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.459 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 15.3 t0 -116.09 109.92 18.16 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.093 -1.004 . . . . 0.0 110.555 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.513 ' N ' HD11 ' A' ' 82' ' ' ILE . 17.8 mttt -58.95 -38.04 78.12 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.208 -0.933 . . . . 0.0 109.927 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.64 HD23 HD13 ' A' ' 106' ' ' LEU . 18.0 tp -58.51 -38.22 77.22 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.131 -0.981 . . . . 0.0 110.033 179.799 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.562 HD21 ' CD2' ' A' ' 57' ' ' HIS . 58.4 tp -69.46 -47.23 64.64 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 120.996 -1.065 . . . . 0.0 108.856 179.299 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.461 HD13 ' HD2' ' A' ' 64' ' ' TYR . 72.8 mt -59.65 -39.16 78.85 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.42 0 O-C-N 121.155 -0.966 . . . . 0.0 108.527 178.431 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.17 -39.68 93.24 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.139 -0.976 . . . . 0.0 109.196 178.593 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.428 ' HB3' HD22 ' A' ' 103' ' ' LEU . 6.1 mmtm -56.74 -41.82 78.19 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.069 -1.019 . . . . 0.0 109.578 179.269 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.4 m0 -64.48 -33.65 76.37 Favored 'General case' 0 N--CA 1.507 2.41 0 C-N-CA 119.514 -0.875 . . . . 0.0 110.355 179.514 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -81.81 -34.51 30.23 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.089 -1.007 . . . . 0.0 110.586 179.523 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 25.3 mmtt -50.72 175.11 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.787 0 O-C-N 120.973 -1.079 . . . . 0.0 110.833 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 13.1 t -100.65 141.39 33.59 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.181 -0.949 . . . . 0.0 109.695 179.324 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.72 -24.96 30.09 Favored Glycine 0 N--CA 1.494 2.556 0 C-N-CA 119.888 -1.149 . . . . 0.0 110.523 -179.202 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.624 ' HB3' HD23 ' A' ' 103' ' ' LEU . 65.5 m-85 -91.82 58.11 3.36 Favored 'General case' 0 N--CA 1.503 2.206 0 CA-C-N 119.171 1.486 . . . . 0.0 110.225 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -71.96 -37.19 69.98 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.029 -1.044 . . . . 0.0 110.141 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -124.81 85.38 2.4 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.127 -0.983 . . . . 0.0 110.361 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.624 HD23 ' HB3' ' A' ' 100' ' ' TYR . 0.5 OUTLIER -126.05 150.1 48.38 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.149 -0.97 . . . . 0.0 110.35 179.72 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.476 ' N ' HD12 ' A' ' 103' ' ' LEU . 27.0 p -114.37 -31.35 6.29 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.227 -0.92 . . . . 0.0 113.144 -179.651 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.644 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.0 m -142.59 -167.94 2.63 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.171 -1.581 . . . . 0.0 109.928 179.215 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.64 HD13 HD23 ' A' ' 90' ' ' LEU . 15.3 mt -96.09 -39.56 9.66 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.266 -0.896 . . . . 0.0 109.943 179.035 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 46.7 ttt-85 -101.98 29.68 4.89 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 120.961 -1.087 . . . . 0.0 110.134 178.417 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.644 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.296 1.8 t -126.07 16.63 7.88 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.025 -1.047 . . . . 0.0 108.925 -179.784 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.461 HG23 ' C ' ' A' ' 108' ' ' CYS . 1.5 pt -156.29 34.56 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.17 0 O-C-N 120.791 -1.193 . . . . 0.0 110.776 -178.794 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.716 ' C ' HG23 ' A' ' 119' ' ' THR . 5.8 mt-30 -156.52 160.47 39.53 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 120.795 -1.191 . . . . 0.0 111.122 -179.222 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.451 ' HB3' ' OG1' ' A' ' 119' ' ' THR . 0.0 OUTLIER -116.81 -174.51 2.59 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.214 -0.929 . . . . 0.0 110.361 179.945 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 27.9 t30 -125.77 -57.66 1.43 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.248 -0.908 . . . . 0.0 110.364 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -140.79 -163.56 1.56 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.111 -0.993 . . . . 0.0 110.072 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -94.98 -42.13 8.8 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.125 -0.984 . . . . 0.0 109.916 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -118.34 39.22 3.49 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.15 -0.969 . . . . 0.0 110.113 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -165.75 49.87 0.09 Allowed 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.167 -0.958 . . . . 0.0 110.797 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 139.03 154.73 6.46 Favored Glycine 0 N--CA 1.493 2.455 0 N-CA-C 109.396 -1.482 . . . . 0.0 109.396 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 11.1 m -145.2 -166.12 2.34 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.208 -1.172 . . . . 0.0 110.406 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.716 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.2 OUTLIER -111.32 155.32 23.24 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.263 -0.898 . . . . 0.0 109.983 179.871 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 41.6 t -62.56 152.93 33.49 Favored 'General case' 0 N--CA 1.505 2.275 0 C-N-CA 118.962 -1.095 . . . . 0.0 108.985 179.1 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.81 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -75.57 -36.1 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 121.022 -1.049 . . . . 0.0 111.39 -178.803 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.466 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 10.8 p -53.46 -32.34 49.6 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 120.785 -1.197 . . . . 0.0 111.362 -178.687 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.47 HH12 HG21 ' A' ' 119' ' ' THR . 0.0 OUTLIER -59.91 -34.28 73.0 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 120.842 -1.161 . . . . 0.0 109.526 178.316 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.625 HG12 ' HG ' ' A' ' 129' ' ' LEU . 56.1 t -82.34 125.42 76.62 Favored Pre-proline 0 N--CA 1.503 2.22 0 O-C-N 121.053 -1.03 . . . . 0.0 109.647 179.457 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.511 ' HD3' ' HB1' ' A' ' 154' ' ' ALA . 38.7 Cg_endo -65.56 179.85 1.51 Allowed 'Trans proline' 0 N--CA 1.489 1.226 0 O-C-N 123.159 1.084 . . . . 0.0 110.721 179.589 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 2.6 tpp85 -75.18 -35.93 61.52 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.201 -0.937 . . . . 0.0 110.953 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.42 -47.38 86.35 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.023 -1.048 . . . . 0.0 109.797 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -64.62 -41.53 96.13 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.219 -0.926 . . . . 0.0 109.263 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.625 ' HG ' HG12 ' A' ' 124' ' ' VAL . 52.3 mt -62.59 -39.26 93.18 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.285 -0.884 . . . . 0.0 109.672 179.363 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -59.26 -39.62 83.44 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.102 -0.999 . . . . 0.0 110.059 179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -57.98 -36.53 72.74 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.145 -0.972 . . . . 0.0 110.467 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -59.74 -39.55 85.13 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.169 -0.957 . . . . 0.0 110.27 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.653 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -60.89 -44.91 96.47 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.082 -1.011 . . . . 0.0 109.93 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 10.4 mmt85 -59.72 -38.78 82.62 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.142 -0.974 . . . . 0.0 109.886 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 76.1 mttt -58.9 -36.35 74.55 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.147 -0.971 . . . . 0.0 110.554 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 22.6 mtmt -107.37 21.53 17.36 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.002 -1.061 . . . . 0.0 111.797 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.76 46.04 60.18 Favored Glycine 0 N--CA 1.5 2.918 0 O-C-N 120.648 -1.282 . . . . 0.0 110.545 179.313 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.653 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.9 t -140.6 -165.18 1.88 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.105 -1.232 . . . . 0.0 110.154 179.747 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -127.41 173.59 9.69 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.154 -0.966 . . . . 0.0 110.354 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.2 p -159.1 160.71 1.8 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.975 0 O-C-N 121.225 -0.922 . . . . 0.0 110.774 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 28.3 t -168.95 85.18 0.15 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.215 -0.928 . . . . 0.0 110.995 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.775 ' CG ' HD12 ' A' ' 121' ' ' ILE . 50.9 t80 -95.61 160.92 14.27 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.243 -0.911 . . . . 0.0 110.538 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 38.0 m80 -140.49 -60.54 0.51 Allowed 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.007 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -131.78 151.83 51.39 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.404 -0.81 . . . . 0.0 109.095 178.84 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 145' ' ' CYS . . . . . 0.404 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.8 p -95.57 153.65 17.6 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.027 -1.045 . . . . 0.0 110.96 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 27.3 m -71.98 -25.49 23.97 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.461 0 O-C-N 121.432 -0.793 . . . . 0.0 111.595 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -50.34 -61.67 2.04 Favored 'General case' 0 N--CA 1.514 2.748 0 O-C-N 120.888 -1.133 . . . . 0.0 110.336 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.499 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.3 p -124.56 -164.46 1.27 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.183 -0.948 . . . . 0.0 110.544 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.0 60.45 0.72 Allowed Glycine 0 N--CA 1.492 2.431 0 N-CA-C 108.13 -1.988 . . . . 0.0 108.13 178.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 28.4 t -102.26 142.44 33.48 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.333 -1.098 . . . . 0.0 109.818 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 6.2 mtt85 -99.04 49.04 0.96 Allowed 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.272 -0.892 . . . . 0.0 109.613 179.31 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 73.15 96.55 0.08 OUTLIER Glycine 0 N--CA 1.488 2.163 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.0 p -108.68 126.22 52.74 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.205 -1.174 . . . . 0.0 110.32 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 154' ' ' ALA . . . . . 0.511 ' HB1' ' HD3' ' A' ' 125' ' ' PRO . . . -152.77 148.93 27.81 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.098 -1.001 . . . . 0.0 110.467 -179.402 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 3.5 m -97.16 -38.35 9.75 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.328 -0.857 . . . . 0.0 110.572 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 5.5 m -55.05 -38.9 68.59 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 120.993 -1.067 . . . . 0.0 110.511 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.494 1.74 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.239 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.331 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 69.16 68.08 1.75 Allowed Glycine 0 N--CA 1.493 2.449 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -142.29 173.01 5.07 Favored Pre-proline 0 N--CA 1.494 1.736 0 O-C-N 121.231 -1.158 . . . . 0.0 110.214 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -72.19 -38.34 3.85 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.431 1.227 . . . . 0.0 110.672 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 16.5 ttt-85 53.69 88.59 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.076 -1.015 . . . . 0.0 110.689 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.0 pt -139.27 -172.78 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.189 -0.945 . . . . 0.0 110.264 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -130.28 105.01 7.62 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.132 -0.98 . . . . 0.0 110.233 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.0 p -120.2 -176.67 3.25 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.194 -0.941 . . . . 0.0 110.218 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.0 ttt85 -120.96 147.4 45.52 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.214 -0.929 . . . . 0.0 110.211 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.5 mtt85 -117.92 -174.92 2.73 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.235 -0.916 . . . . 0.0 110.249 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.42 ' OG ' ' N ' ' A' ' 10' ' ' LYS . 81.7 p -139.67 -62.38 0.52 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.171 -0.956 . . . . 0.0 110.197 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.42 ' N ' ' OG ' ' A' ' 9' ' ' SER . 5.2 mptt -129.08 82.93 67.5 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.217 -0.927 . . . . 0.0 110.209 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -73.84 159.77 44.59 Favored 'Trans proline' 0 C--N 1.317 -1.108 0 O-C-N 123.393 1.207 . . . . 0.0 110.696 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.843 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -67.83 135.72 92.24 Favored Pre-proline 0 N--CA 1.512 2.631 0 C-N-CA 119.511 -0.876 . . . . 0.0 109.009 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -84.36 82.68 1.8 Allowed 'Trans proline' 0 C--N 1.32 -0.922 0 O-C-N 123.129 1.068 . . . . 0.0 112.422 -178.216 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 48.73 92.67 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.258 -0.901 . . . . 0.0 111.737 178.314 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.73 -39.05 0.51 Allowed Glycine 0 N--CA 1.499 2.886 0 C-N-CA 119.792 -1.194 . . . . 0.0 110.538 179.407 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.605 ' N ' HD21 ' A' ' 77' ' ' LEU . 19.2 t80 -57.03 -29.74 63.63 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.063 -1.257 . . . . 0.0 110.462 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -52.86 -34.53 54.84 Favored 'General case' 0 N--CA 1.511 2.608 0 O-C-N 120.889 -1.132 . . . . 0.0 110.156 179.259 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.1 mtpp -58.73 -38.61 78.75 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.181 -0.949 . . . . 0.0 110.144 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.57 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.8 pt -116.74 36.58 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.17 -0.956 . . . . 0.0 110.43 179.765 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.423 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -84.08 -43.24 0.76 Allowed Pre-proline 0 N--CA 1.511 2.579 0 O-C-N 121.056 -1.028 . . . . 0.0 113.531 -178.804 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.2 Cg_endo -74.27 -34.55 4.66 Favored 'Trans proline' 0 N--CA 1.487 1.09 0 O-C-N 122.587 0.783 . . . . 0.0 112.043 -177.863 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.783 HG21 ' CE2' ' A' ' 62' ' ' TYR . 84.1 m -60.91 -43.56 98.4 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 120.973 -1.08 . . . . 0.0 110.071 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.57 HD12 ' O ' ' A' ' 19' ' ' ILE . 0.4 OUTLIER -63.46 -39.11 93.59 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.224 -0.923 . . . . 0.0 109.792 179.67 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -57.42 -35.04 69.55 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.102 -0.999 . . . . 0.0 110.29 179.538 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -57.31 -35.94 70.47 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.038 -1.039 . . . . 0.0 110.311 179.63 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.668 ' CD2' HD22 ' A' ' 55' ' ' LEU . 16.1 m-85 -57.67 -39.35 76.89 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.094 -1.003 . . . . 0.0 110.48 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -58.66 -39.69 81.36 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.223 -0.923 . . . . 0.0 110.487 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.42 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.1 mp -65.72 -41.1 89.68 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 C-N-CA 119.221 -0.992 . . . . 0.0 108.83 179.61 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -70.49 -49.59 46.81 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.198 -1.001 . . . . 0.0 108.619 178.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.048 HD11 HG23 ' A' ' 52' ' ' ILE . 0.9 OUTLIER -59.84 -34.46 73.13 Favored 'General case' 0 N--CA 1.507 2.42 0 C-N-CA 119.376 -0.929 . . . . 0.0 109.558 178.508 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 3.7 mtt85 -56.91 -39.63 74.78 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.041 -1.037 . . . . 0.0 110.071 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.48 -47.86 77.37 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.206 -0.997 . . . . 0.0 109.754 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.437 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -69.6 -37.93 77.08 Favored 'General case' 0 N--CA 1.504 2.265 0 C-N-CA 119.225 -0.99 . . . . 0.0 109.512 179.121 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 13.5 mt-30 -66.63 -32.73 74.25 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.222 -0.924 . . . . 0.0 110.277 179.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.1 mttp -95.05 -35.03 12.09 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 120.962 -1.086 . . . . 0.0 110.921 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -56.4 -37.77 70.6 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 120.988 -1.07 . . . . 0.0 110.261 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -58.43 -50.62 73.05 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.15 -0.969 . . . . 0.0 110.075 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 52.05 -166.55 0.05 Allowed 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.094 -1.004 . . . . 0.0 110.754 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.6 m -117.99 103.05 9.54 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.161 -0.962 . . . . 0.0 110.208 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 46.6 mttm 52.71 61.54 3.14 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.082 -1.011 . . . . 0.0 110.807 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.5 tp -121.46 -57.59 1.82 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.085 -1.01 . . . . 0.0 110.32 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -125.88 -164.92 1.36 Allowed 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.155 -0.966 . . . . 0.0 110.271 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -112.45 -169.75 1.53 Allowed 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.218 -0.926 . . . . 0.0 110.154 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 48.5 tttt 53.0 50.15 18.59 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.062 -1.024 . . . . 0.0 110.609 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -97.04 -40.68 8.73 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.236 -0.915 . . . . 0.0 110.488 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -58.63 -39.67 81.16 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.109 -0.994 . . . . 0.0 110.048 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -62.73 -42.5 99.69 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.266 -0.896 . . . . 0.0 109.829 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 58.1 tp60 -60.42 -39.26 86.78 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.168 -0.957 . . . . 0.0 109.872 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -57.85 -38.43 75.65 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.122 -0.986 . . . . 0.0 110.062 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.499 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.1 m0 -58.01 -36.12 72.24 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.157 -0.964 . . . . 0.0 109.989 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -61.95 -29.28 70.13 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.064 -1.022 . . . . 0.0 109.79 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 1.048 HG23 HD11 ' A' ' 30' ' ' LEU . 22.1 mt -72.26 -59.28 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.201 0 O-C-N 120.942 -1.099 . . . . 0.0 109.181 179.429 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.6 ptm -58.85 -27.89 65.56 Favored 'General case' 0 N--CA 1.511 2.6 0 C-N-CA 118.45 -1.3 . . . . 0.0 109.827 178.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.5 mm100 -69.86 -37.66 76.18 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 120.823 -1.173 . . . . 0.0 109.05 177.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.668 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.2 mt -53.36 -32.61 50.09 Favored 'General case' 0 N--CA 1.512 2.65 0 O-C-N 120.951 -1.093 . . . . 0.0 110.128 179.007 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.439 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 23.0 t60 -55.83 -36.82 67.9 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.145 -0.972 . . . . 0.0 110.198 179.73 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.424 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 7.4 m170 -59.64 -48.9 79.86 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.095 -1.003 . . . . 0.0 109.387 179.237 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.2 tp60 -58.37 -34.19 70.42 Favored 'General case' 0 N--CA 1.508 2.435 0 C-N-CA 119.461 -0.896 . . . . 0.0 109.573 178.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.467 ' HD3' ' CD1' ' A' ' 26' ' ' PHE . 38.8 mmm-85 -64.77 -52.87 54.64 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.031 -1.043 . . . . 0.0 109.28 179.066 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 84.5 p -64.02 -40.04 95.44 Favored 'General case' 0 N--CA 1.503 2.187 0 C-N-CA 119.3 -0.96 . . . . 0.0 108.997 179.203 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.423 ' HD3' ' OG1' ' A' ' 65' ' ' THR . 0.1 OUTLIER -63.11 -40.17 96.84 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.197 -0.939 . . . . 0.0 109.051 178.856 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.783 ' CE2' HG21 ' A' ' 22' ' ' THR . 30.5 t80 -63.58 -53.33 53.33 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.098 -1.001 . . . . 0.0 109.009 179.212 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.903 HD12 ' HB2' ' A' ' 87' ' ' ALA . 75.8 mt -65.64 -37.18 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.333 0 C-N-CA 119.223 -0.991 . . . . 0.0 109.19 179.307 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.438 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 8.1 t80 -66.03 -41.55 90.77 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.059 -1.026 . . . . 0.0 108.778 178.704 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.423 ' OG1' ' HD3' ' A' ' 61' ' ' ARG . 91.7 m -59.28 -41.44 88.92 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.211 -0.931 . . . . 0.0 110.806 -179.453 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.633 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.06 -34.9 26.1 Favored 'General case' 0 N--CA 1.505 2.282 0 C-N-CA 118.764 -1.174 . . . . 0.0 112.823 -178.523 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.56 ' N ' HD12 ' A' ' 66' ' ' LEU . 52.0 t80 -86.27 -32.02 21.32 Favored 'General case' 0 N--CA 1.514 2.751 0 O-C-N 120.564 -1.335 . . . . 0.0 111.961 -179.345 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.438 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 11.8 m-85 -97.05 -16.82 20.36 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 120.729 -1.232 . . . . 0.0 112.584 -178.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.419 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 5.8 mttt -124.74 -59.6 1.43 Allowed 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.495 -1.378 . . . . 0.0 110.996 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.406 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 5.2 ttt85 -59.94 -30.38 69.03 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.03 -1.044 . . . . 0.0 110.906 -179.387 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 27.2 tptt 57.1 41.2 27.69 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.803 -1.185 . . . . 0.0 110.131 -179.442 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.06 37.47 3.66 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.399 -0.813 . . . . 0.0 109.725 179.375 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.633 HG21 ' CD1' ' A' ' 66' ' ' LEU . 13.7 tt -154.23 162.77 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 121.249 -0.907 . . . . 0.0 109.904 -179.73 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 4.9 p -110.08 149.7 29.65 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.092 -1.005 . . . . 0.0 110.354 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 71.5 tttt -45.79 -32.35 2.5 Favored 'General case' 0 N--CA 1.515 2.799 0 O-C-N 121.338 -0.851 . . . . 0.0 111.596 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -65.49 -47.02 77.48 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 120.846 -1.159 . . . . 0.0 109.51 179.517 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.605 HD21 ' N ' ' A' ' 16' ' ' PHE . 0.3 OUTLIER -67.48 -41.61 84.27 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.183 -0.948 . . . . 0.0 108.727 179.02 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.453 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 14.6 t80 -67.85 -41.07 83.51 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.265 -0.897 . . . . 0.0 109.188 179.135 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -72.11 -40.7 67.98 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.19 -0.944 . . . . 0.0 108.795 178.736 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.843 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 80.5 t90 -55.11 -37.92 67.49 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.265 -0.897 . . . . 0.0 109.532 178.904 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.545 HD22 ' CD2' ' A' ' 86' ' ' TYR . 17.1 mt -69.69 -48.84 58.27 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 119.344 -0.942 . . . . 0.0 108.561 178.791 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.558 HD12 ' HG3' ' A' ' 89' ' ' LYS . 35.4 mm -57.4 -32.72 42.1 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.573 0 O-C-N 121.281 -0.887 . . . . 0.0 109.904 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.8 tttt -86.87 -23.9 25.09 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.952 -1.092 . . . . 0.0 111.589 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.428 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 16.7 mm-40 -97.39 19.4 13.31 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 120.707 -1.246 . . . . 0.0 111.948 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 28.2 tttt 73.38 80.53 0.13 Allowed 'General case' 0 N--CA 1.51 2.565 0 O-C-N 120.914 -1.116 . . . . 0.0 111.327 179.268 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.545 ' CD2' HD22 ' A' ' 81' ' ' LEU . 29.3 m-85 -137.24 -64.03 0.58 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.546 -0.722 . . . . 0.0 109.932 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.903 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -118.31 -172.55 2.29 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.419 -0.8 . . . . 0.0 109.593 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.439 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 7.1 t0 -122.56 102.77 8.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.058 -1.026 . . . . 0.0 110.373 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.558 ' HG3' HD12 ' A' ' 82' ' ' ILE . 12.0 mtpt -64.35 -40.19 95.38 Favored 'General case' 0 N--CA 1.508 2.429 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.63 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.574 HD23 HD13 ' A' ' 106' ' ' LEU . 32.4 tp -59.78 -37.21 78.44 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.23 -0.918 . . . . 0.0 110.056 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.564 HD21 ' CH2' ' A' ' 95' ' ' TRP . 34.3 tp -71.73 -48.16 48.86 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.005 -1.059 . . . . 0.0 108.756 179.142 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.485 HG22 ' HD2' ' A' ' 96' ' ' ARG . 50.7 mt -58.86 -36.19 60.01 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 C-N-CA 119.378 -0.929 . . . . 0.0 108.7 178.293 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.94 -39.48 83.44 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.128 -0.983 . . . . 0.0 109.062 178.435 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.427 ' HB3' ' CD2' ' A' ' 103' ' ' LEU . 7.1 mmtt -58.49 -44.35 89.34 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.139 -0.975 . . . . 0.0 109.364 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.564 ' CH2' HD21 ' A' ' 91' ' ' LEU . 7.8 m0 -65.72 -41.19 92.58 Favored 'General case' 0 N--CA 1.507 2.406 0 C-N-CA 119.557 -0.857 . . . . 0.0 109.506 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.485 ' HD2' HG22 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -65.71 -33.29 75.53 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.283 -0.885 . . . . 0.0 110.425 179.479 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.1 mmtp -54.31 -176.78 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.646 0 O-C-N 121.056 -1.028 . . . . 0.0 110.535 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 32.1 m -105.87 132.75 51.61 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.172 -0.955 . . . . 0.0 109.85 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 98.57 10.92 49.23 Favored Glycine 0 N--CA 1.492 2.427 0 C-N-CA 120.213 -0.994 . . . . 0.0 111.087 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -115.97 69.51 0.74 Allowed 'General case' 0 N--CA 1.495 1.778 0 CA-C-N 119.487 1.644 . . . . 0.0 110.117 179.75 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -92.08 -38.95 11.89 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.221 -0.924 . . . . 0.0 109.96 179.59 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -110.15 78.5 1.13 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.151 -0.968 . . . . 0.0 109.61 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.937 HD13 HD13 ' A' ' 109' ' ' ILE . 8.9 tp -122.23 137.87 54.69 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.242 -0.911 . . . . 0.0 109.823 -179.24 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.424 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 28.1 p -111.61 -38.6 4.86 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.234 -0.916 . . . . 0.0 112.483 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.821 ' O ' HD11 ' A' ' 103' ' ' LEU . 6.9 m -138.76 -168.49 2.42 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.17 -1.581 . . . . 0.0 109.85 179.077 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.574 HD13 HD23 ' A' ' 90' ' ' LEU . 13.9 mt -97.48 -38.15 9.7 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.177 -0.952 . . . . 0.0 110.295 179.189 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -102.2 31.34 4.02 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 120.953 -1.092 . . . . 0.0 109.804 178.221 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.676 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.7 t -125.86 16.28 8.01 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.131 -0.981 . . . . 0.0 108.929 -179.592 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.937 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -159.01 38.01 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.38 0 O-C-N 120.922 -1.111 . . . . 0.0 110.4 -178.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.575 ' O ' HG23 ' A' ' 119' ' ' THR . 2.0 tt0 -117.86 134.54 54.83 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.739 -1.226 . . . . 0.0 111.698 -178.273 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.497 ' HA ' ' HG1' ' A' ' 119' ' ' THR . 0.4 OUTLIER -138.73 155.56 48.12 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.372 -0.83 . . . . 0.0 110.122 179.357 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -135.95 165.9 24.59 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.171 -0.956 . . . . 0.0 110.185 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 52.86 -165.17 0.07 Allowed 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.035 -1.041 . . . . 0.0 110.55 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 31.8 m -109.29 110.76 22.03 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.085 -1.009 . . . . 0.0 109.989 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.5 m120 52.86 38.09 25.89 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.062 -1.024 . . . . 0.0 110.803 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -159.09 50.49 0.36 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.173 -0.954 . . . . 0.0 110.832 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -136.6 -158.0 7.9 Favored Glycine 0 N--CA 1.494 2.514 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 4.0 m -120.21 107.71 13.32 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.16 -1.2 . . . . 0.0 110.247 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.575 HG23 ' O ' ' A' ' 110' ' ' GLN . 4.4 m -138.01 166.71 23.4 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.223 -0.923 . . . . 0.0 110.249 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 48.6 t -87.17 154.15 20.95 Favored 'General case' 0 N--CA 1.499 2.017 0 C-N-CA 119.499 -0.88 . . . . 0.0 109.202 179.053 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.804 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -72.64 -36.11 52.46 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.433 0 O-C-N 121.16 -0.962 . . . . 0.0 111.012 -179.225 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 7.9 p -55.46 -34.32 64.42 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 120.846 -1.158 . . . . 0.0 110.911 -178.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.481 ' HG3' HG22 ' A' ' 109' ' ' ILE . 16.8 ttt-85 -59.32 -36.43 75.62 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 120.995 -1.066 . . . . 0.0 109.681 178.435 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 61.0 t -76.19 125.42 87.87 Favored Pre-proline 0 N--CA 1.504 2.24 0 O-C-N 121.171 -0.956 . . . . 0.0 109.795 179.773 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.495 ' O ' HD12 ' A' ' 129' ' ' LEU . 37.5 Cg_endo -64.02 178.2 1.59 Allowed 'Trans proline' 0 N--CA 1.49 1.283 0 O-C-N 123.228 1.12 . . . . 0.0 110.791 179.521 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.09 -37.27 61.61 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.22 -0.925 . . . . 0.0 110.635 -179.582 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.41 -41.64 85.4 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.013 -1.054 . . . . 0.0 109.929 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 37.3 tp60 -68.8 -41.44 78.69 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 119.395 -0.922 . . . . 0.0 109.103 179.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.62 HD11 HD11 ' A' ' 121' ' ' ILE . 3.9 mt -62.54 -38.69 90.99 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.288 -0.883 . . . . 0.0 109.757 179.306 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -60.2 -39.83 87.97 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.193 -0.942 . . . . 0.0 109.971 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -58.08 -35.88 72.03 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.151 -0.968 . . . . 0.0 110.475 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -59.98 -40.99 91.03 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.152 -0.968 . . . . 0.0 110.164 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.705 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -61.72 -45.02 95.76 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.144 -0.972 . . . . 0.0 109.798 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 15.2 mtp85 -58.69 -38.7 78.82 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.208 -0.932 . . . . 0.0 109.929 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -58.01 -36.38 72.59 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.17 -0.956 . . . . 0.0 110.486 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 2.6 mtpm? -107.82 21.08 17.94 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.008 -1.057 . . . . 0.0 111.806 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 53.88 45.87 69.62 Favored Glycine 0 N--CA 1.499 2.85 0 O-C-N 120.572 -1.33 . . . . 0.0 110.467 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.705 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.7 t -141.68 -164.36 1.76 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.217 -1.167 . . . . 0.0 110.145 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -130.46 155.1 47.01 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.12 -0.988 . . . . 0.0 110.237 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.512 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.4 p -131.51 161.52 41.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.213 -0.929 . . . . 0.0 110.148 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 31.2 t -165.53 86.01 0.37 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.24 -0.913 . . . . 0.0 111.087 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.764 ' CG ' HD12 ' A' ' 121' ' ' ILE . 52.0 t80 -97.26 159.57 14.84 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.216 -0.927 . . . . 0.0 110.382 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 22.5 m80 -138.08 -61.13 0.62 Allowed 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 179.107 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -133.73 151.01 51.5 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.418 -0.801 . . . . 0.0 108.93 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' CYS . . . . . 0.402 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.6 p -91.98 152.53 19.97 Favored 'General case' 0 N--CA 1.505 2.285 0 C-N-CA 119.063 -1.055 . . . . 0.0 111.142 -179.581 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 23.2 m -69.71 -26.46 30.69 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.449 0 C-N-CA 119.748 -0.781 . . . . 0.0 111.347 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 63.4 m170 -50.91 -60.18 3.35 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 120.84 -1.163 . . . . 0.0 110.142 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.499 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 25.7 p -126.82 -167.41 1.72 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.3 -0.875 . . . . 0.0 110.797 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 149' ' ' GLY . . . . . 0.404 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -98.98 58.17 0.89 Allowed Glycine 0 N--CA 1.491 2.346 0 N-CA-C 108.04 -2.024 . . . . 0.0 108.04 178.629 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 16.8 t -99.67 145.97 27.01 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.442 -1.034 . . . . 0.0 109.755 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 4.9 ttm-85 -97.83 50.79 1.04 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.226 -0.922 . . . . 0.0 109.318 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.31 97.33 0.03 OUTLIER Glycine 0 N--CA 1.486 2.019 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.1 p -109.09 128.23 54.81 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.293 -1.122 . . . . 0.0 110.327 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -143.02 130.23 20.87 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.069 -1.02 . . . . 0.0 110.099 -179.63 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -96.04 -38.33 10.25 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.17 -0.957 . . . . 0.0 110.606 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 3.1 m -54.36 -38.43 66.07 Favored 'General case' 0 N--CA 1.512 2.66 0 O-C-N 121.02 -1.05 . . . . 0.0 110.614 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.216 179.98 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.333 0 N-CA-C 109.551 -1.419 . . . . 0.0 109.551 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -107.55 -97.08 2.49 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.4 t -117.5 148.84 43.69 Favored Pre-proline 0 N--CA 1.494 1.733 0 O-C-N 121.158 -1.201 . . . . 0.0 110.293 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -72.74 138.81 29.67 Favored 'Trans proline' 0 C--N 1.317 -1.114 0 O-C-N 123.392 1.206 . . . . 0.0 110.432 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.85 169.5 9.81 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.166 -0.958 . . . . 0.0 110.237 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 37.2 pt -143.26 157.86 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 O-C-N 121.163 -0.961 . . . . 0.0 110.289 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.9 mtmm -118.53 146.46 44.54 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.174 -0.954 . . . . 0.0 110.14 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.7 m -129.61 119.42 23.56 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.143 -0.973 . . . . 0.0 110.246 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.5 tpp85 -140.9 76.16 1.54 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.19 -0.944 . . . . 0.0 110.168 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.05 -164.43 1.89 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.229 -0.919 . . . . 0.0 110.156 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 45.9 t -112.24 -174.91 2.56 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.123 -0.985 . . . . 0.0 110.153 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.6 mmmm -140.02 155.47 70.78 Favored Pre-proline 0 N--CA 1.494 1.763 0 O-C-N 121.164 -0.96 . . . . 0.0 110.333 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.43 162.64 40.91 Favored 'Trans proline' 0 C--N 1.318 -1.069 0 O-C-N 123.543 1.286 . . . . 0.0 110.672 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.676 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -84.17 143.73 42.89 Favored Pre-proline 0 N--CA 1.504 2.269 0 O-C-N 121.416 -0.802 . . . . 0.0 109.655 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -71.95 166.41 29.65 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 O-C-N 123.308 1.162 . . . . 0.0 110.835 -179.667 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -47.97 -31.93 5.87 Favored 'General case' 0 N--CA 1.515 2.825 0 O-C-N 121.507 -0.745 . . . . 0.0 111.529 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.49 -34.46 34.74 Favored Glycine 0 N--CA 1.5 2.931 0 O-C-N 120.96 -1.087 . . . . 0.0 110.585 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.405 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 26.0 t80 -55.56 -33.27 63.72 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 120.938 -1.33 . . . . 0.0 110.555 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -54.32 -37.8 65.26 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.046 -1.034 . . . . 0.0 110.167 179.736 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.5 mtpt -57.4 -36.56 71.44 Favored 'General case' 0 N--CA 1.511 2.585 0 O-C-N 121.298 -0.877 . . . . 0.0 110.117 179.467 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.743 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.8 pt -118.69 35.28 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.2 -0.937 . . . . 0.0 110.388 179.453 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -83.73 -43.37 0.8 Allowed Pre-proline 0 N--CA 1.508 2.457 0 O-C-N 120.976 -1.077 . . . . 0.0 113.105 -179.087 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.8 Cg_endo -76.27 -36.4 1.85 Allowed 'Trans proline' 0 N--CA 1.487 1.113 0 O-C-N 122.583 0.78 . . . . 0.0 111.506 -178.464 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.825 HG21 ' CE2' ' A' ' 62' ' ' TYR . 78.5 m -59.8 -42.92 94.5 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.02 -1.05 . . . . 0.0 110.092 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.743 HD12 ' O ' ' A' ' 19' ' ' ILE . 2.7 mt -64.37 -39.84 94.66 Favored 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.672 179.601 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -57.97 -35.27 70.93 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.107 -0.996 . . . . 0.0 110.228 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -56.22 -34.52 66.4 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.127 -0.983 . . . . 0.0 110.528 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.669 ' CD1' HD22 ' A' ' 55' ' ' LEU . 13.9 m-85 -58.52 -40.35 82.65 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.037 -1.04 . . . . 0.0 110.642 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -60.41 -39.93 89.16 Favored 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.653 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.425 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.2 mp -66.08 -39.96 85.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.381 0 C-N-CA 119.195 -1.002 . . . . 0.0 109.126 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -70.34 -49.15 52.32 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.081 -1.012 . . . . 0.0 108.689 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.665 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -62.91 -32.94 74.33 Favored 'General case' 0 N--CA 1.508 2.433 0 C-N-CA 119.229 -0.988 . . . . 0.0 108.926 178.186 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 23.1 mtt180 -56.9 -40.31 76.04 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.009 -1.057 . . . . 0.0 110.018 179.387 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -62.9 -51.09 68.32 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.252 -0.979 . . . . 0.0 109.417 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.585 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -65.75 -40.35 92.0 Favored 'General case' 0 N--CA 1.504 2.263 0 C-N-CA 119.227 -0.989 . . . . 0.0 109.11 179.038 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.439 ' CG ' HD23 ' A' ' 30' ' ' LEU . 5.4 mm100 -62.74 -38.59 91.13 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.178 -0.951 . . . . 0.0 109.641 179.398 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.0 mmtm -60.5 -39.26 87.1 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.134 -0.979 . . . . 0.0 110.02 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -58.09 -38.67 76.86 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.142 -0.973 . . . . 0.0 110.114 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 35.2 tttm -56.33 -37.38 69.9 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.131 -0.981 . . . . 0.0 110.422 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 83.1 p -109.6 39.41 2.11 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.222 -0.924 . . . . 0.0 110.275 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.7 m -148.56 -59.37 0.23 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.22 -0.925 . . . . 0.0 110.217 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -137.69 101.49 4.48 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.294 -0.879 . . . . 0.0 109.924 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.6 tp -113.53 50.21 0.92 Allowed 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.21 -0.931 . . . . 0.0 110.244 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -118.04 -57.36 2.1 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.242 -0.911 . . . . 0.0 110.193 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -121.85 149.85 42.77 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.137 -0.977 . . . . 0.0 110.178 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.7 mtmt 52.47 49.01 21.39 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.993 -1.067 . . . . 0.0 110.819 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.9 p -111.15 -52.71 2.77 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.195 -0.941 . . . . 0.0 110.553 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -55.91 -37.97 69.62 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.163 -0.96 . . . . 0.0 110.142 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -61.01 -40.96 95.55 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.17 -0.957 . . . . 0.0 109.823 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -62.64 -40.23 96.37 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.195 -0.941 . . . . 0.0 109.82 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.477 HD23 HD12 ' A' ' 52' ' ' ILE . 12.5 mt -59.46 -38.03 79.69 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.203 -0.935 . . . . 0.0 110.26 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.492 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.5 m0 -58.36 -36.67 73.81 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.038 -1.039 . . . . 0.0 110.127 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -62.33 -30.34 71.09 Favored 'General case' 0 N--CA 1.506 2.327 0 C-N-CA 119.204 -0.998 . . . . 0.0 109.983 178.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.665 HG23 ' CG ' ' A' ' 30' ' ' LEU . 69.6 mt -71.91 -57.09 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.269 0 O-C-N 120.913 -1.117 . . . . 0.0 109.466 179.526 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.5 ptm -61.13 -29.48 69.8 Favored 'General case' 0 N--CA 1.509 2.49 0 C-N-CA 118.414 -1.314 . . . . 0.0 109.704 178.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -67.82 -37.42 81.93 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.841 -1.162 . . . . 0.0 109.09 178.085 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.669 HD22 ' CD1' ' A' ' 26' ' ' PHE . 11.0 mt -53.15 -31.87 44.72 Favored 'General case' 0 N--CA 1.512 2.636 0 O-C-N 120.965 -1.084 . . . . 0.0 110.169 178.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.466 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 70.6 t60 -54.79 -39.3 68.29 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.038 -1.038 . . . . 0.0 109.828 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.51 ' CD2' HD21 ' A' ' 91' ' ' LEU . 5.7 m170 -59.49 -46.61 88.31 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.158 -0.964 . . . . 0.0 109.404 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.9 tp-100 -59.44 -34.93 73.11 Favored 'General case' 0 N--CA 1.506 2.349 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.489 178.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.446 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 8.2 mmm-85 -65.39 -53.33 44.86 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.041 -1.037 . . . . 0.0 109.194 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 12.3 p -61.65 -38.58 88.23 Favored 'General case' 0 N--CA 1.505 2.277 0 C-N-CA 119.3 -0.96 . . . . 0.0 109.357 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.426 ' O ' ' OG1' ' A' ' 65' ' ' THR . 6.3 ttt85 -65.1 -41.37 95.02 Favored 'General case' 0 N--CA 1.504 2.259 0 C-N-CA 119.216 -0.993 . . . . 0.0 109.221 179.064 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.825 ' CE2' HG21 ' A' ' 22' ' ' THR . 40.1 t80 -62.62 -49.54 74.8 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.17 -0.956 . . . . 0.0 109.547 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.751 HD12 ' HB2' ' A' ' 87' ' ' ALA . 85.4 mt -71.85 -38.85 66.62 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.327 0 O-C-N 121.204 -0.935 . . . . 0.0 109.448 179.564 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.405 ' HD2' HD13 ' A' ' 92' ' ' ILE . 9.4 t80 -66.03 -42.25 89.86 Favored 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.107 -0.996 . . . . 0.0 108.832 178.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.426 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 91.6 m -60.97 -42.17 97.78 Favored 'General case' 0 N--CA 1.504 2.239 0 C-N-CA 119.253 -0.979 . . . . 0.0 110.171 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.567 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.1 -33.11 26.42 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.962 -1.086 . . . . 0.0 112.474 -178.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.495 ' N ' HD12 ' A' ' 66' ' ' LEU . 36.3 t80 -86.33 -32.86 20.78 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 120.554 -1.341 . . . . 0.0 111.896 -179.158 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -97.54 -21.1 17.29 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 120.878 -1.138 . . . . 0.0 112.527 -178.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.414 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 6.9 mtpt -118.3 -59.65 1.87 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 120.56 -1.337 . . . . 0.0 110.808 179.778 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.415 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 11.3 ttt85 -62.16 -29.7 70.54 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.129 -0.982 . . . . 0.0 110.865 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.2 mtpt 56.27 42.32 28.06 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.938 -1.102 . . . . 0.0 110.171 -179.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.51 35.6 3.95 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.444 -0.785 . . . . 0.0 110.0 179.368 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.776 HG13 HD23 ' A' ' 77' ' ' LEU . 14.1 tt -153.87 162.27 2.14 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.202 -0.936 . . . . 0.0 109.974 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 50.4 m -110.0 148.29 31.94 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.181 -0.95 . . . . 0.0 110.136 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.2 tttm -46.77 -31.72 3.18 Favored 'General case' 0 N--CA 1.515 2.781 0 O-C-N 121.302 -0.874 . . . . 0.0 111.55 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -62.88 -52.01 64.74 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 120.836 -1.165 . . . . 0.0 109.261 179.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.776 HD23 HG13 ' A' ' 73' ' ' ILE . 22.4 tp -64.76 -45.68 85.36 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 119.232 -0.987 . . . . 0.0 108.469 178.834 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.759 ' HA ' HD12 ' A' ' 81' ' ' LEU . 11.8 t80 -59.3 -40.84 87.47 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.337 -0.852 . . . . 0.0 109.424 179.177 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -71.65 -43.14 66.61 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.178 -0.951 . . . . 0.0 108.506 178.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.676 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 88.7 t90 -57.0 -34.68 68.38 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.229 -0.92 . . . . 0.0 109.353 178.436 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.759 HD12 ' HA ' ' A' ' 78' ' ' TYR . 11.3 mt -67.11 -59.89 3.08 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.115 -0.991 . . . . 0.0 108.889 179.012 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.423 HG13 ' HB3' ' A' ' 87' ' ' ALA . 5.4 mt -57.97 -26.51 28.86 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.555 0 O-C-N 120.941 -1.1 . . . . 0.0 110.035 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.9 tttp -80.03 -19.07 48.53 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 120.869 -1.144 . . . . 0.0 110.853 178.323 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.442 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 8.3 mm-40 -108.47 23.11 14.99 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 120.752 -1.217 . . . . 0.0 111.984 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.415 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 1.5 tmtt? 76.83 69.82 0.06 Allowed 'General case' 0 N--CA 1.515 2.794 0 O-C-N 121.148 -0.97 . . . . 0.0 111.882 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.678 ' HE2' HD13 ' A' ' 23' ' ' LEU . 21.8 m-85 -130.95 -62.34 0.9 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.488 -0.758 . . . . 0.0 109.215 179.354 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.751 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -127.75 166.99 17.11 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.458 -0.776 . . . . 0.0 109.812 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.466 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 19.1 t0 -115.41 109.45 17.89 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.231 -0.918 . . . . 0.0 110.156 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.44 -38.09 73.87 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.216 -0.927 . . . . 0.0 110.171 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.46 HD23 HD22 ' A' ' 106' ' ' LEU . 11.2 tp -59.52 -38.77 81.85 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.178 -0.951 . . . . 0.0 110.179 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.51 HD21 ' CD2' ' A' ' 57' ' ' HIS . 55.6 tp -68.32 -50.02 56.3 Favored 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 119.17 -1.012 . . . . 0.0 109.164 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.405 HD13 ' HD2' ' A' ' 64' ' ' TYR . 68.9 mt -60.94 -37.57 77.32 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 C-N-CA 119.117 -1.033 . . . . 0.0 108.817 178.645 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.81 -38.67 86.92 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.082 -1.011 . . . . 0.0 109.086 178.437 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.484 ' HB3' HD22 ' A' ' 103' ' ' LEU . 9.7 mmtm -58.3 -44.85 88.74 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.105 -0.997 . . . . 0.0 109.565 179.345 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 3.2 m0 -60.68 -35.86 77.31 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.317 -0.865 . . . . 0.0 110.053 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.83 -32.79 40.64 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.105 -0.997 . . . . 0.0 110.491 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 10.3 mmtp -51.66 177.93 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.728 0 O-C-N 120.952 -1.092 . . . . 0.0 110.841 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 3.5 m -105.4 141.77 36.33 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.22 -0.925 . . . . 0.0 109.39 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 103.68 -29.15 12.78 Favored Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.896 -1.282 . . . . 0.0 109.896 -179.046 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.603 ' HB3' HD23 ' A' ' 103' ' ' LEU . 55.9 m-85 -92.98 57.76 2.84 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 120.906 -1.349 . . . . 0.0 109.986 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.425 ' HB2' ' OG ' ' A' ' 155' ' ' SER . 5.4 mt-10 -63.02 -37.73 88.34 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 120.972 -1.08 . . . . 0.0 110.287 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -131.91 83.25 2.07 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.071 -1.018 . . . . 0.0 110.636 -179.781 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.603 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.2 pp -114.49 147.51 39.23 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.243 -0.911 . . . . 0.0 109.951 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.428 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.4 p -109.22 -27.63 9.45 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.215 -0.928 . . . . 0.0 113.003 -179.383 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.654 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 11.5 m -143.73 -167.72 2.66 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.202 -1.562 . . . . 0.0 109.789 179.107 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.46 HD22 HD23 ' A' ' 90' ' ' LEU . 13.2 mt -95.97 -38.54 10.19 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.149 -0.97 . . . . 0.0 110.098 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 22.6 ttt180 -103.37 31.73 4.18 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 120.972 -1.08 . . . . 0.0 109.876 178.31 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.654 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.7 t -128.38 19.44 6.32 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.266 -0.897 . . . . 0.0 108.733 -179.632 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.497 HG22 ' HG3' ' A' ' 123' ' ' ARG . 1.4 pt -158.34 39.01 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.345 0 O-C-N 120.974 -1.079 . . . . 0.0 110.064 -178.783 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.795 ' C ' HG23 ' A' ' 119' ' ' THR . 0.0 OUTLIER -93.11 101.12 13.42 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 120.95 -1.094 . . . . 0.0 111.004 -178.633 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.418 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 19.1 ttmt -103.31 -50.61 3.42 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.31 -0.869 . . . . 0.0 110.029 179.381 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -120.4 118.17 29.62 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.196 -0.94 . . . . 0.0 110.179 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -153.32 -173.03 4.43 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.219 -0.926 . . . . 0.0 110.72 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 75.9 p -116.21 43.89 2.07 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.221 -0.924 . . . . 0.0 110.168 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -133.18 -165.16 1.58 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.187 -0.946 . . . . 0.0 110.151 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -115.85 64.8 0.7 Allowed 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.198 -0.939 . . . . 0.0 110.19 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -133.92 -155.27 7.56 Favored Glycine 0 N--CA 1.493 2.454 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 10.0 m -143.9 -165.18 2.05 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.171 -1.193 . . . . 0.0 110.237 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.795 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.9 OUTLIER -114.52 158.05 22.16 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.249 -0.907 . . . . 0.0 110.175 179.953 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.432 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 49.9 t -82.19 153.9 25.73 Favored 'General case' 0 N--CA 1.499 2.005 0 C-N-CA 119.213 -0.995 . . . . 0.0 108.705 178.596 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.964 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -75.52 -30.62 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.52 0 O-C-N 121.053 -1.03 . . . . 0.0 111.759 -178.702 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.495 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 14.2 p -58.94 -35.41 73.07 Favored 'General case' 0 N--CA 1.511 2.61 0 O-C-N 120.692 -1.255 . . . . 0.0 110.869 -179.037 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.497 ' HG3' HG22 ' A' ' 109' ' ' ILE . 0.0 OUTLIER -57.12 -30.41 64.37 Favored 'General case' 0 N--CA 1.51 2.557 0 O-C-N 120.917 -1.114 . . . . 0.0 110.261 179.034 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.4 t -83.06 124.35 76.59 Favored Pre-proline 0 N--CA 1.505 2.298 0 O-C-N 121.061 -1.024 . . . . 0.0 110.147 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -66.17 174.8 5.51 Favored 'Trans proline' 0 N--CA 1.49 1.27 0 O-C-N 123.138 1.072 . . . . 0.0 110.774 179.462 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 31.1 mmm-85 -75.08 -37.0 61.7 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.216 -0.927 . . . . 0.0 110.57 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.36 -40.65 78.56 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 120.996 -1.065 . . . . 0.0 110.044 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 38.6 tp60 -69.35 -41.98 75.87 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.338 -0.945 . . . . 0.0 109.128 179.296 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.654 HD11 HD11 ' A' ' 121' ' ' ILE . 8.0 mt -65.23 -39.47 92.77 Favored 'General case' 0 N--CA 1.505 2.304 0 C-N-CA 119.461 -0.895 . . . . 0.0 109.407 179.044 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -59.84 -39.0 83.67 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.17 -0.956 . . . . 0.0 109.994 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -59.78 -40.07 87.01 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.127 -0.983 . . . . 0.0 110.054 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -61.62 -44.29 97.27 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.189 -0.944 . . . . 0.0 109.819 179.79 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.453 ' HB1' ' HA ' ' A' ' 139' ' ' GLN . . . -60.94 -41.41 96.21 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.209 -0.932 . . . . 0.0 109.953 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 18.3 ttt-85 -63.44 -33.13 74.88 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.111 -0.993 . . . . 0.0 110.492 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 24.5 mtmt -79.95 -30.85 39.95 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.014 -1.054 . . . . 0.0 111.197 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.37 23.51 8.35 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 120.836 -1.165 . . . . 0.0 111.739 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.89 46.6 49.17 Favored Glycine 0 N--CA 1.5 2.923 0 O-C-N 120.645 -1.284 . . . . 0.0 110.882 179.232 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.43 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 9.3 t -147.8 -164.01 1.91 Allowed 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.136 -1.214 . . . . 0.0 110.383 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 139' ' ' GLN . . . . . 0.453 ' HA ' ' HB1' ' A' ' 133' ' ' ALA . 27.5 mt-30 -136.25 151.42 49.64 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.135 -0.978 . . . . 0.0 110.224 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.584 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.8 p -132.12 161.07 41.99 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.123 -0.985 . . . . 0.0 110.222 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 34.7 t -168.33 92.99 0.34 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.249 -0.907 . . . . 0.0 111.001 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.964 ' CD1' HD12 ' A' ' 121' ' ' ILE . 78.3 t80 -100.53 159.97 14.73 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.161 -0.962 . . . . 0.0 110.57 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -138.27 -60.92 0.61 Allowed 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -142.46 149.57 39.4 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.48 -0.762 . . . . 0.0 109.079 178.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' CYS . . . . . 0.409 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.6 p -90.32 153.82 20.16 Favored 'General case' 0 N--CA 1.506 2.368 0 C-N-CA 119.102 -1.039 . . . . 0.0 111.195 -179.439 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 27.0 m -72.11 -24.96 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.439 0 O-C-N 121.445 -0.785 . . . . 0.0 111.396 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -50.06 -61.31 2.23 Favored 'General case' 0 N--CA 1.515 2.802 0 O-C-N 120.837 -1.164 . . . . 0.0 110.036 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.492 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.3 p -125.93 -166.13 1.52 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.273 -0.892 . . . . 0.0 110.459 179.325 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -99.43 64.52 0.67 Allowed Glycine 0 N--CA 1.492 2.376 0 N-CA-C 107.987 -2.045 . . . . 0.0 107.987 178.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 29.9 t -104.73 137.32 42.71 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.359 -1.083 . . . . 0.0 110.007 -179.074 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 18.7 ttt85 -95.3 53.79 1.55 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.306 -0.871 . . . . 0.0 109.419 178.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 68.95 98.09 0.04 OUTLIER Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.986 -1.245 . . . . 0.0 109.986 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 29.8 p -105.56 119.01 38.04 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.279 -1.13 . . . . 0.0 110.248 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -145.86 154.64 42.2 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.141 -0.975 . . . . 0.0 110.063 -179.215 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 155' ' ' SER . . . . . 0.425 ' OG ' ' HB2' ' A' ' 101' ' ' GLU . 0.7 OUTLIER -83.52 -35.17 25.03 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.29 -0.881 . . . . 0.0 110.693 -179.897 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 81.8 p -79.41 -39.07 33.32 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.976 -1.078 . . . . 0.0 110.132 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 . . . . . 0 N--CA 1.493 1.711 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.22 179.894 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -81.98 -125.58 0.84 Allowed Glycine 0 N--CA 1.493 2.479 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.0 t -128.92 147.68 65.68 Favored Pre-proline 0 N--CA 1.493 1.705 0 O-C-N 121.192 -1.181 . . . . 0.0 110.236 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -73.23 149.99 46.62 Favored 'Trans proline' 0 C--N 1.316 -1.15 0 O-C-N 123.454 1.239 . . . . 0.0 110.399 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 13.1 ptp180 -143.13 139.43 30.39 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.278 -0.889 . . . . 0.0 110.308 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 63.5 mt -119.64 91.59 1.88 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 O-C-N 121.249 -0.907 . . . . 0.0 109.957 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 79.6 mttt -122.05 129.2 52.21 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.246 -0.909 . . . . 0.0 110.186 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 29.2 m -122.98 152.22 41.09 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.222 -0.924 . . . . 0.0 110.227 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 28.0 mtm-85 -128.28 142.11 51.24 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.23 -0.919 . . . . 0.0 110.231 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 52.57 85.86 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.039 -1.038 . . . . 0.0 110.776 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 34.3 t -121.33 141.73 50.65 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.211 -0.93 . . . . 0.0 110.222 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -136.73 87.06 20.81 Favored Pre-proline 0 N--CA 1.495 1.809 0 O-C-N 121.272 -0.893 . . . . 0.0 110.246 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -73.97 158.92 45.56 Favored 'Trans proline' 0 C--N 1.316 -1.144 0 O-C-N 123.518 1.272 . . . . 0.0 110.596 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.664 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -90.15 146.18 34.37 Favored Pre-proline 0 N--CA 1.504 2.236 0 O-C-N 121.335 -0.853 . . . . 0.0 109.741 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.415 ' HG2' HD13 ' A' ' 77' ' ' LEU . 44.8 Cg_endo -71.13 160.69 48.35 Favored 'Trans proline' 0 C--N 1.317 -1.097 0 O-C-N 123.358 1.188 . . . . 0.0 110.852 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -49.05 -31.72 8.25 Favored 'General case' 0 N--CA 1.515 2.791 0 O-C-N 121.411 -0.805 . . . . 0.0 111.361 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.8 -33.93 43.76 Favored Glycine 0 N--CA 1.498 2.826 0 O-C-N 120.957 -1.089 . . . . 0.0 110.503 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -55.66 -33.28 63.96 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.029 -1.277 . . . . 0.0 110.673 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -53.62 -38.29 63.89 Favored 'General case' 0 N--CA 1.513 2.687 0 O-C-N 121.047 -1.033 . . . . 0.0 110.2 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.7 mtmt -60.29 -37.42 80.47 Favored 'General case' 0 N--CA 1.509 2.482 0 C-N-CA 119.559 -0.856 . . . . 0.0 109.999 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.862 ' O ' HD12 ' A' ' 23' ' ' LEU . 1.3 pt -115.41 33.64 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.193 -0.942 . . . . 0.0 110.61 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 2.5 tttt -84.64 -43.08 0.71 Allowed Pre-proline 0 N--CA 1.51 2.557 0 O-C-N 120.936 -1.102 . . . . 0.0 113.393 -179.03 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.6 Cg_endo -75.57 -35.09 2.94 Favored 'Trans proline' 0 N--CA 1.487 1.094 0 O-C-N 122.604 0.792 . . . . 0.0 111.797 -178.093 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.472 HG21 ' CE2' ' A' ' 62' ' ' TYR . 82.9 m -60.43 -43.76 96.46 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 120.955 -1.091 . . . . 0.0 110.019 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.862 HD12 ' O ' ' A' ' 19' ' ' ILE . 6.2 mt -65.33 -39.49 92.49 Favored 'General case' 0 N--CA 1.507 2.377 0 C-N-CA 119.337 -0.945 . . . . 0.0 109.466 179.465 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.1 m -57.62 -35.54 70.6 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.085 -1.009 . . . . 0.0 110.185 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -56.81 -36.14 69.57 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.067 -1.021 . . . . 0.0 110.438 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.709 ' CD2' HD22 ' A' ' 55' ' ' LEU . 14.7 m-85 -58.46 -38.98 78.67 Favored 'General case' 0 N--CA 1.51 2.526 0 O-C-N 121.114 -0.991 . . . . 0.0 110.51 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -60.47 -38.48 84.35 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.185 -0.947 . . . . 0.0 110.711 -179.253 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.414 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.2 mp -66.9 -40.97 86.94 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.397 0 C-N-CA 119.238 -0.985 . . . . 0.0 109.089 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 29.2 tp60 -67.76 -47.17 69.99 Favored 'General case' 0 N--CA 1.506 2.354 0 C-N-CA 119.178 -1.009 . . . . 0.0 108.785 179.013 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.698 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.1 OUTLIER -63.58 -36.23 83.13 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 121.225 -0.922 . . . . 0.0 109.001 178.474 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.2 mtt85 -57.88 -41.41 82.46 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.026 -1.046 . . . . 0.0 109.874 179.517 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.86 -46.3 88.54 Favored 'General case' 0 N--CA 1.506 2.334 0 C-N-CA 119.27 -0.972 . . . . 0.0 109.602 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.53 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -66.91 -41.66 86.72 Favored 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 119.262 -0.975 . . . . 0.0 109.202 179.194 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -60.29 -34.24 73.49 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.566 -0.854 . . . . 0.0 110.191 179.51 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -92.72 -32.79 14.58 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.05 -1.031 . . . . 0.0 110.824 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -55.73 -36.58 67.39 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 120.933 -1.105 . . . . 0.0 110.357 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 11.6 ttpt -55.52 -43.47 75.75 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 120.973 -1.079 . . . . 0.0 110.355 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 52.09 -165.53 0.06 Allowed 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.05 -1.031 . . . . 0.0 110.846 179.79 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -108.87 -52.2 2.79 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.209 -0.932 . . . . 0.0 110.304 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.8 tttp -111.08 69.6 0.69 Allowed 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.104 -0.997 . . . . 0.0 110.16 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.6 tp -110.19 -50.19 2.99 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.21 -0.931 . . . . 0.0 110.625 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 54.5 34.04 20.2 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.961 -1.087 . . . . 0.0 110.963 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -143.72 109.55 5.24 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.23 -0.919 . . . . 0.0 110.158 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.8 mttt 52.72 70.62 0.55 Allowed 'General case' 0 N--CA 1.501 2.118 0 O-C-N 120.937 -1.102 . . . . 0.0 110.644 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.415 ' OG ' ' N ' ' A' ' 46' ' ' ASN . 24.0 p -112.16 -54.94 2.57 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.203 -0.936 . . . . 0.0 110.368 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.415 ' N ' ' OG ' ' A' ' 45' ' ' SER . 1.3 m-80 -57.0 -38.79 73.58 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.281 -0.887 . . . . 0.0 109.966 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -64.58 -40.09 94.91 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.213 -0.93 . . . . 0.0 109.687 179.548 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.8 tp60 -62.33 -41.05 98.24 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.207 -0.933 . . . . 0.0 109.765 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.452 ' HA ' HD13 ' A' ' 49' ' ' LEU . 4.3 mm? -60.5 -39.87 89.31 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.212 -0.93 . . . . 0.0 109.993 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.497 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 52.9 m0 -60.83 -37.63 82.68 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.132 -0.98 . . . . 0.0 110.041 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -61.15 -31.07 70.8 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.038 -1.039 . . . . 0.0 109.916 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.698 HG23 ' CG ' ' A' ' 30' ' ' LEU . 70.6 mt -71.57 -58.41 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.244 0 O-C-N 120.864 -1.148 . . . . 0.0 109.286 179.451 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.407 ' HE1' ' O ' ' A' ' 147' ' ' HIS . 3.2 ptm -60.62 -28.28 68.41 Favored 'General case' 0 N--CA 1.509 2.52 0 C-N-CA 118.503 -1.279 . . . . 0.0 109.847 178.678 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -68.45 -37.26 80.05 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.756 -1.215 . . . . 0.0 109.24 178.139 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.709 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.3 mt -52.78 -32.5 44.02 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 120.967 -1.083 . . . . 0.0 110.175 179.044 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.473 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 10.4 t60 -54.61 -37.82 66.04 Favored 'General case' 0 N--CA 1.511 2.579 0 O-C-N 121.049 -1.032 . . . . 0.0 110.178 179.562 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.437 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 5.2 m170 -62.06 -51.84 66.33 Favored 'General case' 0 N--CA 1.508 2.443 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.472 179.29 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 19.6 tp60 -57.74 -34.67 69.76 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.273 -0.892 . . . . 0.0 109.831 179.332 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.426 ' HD3' ' CE2' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -68.81 -49.94 54.36 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.005 -1.06 . . . . 0.0 109.142 178.938 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 65.5 p -61.78 -37.45 84.38 Favored 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.162 -0.961 . . . . 0.0 109.432 179.107 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.84 -39.0 93.17 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.068 -1.02 . . . . 0.0 109.546 179.34 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.752 ' OH ' HG22 ' A' ' 19' ' ' ILE . 36.8 t80 -61.7 -49.82 74.92 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.182 -0.949 . . . . 0.0 109.379 179.578 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.764 HD12 ' HB2' ' A' ' 87' ' ' ALA . 85.1 mt -73.61 -41.47 55.47 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 C-N-CA 119.398 -0.921 . . . . 0.0 109.137 179.151 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.443 ' CE1' HG23 ' A' ' 92' ' ' ILE . 45.9 t80 -60.81 -33.07 72.44 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.289 -0.882 . . . . 0.0 110.135 179.125 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.7 m -79.25 -35.82 40.9 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.886 -1.133 . . . . 0.0 110.748 -179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.631 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -82.93 -33.69 26.74 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.836 -1.165 . . . . 0.0 112.412 -179.035 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.529 ' N ' HD12 ' A' ' 66' ' ' LEU . 64.2 t80 -86.6 -34.94 19.71 Favored 'General case' 0 N--CA 1.511 2.617 0 O-C-N 120.674 -1.266 . . . . 0.0 112.047 -179.35 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -98.55 -20.73 16.88 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.778 -1.201 . . . . 0.0 112.862 -178.316 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.415 ' HE2' ' CD2' ' A' ' 64' ' ' TYR . 0.6 OUTLIER -118.75 -56.65 2.1 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.552 -1.343 . . . . 0.0 111.198 -179.523 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.424 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 6.9 ttt85 -66.2 -30.84 71.38 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 121.085 -1.01 . . . . 0.0 110.706 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.2 ttpt 58.64 44.0 18.13 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.785 -1.197 . . . . 0.0 110.133 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.65 38.12 3.56 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.367 -0.833 . . . . 0.0 109.701 179.292 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.824 HG13 HD23 ' A' ' 77' ' ' LEU . 14.2 tt -155.32 162.97 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.92 0 O-C-N 121.25 -0.906 . . . . 0.0 110.206 -179.604 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.8 m -108.11 146.05 33.2 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.118 -0.989 . . . . 0.0 109.978 179.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -45.99 -32.9 3.02 Favored 'General case' 0 N--CA 1.516 2.835 0 O-C-N 121.269 -0.894 . . . . 0.0 111.598 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -61.42 -49.63 76.08 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 120.947 -1.095 . . . . 0.0 109.324 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.824 HD23 HG13 ' A' ' 73' ' ' ILE . 34.5 tp -67.31 -43.01 82.73 Favored 'General case' 0 N--CA 1.504 2.26 0 C-N-CA 119.25 -0.98 . . . . 0.0 108.593 178.753 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.463 ' HA ' HD12 ' A' ' 81' ' ' LEU . 17.6 t80 -61.3 -38.69 87.72 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 121.352 -0.842 . . . . 0.0 109.35 178.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.464 ' O ' HG22 ' A' ' 82' ' ' ILE . 10.4 t0 -74.73 -41.2 60.57 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.171 -0.956 . . . . 0.0 108.954 178.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.664 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 81.6 t90 -59.73 -38.33 81.38 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.175 -0.953 . . . . 0.0 109.291 178.871 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.463 HD12 ' HA ' ' A' ' 78' ' ' TYR . 16.6 mt -66.01 -55.69 15.4 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.179 -0.951 . . . . 0.0 109.278 179.144 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.537 HD12 ' HB3' ' A' ' 87' ' ' ALA . 0.9 OUTLIER -56.48 -27.43 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 O-C-N 121.104 -0.997 . . . . 0.0 110.831 -179.726 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 10.2 tppt? -89.26 -15.37 33.71 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 120.918 -1.114 . . . . 0.0 111.868 179.623 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.438 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 75.0 mm-40 -107.48 25.04 11.95 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.564 -1.335 . . . . 0.0 111.927 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.408 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 7.0 ttmt 76.69 67.89 0.06 Allowed 'General case' 0 N--CA 1.514 2.741 0 O-C-N 121.252 -0.905 . . . . 0.0 112.022 179.278 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.603 ' HE2' HD13 ' A' ' 23' ' ' LEU . 27.2 m-85 -131.28 -62.58 0.88 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.406 -0.809 . . . . 0.0 108.977 178.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.764 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -132.89 168.53 18.26 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.388 -0.82 . . . . 0.0 109.391 179.318 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.473 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.7 t70 -121.29 111.88 17.91 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.132 -0.98 . . . . 0.0 110.546 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 7.8 mttt -58.61 -35.26 72.16 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.229 -0.919 . . . . 0.0 110.259 179.634 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.3 tp -57.61 -40.55 79.36 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 120.992 -1.067 . . . . 0.0 110.069 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.689 ' HA ' HD21 ' A' ' 106' ' ' LEU . 63.1 tp -71.03 -49.85 40.43 Favored 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 119.195 -1.002 . . . . 0.0 108.723 179.275 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.443 HG23 ' CE1' ' A' ' 64' ' ' TYR . 63.8 mt -60.76 -30.3 46.84 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.289 0 C-N-CA 119.32 -0.952 . . . . 0.0 109.377 178.501 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.9 -45.39 78.13 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 120.964 -1.085 . . . . 0.0 109.423 178.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.486 ' HD3' HD23 ' A' ' 106' ' ' LEU . 11.9 mttp -59.47 -44.27 93.05 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.003 -1.061 . . . . 0.0 109.859 179.282 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 3.3 m0 -57.49 -33.52 68.11 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.077 -1.014 . . . . 0.0 110.367 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.29 -35.58 35.6 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.129 -0.982 . . . . 0.0 110.282 179.418 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.8 mmtm -53.57 -178.62 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.641 0 O-C-N 120.953 -1.092 . . . . 0.0 110.62 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.87 140.18 39.3 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.257 -0.902 . . . . 0.0 109.472 179.143 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 102.52 -27.55 19.81 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 -178.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.604 ' HB3' HD23 ' A' ' 103' ' ' LEU . 66.0 m-85 -92.62 59.05 3.24 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 120.859 -1.377 . . . . 0.0 109.734 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -81.37 -35.98 30.16 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.064 -1.022 . . . . 0.0 110.456 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.17 66.71 0.83 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.049 -1.032 . . . . 0.0 110.694 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.604 HD23 ' HB3' ' A' ' 100' ' ' TYR . 0.7 OUTLIER -109.59 149.46 29.64 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 120.967 -1.083 . . . . 0.0 109.82 179.43 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.437 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 27.0 p -111.62 -27.88 8.37 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.193 -0.942 . . . . 0.0 113.264 -179.186 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.684 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 12.4 m -144.86 -168.77 3.01 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 120.168 -1.582 . . . . 0.0 109.865 179.207 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.689 HD21 ' HA ' ' A' ' 91' ' ' LEU . 17.3 mt -97.01 -37.34 10.2 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.165 -0.959 . . . . 0.0 110.234 179.002 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 7.9 ttp180 -104.07 33.32 3.51 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.93 -1.106 . . . . 0.0 109.675 178.316 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.684 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.304 1.7 t -128.37 20.84 6.19 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 108.388 -0.968 . . . . 0.0 108.388 -179.629 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.466 HG23 ' C ' ' A' ' 108' ' ' CYS . 1.6 pt -157.29 38.34 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.298 0 O-C-N 121.017 -1.052 . . . . 0.0 110.211 -178.776 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.751 ' C ' HG23 ' A' ' 119' ' ' THR . 83.4 mt-30 -77.57 72.73 4.13 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 120.953 -1.092 . . . . 0.0 110.675 -178.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 27.1 ttmt -96.43 -36.8 10.69 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.174 -0.954 . . . . 0.0 110.791 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -99.47 -43.12 6.65 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.994 -1.066 . . . . 0.0 110.558 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -113.29 128.29 56.42 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.067 -1.02 . . . . 0.0 110.365 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 62.3 m -142.3 142.2 32.51 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.177 -0.952 . . . . 0.0 110.166 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -121.17 -66.22 1.07 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.173 -0.954 . . . . 0.0 110.255 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -124.09 91.94 3.56 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.16 -0.963 . . . . 0.0 110.197 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 138.11 -146.06 17.75 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 12.2 m -144.68 -164.06 1.83 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.251 -1.146 . . . . 0.0 110.173 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.751 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.7 m -91.32 165.32 13.49 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.156 -0.965 . . . . 0.0 110.056 179.699 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 39.6 t -92.62 154.2 18.54 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 119.386 -0.926 . . . . 0.0 108.962 178.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.965 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -77.29 -30.15 17.28 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.443 0 O-C-N 121.025 -1.047 . . . . 0.0 111.775 -178.711 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.48 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.7 p -59.02 -35.55 73.47 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 120.676 -1.265 . . . . 0.0 110.75 -179.156 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.08 -32.57 64.25 Favored 'General case' 0 N--CA 1.512 2.629 0 O-C-N 120.94 -1.1 . . . . 0.0 110.001 178.835 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 62.5 t -81.3 124.76 80.36 Favored Pre-proline 0 N--CA 1.503 2.212 0 O-C-N 121.051 -1.031 . . . . 0.0 109.681 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.97 178.81 2.15 Favored 'Trans proline' 0 N--CA 1.488 1.174 0 O-C-N 123.114 1.06 . . . . 0.0 110.762 179.617 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -75.12 -38.44 61.07 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.308 -0.87 . . . . 0.0 110.355 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.2 -40.88 82.73 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.089 -1.007 . . . . 0.0 110.029 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -67.41 -42.2 83.64 Favored 'General case' 0 N--CA 1.506 2.368 0 C-N-CA 119.432 -0.907 . . . . 0.0 109.217 179.309 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.698 HD11 HD11 ' A' ' 121' ' ' ILE . 9.5 mt -63.59 -39.78 95.26 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.155 -0.966 . . . . 0.0 109.547 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -58.82 -37.79 77.21 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.096 -1.002 . . . . 0.0 110.059 179.62 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -57.42 -37.18 72.35 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.098 -1.001 . . . . 0.0 110.381 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 62.7 mt-10 -61.43 -47.59 85.05 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.144 -0.972 . . . . 0.0 109.695 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.85 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -59.81 -37.97 80.67 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.171 -0.956 . . . . 0.0 109.877 179.644 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 23.6 ttm-85 -61.69 -38.72 88.89 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.155 -0.966 . . . . 0.0 110.318 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 49.5 mttm -87.08 -39.66 15.38 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.105 -0.997 . . . . 0.0 110.212 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 67.7 mttt -69.13 -26.0 64.67 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.21 -0.931 . . . . 0.0 111.17 179.67 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 90.0 33.54 8.88 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.85 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.7 t -144.31 -161.41 1.28 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.049 -1.266 . . . . 0.0 109.946 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -125.74 150.86 47.37 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.089 -1.007 . . . . 0.0 109.979 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.514 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.0 p -132.14 160.72 42.29 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.17 -0.956 . . . . 0.0 110.434 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 46.9 t -170.26 98.04 0.27 Allowed 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.237 -0.915 . . . . 0.0 110.892 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.965 ' CD1' HD12 ' A' ' 121' ' ' ILE . 81.6 t80 -103.93 159.97 15.2 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.124 -0.985 . . . . 0.0 110.85 -179.608 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -138.75 -61.06 0.58 Allowed 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -141.69 148.51 39.21 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.536 -0.728 . . . . 0.0 109.155 178.753 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' CYS . . . . . 0.417 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 29.8 p -89.81 154.13 20.14 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.073 -1.051 . . . . 0.0 111.069 -179.467 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.2 p -72.34 -25.77 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.386 0 O-C-N 121.385 -0.822 . . . . 0.0 111.463 -179.56 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' HIS . . . . . 0.407 ' O ' ' HE1' ' A' ' 53' ' ' MET . 3.6 m-70 -49.78 -59.34 3.92 Favored 'General case' 0 N--CA 1.516 2.844 0 O-C-N 120.853 -1.154 . . . . 0.0 110.208 -179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.497 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.6 p -126.96 -165.23 1.44 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.278 -0.889 . . . . 0.0 110.333 179.289 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 149' ' ' GLY . . . . . 0.44 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -101.55 63.18 0.52 Allowed Glycine 0 N--CA 1.492 2.387 0 N-CA-C 107.879 -2.088 . . . . 0.0 107.879 178.377 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 20.6 t -101.49 141.26 34.62 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.347 -1.09 . . . . 0.0 109.819 -179.153 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 23.9 mtt85 -97.55 50.19 1.05 Allowed 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.246 -0.909 . . . . 0.0 109.546 179.067 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 71.42 98.37 0.06 OUTLIER Glycine 0 N--CA 1.486 2.017 0 N-CA-C 109.975 -1.25 . . . . 0.0 109.975 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.4 p -109.43 126.04 53.05 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.244 -1.15 . . . . 0.0 110.173 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -150.17 151.75 33.58 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.077 -1.015 . . . . 0.0 110.434 -179.366 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -104.28 -47.62 4.08 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.217 -0.927 . . . . 0.0 110.583 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 6.3 p -54.61 -38.67 67.07 Favored 'General case' 0 N--CA 1.512 2.67 0 O-C-N 121.004 -1.06 . . . . 0.0 110.644 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 . . . . . 0 N--CA 1.494 1.749 0 CA-C-O 117.987 -1.006 . . . . 0.0 110.192 179.96 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.336 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 110.18 85.48 1.63 Allowed Glycine 0 N--CA 1.493 2.48 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 55.34 175.52 0.04 OUTLIER Pre-proline 0 N--CA 1.503 2.182 0 O-C-N 121.117 -1.225 . . . . 0.0 110.432 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -73.43 -171.94 0.94 Allowed 'Trans proline' 0 C--N 1.318 -1.069 0 O-C-N 123.308 1.162 . . . . 0.0 110.365 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.3 ttt85 -115.16 -56.62 2.35 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.182 -0.949 . . . . 0.0 110.28 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 5.1 tp -131.29 145.06 35.9 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 O-C-N 121.304 -0.872 . . . . 0.0 110.193 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.4 tttm -147.4 173.8 12.28 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.114 -0.991 . . . . 0.0 110.355 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.7 m -121.12 41.6 3.28 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.167 -0.958 . . . . 0.0 110.151 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -142.68 121.75 12.89 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.265 -0.897 . . . . 0.0 110.243 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 10' ' ' LYS . 14.5 ttt85 -140.37 100.61 3.93 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.22 -0.925 . . . . 0.0 110.156 -179.909 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.01 -71.75 0.06 Allowed 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.232 -0.917 . . . . 0.0 110.791 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.401 ' N ' ' O ' ' A' ' 8' ' ' ARG . 5.3 mtmp? -117.2 148.96 43.57 Favored Pre-proline 0 N--CA 1.494 1.763 0 O-C-N 120.931 -1.106 . . . . 0.0 110.184 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.474 ' O ' ' HB3' ' A' ' 12' ' ' ALA . 46.6 Cg_endo -72.86 158.46 50.02 Favored 'Trans proline' 0 C--N 1.316 -1.138 0 O-C-N 123.408 1.215 . . . . 0.0 110.598 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.768 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . 61.77 150.52 0.1 OUTLIER Pre-proline 0 N--CA 1.504 2.24 0 O-C-N 121.366 -0.834 . . . . 0.0 110.539 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.45 165.05 33.82 Favored 'Trans proline' 0 C--N 1.317 -1.115 0 O-C-N 123.296 1.156 . . . . 0.0 110.514 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -48.18 -32.25 6.8 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 121.5 -0.75 . . . . 0.0 111.368 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.99 -33.99 51.47 Favored Glycine 0 N--CA 1.499 2.833 0 O-C-N 120.984 -1.072 . . . . 0.0 110.514 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.504 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 28.5 t80 -54.98 -31.63 60.94 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.039 -1.271 . . . . 0.0 110.689 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -53.27 -37.03 61.79 Favored 'General case' 0 N--CA 1.512 2.662 0 O-C-N 120.982 -1.074 . . . . 0.0 110.236 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp -59.0 -37.7 77.46 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.24 -0.913 . . . . 0.0 110.116 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.889 HD12 HD11 ' A' ' 23' ' ' LEU . 1.9 pt -119.51 35.07 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.223 -0.923 . . . . 0.0 110.537 179.77 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.439 ' HG3' ' CE2' ' A' ' 16' ' ' PHE . 3.0 tttt -84.9 -43.3 0.68 Allowed Pre-proline 0 N--CA 1.509 2.481 0 O-C-N 120.992 -1.067 . . . . 0.0 113.42 -178.901 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.42 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.7 Cg_endo -75.74 -35.45 2.64 Favored 'Trans proline' 0 N--CA 1.486 1.085 0 O-C-N 122.559 0.768 . . . . 0.0 111.867 -177.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.513 HG21 ' CE2' ' A' ' 62' ' ' TYR . 59.8 m -61.5 -45.62 93.45 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.985 -1.072 . . . . 0.0 110.061 -179.585 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.889 HD11 HD12 ' A' ' 19' ' ' ILE . 9.0 mt -63.53 -40.36 96.83 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.509 -0.877 . . . . 0.0 109.694 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.09 -35.34 73.23 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.157 -0.964 . . . . 0.0 110.087 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -57.92 -36.05 71.93 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.009 -1.057 . . . . 0.0 110.272 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.513 ' CZ ' ' NE2' ' A' ' 58' ' ' GLN . 10.4 m-85 -55.46 -40.95 72.25 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 120.879 -1.138 . . . . 0.0 109.978 179.598 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -58.58 -25.1 62.2 Favored 'General case' 0 N--CA 1.505 2.323 0 C-N-CA 119.484 -0.887 . . . . 0.0 110.711 179.284 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 11.3 mm -70.53 -49.01 55.76 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.31 0 O-C-N 120.894 -1.129 . . . . 0.0 109.136 179.624 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.77 -43.35 72.39 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.154 -0.967 . . . . 0.0 108.867 179.155 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.67 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -64.43 -34.68 78.75 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.249 -0.98 . . . . 0.0 109.215 178.544 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.58 -40.86 84.37 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.014 -1.054 . . . . 0.0 109.957 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -62.43 -48.19 80.77 Favored 'General case' 0 N--CA 1.508 2.45 0 C-N-CA 119.28 -0.968 . . . . 0.0 109.541 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.615 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -67.68 -41.05 84.28 Favored 'General case' 0 N--CA 1.505 2.292 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.245 179.124 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.52 ' HG3' HD23 ' A' ' 30' ' ' LEU . 8.8 mm-40 -66.28 -34.21 77.49 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.309 -0.869 . . . . 0.0 110.159 179.401 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt -85.87 -34.32 21.04 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.033 -1.042 . . . . 0.0 110.631 179.713 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -55.89 -37.34 68.72 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.002 -1.062 . . . . 0.0 110.209 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.1 tttm -54.37 -37.57 65.11 Favored 'General case' 0 N--CA 1.512 2.648 0 O-C-N 121.196 -0.94 . . . . 0.0 110.493 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -110.29 -174.49 2.5 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.141 -0.974 . . . . 0.0 110.039 179.792 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 65.25 -68.17 0.12 Allowed 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.046 -1.033 . . . . 0.0 110.979 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.4 mmmt -113.46 142.31 46.07 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.786 -1.196 . . . . 0.0 110.116 179.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.9 tp -145.88 83.03 1.63 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.216 -0.928 . . . . 0.0 110.377 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -114.92 -66.26 1.1 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.203 -0.935 . . . . 0.0 110.179 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -150.76 -179.48 7.3 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.18 -0.95 . . . . 0.0 110.608 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.0 tttp 52.7 72.13 0.43 Allowed 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.122 -0.986 . . . . 0.0 110.785 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 27.9 t -116.04 -56.66 2.29 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.187 -0.946 . . . . 0.0 110.363 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -56.96 -39.45 74.62 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 121.169 -0.957 . . . . 0.0 109.911 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -63.07 -39.35 94.45 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.153 -0.967 . . . . 0.0 109.763 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 46.4 tp60 -62.15 -41.02 97.88 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.167 -0.958 . . . . 0.0 109.855 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -60.05 -39.99 87.87 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.225 -0.922 . . . . 0.0 110.169 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.496 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.3 m0 -59.13 -36.38 75.11 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.214 -0.929 . . . . 0.0 110.276 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -60.99 -29.86 69.93 Favored 'General case' 0 N--CA 1.507 2.378 0 C-N-CA 119.164 -1.014 . . . . 0.0 110.173 179.136 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.67 HG23 ' CG ' ' A' ' 30' ' ' LEU . 71.7 mt -72.58 -58.16 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.269 0 O-C-N 120.936 -1.103 . . . . 0.0 109.196 179.461 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.4 ptm -60.53 -29.96 69.45 Favored 'General case' 0 N--CA 1.51 2.548 0 C-N-CA 118.609 -1.237 . . . . 0.0 109.861 178.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.9 mt-30 -69.81 -37.66 76.35 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.894 -1.129 . . . . 0.0 109.075 178.111 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.414 ' HA ' HD23 ' A' ' 55' ' ' LEU . 12.5 mt -54.26 -32.65 56.69 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.003 -1.06 . . . . 0.0 110.211 178.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.449 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 6.2 t60 -55.0 -37.13 66.2 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.008 -1.057 . . . . 0.0 110.111 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.493 ' NE2' HD21 ' A' ' 91' ' ' LEU . 5.1 m170 -59.61 -48.3 82.19 Favored 'General case' 0 N--CA 1.509 2.508 0 C-N-CA 119.313 -0.955 . . . . 0.0 109.538 179.05 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.513 ' NE2' ' CZ ' ' A' ' 26' ' ' PHE . 16.8 tt0 -60.58 -36.15 77.81 Favored 'General case' 0 N--CA 1.506 2.327 0 C-N-CA 119.396 -0.921 . . . . 0.0 109.505 179.036 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.451 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -67.59 -49.58 62.46 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.182 -0.949 . . . . 0.0 109.304 179.073 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.6 p -61.26 -38.11 85.54 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.146 -0.971 . . . . 0.0 109.586 179.26 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.0 ttt85 -65.7 -39.0 90.77 Favored 'General case' 0 N--CA 1.507 2.392 0 C-N-CA 119.164 -1.014 . . . . 0.0 109.406 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.56 ' OH ' HG22 ' A' ' 19' ' ' ILE . 40.5 t80 -59.88 -47.13 86.98 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.21 -0.931 . . . . 0.0 109.561 179.496 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.772 HD12 ' HB2' ' A' ' 87' ' ' ALA . 86.2 mt -78.01 -44.06 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 O-C-N 121.186 -0.946 . . . . 0.0 108.947 179.212 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.523 ' CE1' HG23 ' A' ' 92' ' ' ILE . 37.7 t80 -59.17 -25.62 64.08 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.326 -0.859 . . . . 0.0 110.289 178.871 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.417 ' HA ' ' CD ' ' A' ' 69' ' ' LYS . 71.2 m -87.47 -37.12 17.25 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.774 -1.204 . . . . 0.0 110.283 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.58 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.6 pp -83.14 -31.82 26.99 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.005 -1.059 . . . . 0.0 112.485 -179.116 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.491 ' HD1' HG23 ' A' ' 73' ' ' ILE . 73.5 t80 -86.27 -36.2 19.5 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 120.697 -1.252 . . . . 0.0 111.482 -179.192 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -94.36 -17.11 22.87 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 120.889 -1.132 . . . . 0.0 112.726 -178.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.417 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 1.1 mttt -125.0 -60.48 1.35 Allowed 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.53 -1.356 . . . . 0.0 111.264 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.426 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 1.7 tpt180 -59.82 -29.89 68.56 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 120.986 -1.071 . . . . 0.0 110.825 -179.636 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.2 tttt 58.55 43.86 18.64 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.885 -1.134 . . . . 0.0 110.058 -179.526 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -114.07 36.63 3.62 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.366 -0.834 . . . . 0.0 109.798 179.234 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.755 HG13 HD23 ' A' ' 77' ' ' LEU . 13.8 tt -159.43 162.36 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.202 -0.936 . . . . 0.0 110.119 -179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.05 149.44 29.26 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.048 -1.032 . . . . 0.0 110.199 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.9 tttp -46.09 -32.7 3.03 Favored 'General case' 0 N--CA 1.515 2.804 0 O-C-N 121.375 -0.828 . . . . 0.0 111.588 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -62.46 -51.37 67.74 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 120.961 -1.087 . . . . 0.0 109.224 179.577 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.755 HD23 HG13 ' A' ' 73' ' ' ILE . 29.6 tp -65.92 -42.35 90.26 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.192 -1.003 . . . . 0.0 108.659 178.809 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.584 ' HA ' HD12 ' A' ' 81' ' ' LEU . 17.6 t80 -61.86 -40.13 94.29 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.302 -0.874 . . . . 0.0 109.244 179.022 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -70.84 -42.21 70.45 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.14 -0.975 . . . . 0.0 108.868 178.821 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.768 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 81.5 t90 -57.57 -36.84 72.21 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.248 -0.907 . . . . 0.0 109.65 179.049 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.584 HD12 ' HA ' ' A' ' 78' ' ' TYR . 15.8 mt -67.99 -51.37 47.99 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.059 -1.025 . . . . 0.0 109.082 179.176 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.494 HG21 ' HD2' ' A' ' 89' ' ' LYS . 34.8 mm -56.77 -29.27 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.53 0 O-C-N 121.208 -0.932 . . . . 0.0 110.209 179.415 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 25.2 tttt -89.1 -20.33 24.44 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 120.873 -1.142 . . . . 0.0 111.93 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.441 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 29.0 mm-40 -102.91 22.9 13.04 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 120.635 -1.291 . . . . 0.0 112.077 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? 73.81 77.65 0.13 Allowed 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.02 -1.05 . . . . 0.0 111.685 179.245 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.736 ' HE2' HD13 ' A' ' 23' ' ' LEU . 31.8 m-85 -135.9 -62.39 0.68 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.51 -0.743 . . . . 0.0 109.342 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.772 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -127.96 171.67 11.61 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.478 -0.763 . . . . 0.0 109.41 179.324 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.449 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 25.8 t0 -114.35 104.94 12.56 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.144 -0.973 . . . . 0.0 110.246 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.494 ' HD2' HG21 ' A' ' 82' ' ' ILE . 20.5 mttm -58.83 -39.91 82.6 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.219 -0.926 . . . . 0.0 109.934 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.596 HD23 HD13 ' A' ' 106' ' ' LEU . 27.5 tp -61.52 -38.59 87.95 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.135 -0.978 . . . . 0.0 109.924 179.84 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.493 HD21 ' NE2' ' A' ' 57' ' ' HIS . 57.0 tp -71.47 -47.25 56.86 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.056 -1.028 . . . . 0.0 108.702 179.241 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.523 HG23 ' CE1' ' A' ' 64' ' ' TYR . 23.1 mt -58.02 -36.44 56.49 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 O-C-N 121.16 -0.962 . . . . 0.0 108.627 178.305 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.99 -38.91 86.88 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 121.154 -0.966 . . . . 0.0 109.137 178.369 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.433 ' HD2' ' CZ ' ' A' ' 100' ' ' TYR . 4.9 mmtt -57.64 -42.91 84.41 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.152 -0.967 . . . . 0.0 109.474 179.288 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.5 m0 -64.79 -37.46 87.7 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.56 -0.856 . . . . 0.0 110.055 179.533 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.3 mtp85 -75.68 -32.81 60.29 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.194 -0.941 . . . . 0.0 110.543 179.585 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -54.06 -176.59 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.7 0 O-C-N 121.065 -1.022 . . . . 0.0 110.657 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -104.03 136.14 44.23 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.129 -0.982 . . . . 0.0 109.694 179.228 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 95.63 11.3 55.63 Favored Glycine 0 N--CA 1.494 2.553 0 C-N-CA 120.172 -1.013 . . . . 0.0 111.023 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.641 ' HB3' HD23 ' A' ' 103' ' ' LEU . 48.2 m-85 -119.28 71.95 0.88 Allowed 'General case' 0 N--CA 1.493 1.715 0 CA-C-N 119.403 1.602 . . . . 0.0 109.777 179.703 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -96.73 -36.26 10.72 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.177 -0.952 . . . . 0.0 110.807 -179.701 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.33 66.98 0.99 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.015 -1.053 . . . . 0.0 110.822 -179.598 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.641 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.2 pp -114.5 153.04 30.72 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.035 -1.041 . . . . 0.0 109.78 179.297 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.433 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.7 p -114.36 -29.92 6.74 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.172 -0.955 . . . . 0.0 113.569 -178.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.645 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.8 m -142.92 -167.99 2.67 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 120.051 -1.656 . . . . 0.0 109.907 179.263 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.596 HD13 HD23 ' A' ' 90' ' ' LEU . 15.0 mt -95.69 -39.04 10.09 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.2 -0.937 . . . . 0.0 109.937 179.083 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 5.7 ttm-85 -102.83 30.74 4.55 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.026 -1.046 . . . . 0.0 109.933 178.332 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.645 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.299 1.8 t -128.14 17.98 6.59 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.12 -0.988 . . . . 0.0 108.947 -179.554 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.461 HG23 ' C ' ' A' ' 108' ' ' CYS . 1.2 pt -158.28 37.83 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.275 0 O-C-N 120.864 -1.147 . . . . 0.0 110.571 -178.702 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.524 ' C ' HG23 ' A' ' 119' ' ' THR . 12.1 mm-40 -71.04 76.24 0.66 Allowed 'General case' 0 N--CA 1.51 2.559 0 O-C-N 120.854 -1.154 . . . . 0.0 110.509 -178.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.603 ' NZ ' HG22 ' A' ' 124' ' ' VAL . 0.0 OUTLIER -110.58 -166.17 1.06 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.196 -0.94 . . . . 0.0 110.106 179.562 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 1.4 m120 53.28 -171.91 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.986 -1.071 . . . . 0.0 110.575 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -115.14 100.09 7.91 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.183 -0.948 . . . . 0.0 110.276 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -144.84 -58.81 0.36 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.137 -0.977 . . . . 0.0 110.453 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -117.26 -172.48 2.23 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.188 -0.945 . . . . 0.0 110.212 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -116.64 161.62 18.9 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.174 -0.954 . . . . 0.0 110.165 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 134.25 -144.99 17.1 Favored Glycine 0 N--CA 1.493 2.457 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 4.1 m -125.79 163.26 23.27 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.214 -1.168 . . . . 0.0 110.129 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.524 HG23 ' C ' ' A' ' 110' ' ' GLN . 2.7 m -112.61 168.44 9.65 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.261 -0.899 . . . . 0.0 110.127 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.428 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 41.7 t -102.74 155.28 18.42 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.247 -0.908 . . . . 0.0 109.698 179.521 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.778 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -72.96 -36.34 51.13 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.457 0 O-C-N 121.114 -0.991 . . . . 0.0 111.052 -179.36 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.483 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 11.9 p -53.65 -33.17 54.33 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 120.84 -1.163 . . . . 0.0 111.253 -178.772 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.32 -32.57 70.2 Favored 'General case' 0 N--CA 1.512 2.65 0 O-C-N 120.952 -1.092 . . . . 0.0 109.666 178.392 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.603 HG22 ' NZ ' ' A' ' 111' ' ' LYS . 49.3 t -82.84 125.41 75.45 Favored Pre-proline 0 N--CA 1.505 2.297 0 O-C-N 121.06 -1.025 . . . . 0.0 109.85 179.603 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.64 175.29 4.49 Favored 'Trans proline' 0 N--CA 1.488 1.189 0 O-C-N 123.155 1.082 . . . . 0.0 110.797 179.596 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.11 -36.71 61.66 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.256 -0.902 . . . . 0.0 110.73 -179.758 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.65 -40.22 78.8 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 121.031 -1.043 . . . . 0.0 110.105 -179.672 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -69.84 -41.35 75.02 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 119.356 -0.938 . . . . 0.0 109.288 179.316 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.728 HD11 HD11 ' A' ' 121' ' ' ILE . 2.9 mt -65.04 -38.45 90.87 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.246 -0.909 . . . . 0.0 109.648 179.231 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -61.22 -40.46 94.08 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.088 -1.008 . . . . 0.0 109.842 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -59.8 -37.49 79.29 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.144 -0.973 . . . . 0.0 110.294 179.82 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -61.53 -43.44 98.86 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.169 -0.957 . . . . 0.0 110.071 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.618 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -60.29 -40.89 92.09 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.186 -0.946 . . . . 0.0 110.015 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.94 -33.82 69.22 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.183 -0.948 . . . . 0.0 110.401 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 25.1 mttt -76.88 -30.93 56.44 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.065 -1.022 . . . . 0.0 110.949 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 14.8 mtpp -98.42 22.33 9.9 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 120.916 -1.115 . . . . 0.0 111.688 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.67 39.38 46.13 Favored Glycine 0 N--CA 1.5 2.964 0 O-C-N 120.691 -1.255 . . . . 0.0 110.727 179.265 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.618 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 7.0 t -143.55 -166.64 2.38 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.089 -1.242 . . . . 0.0 110.338 179.898 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 139' ' ' GLN . . . . . 0.438 ' HA ' ' HB1' ' A' ' 133' ' ' ALA . 37.6 mt-30 -132.94 155.05 49.81 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.245 -0.91 . . . . 0.0 110.248 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.611 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.2 p -130.63 161.36 40.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.152 -0.968 . . . . 0.0 109.961 179.807 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 42.2 t -166.41 85.52 0.3 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.138 -0.976 . . . . 0.0 111.285 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.762 ' CG ' HD12 ' A' ' 121' ' ' ILE . 55.1 t80 -97.43 159.94 14.62 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.207 -0.933 . . . . 0.0 110.136 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 9.8 m-70 -136.82 -61.47 0.67 Allowed 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 179.013 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -136.7 151.0 48.76 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.45 -0.781 . . . . 0.0 108.928 178.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' CYS . . . . . 0.402 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 29.0 p -91.49 154.48 19.09 Favored 'General case' 0 N--CA 1.506 2.331 0 C-N-CA 119.121 -1.032 . . . . 0.0 111.093 -179.456 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.5 m -72.7 -25.1 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.462 0 C-N-CA 119.742 -0.783 . . . . 0.0 111.541 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -50.43 -60.81 2.63 Favored 'General case' 0 N--CA 1.516 2.856 0 O-C-N 120.906 -1.121 . . . . 0.0 110.022 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.496 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.9 p -126.43 -165.39 1.44 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.215 -0.928 . . . . 0.0 110.393 179.263 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 149' ' ' GLY . . . . . 0.441 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.39 63.52 0.61 Allowed Glycine 0 N--CA 1.492 2.42 0 N-CA-C 108.053 -2.019 . . . . 0.0 108.053 178.543 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 30.5 t -103.69 138.89 39.69 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.357 -1.084 . . . . 0.0 110.074 -179.191 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -95.03 54.38 1.68 Allowed 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.266 -0.896 . . . . 0.0 109.444 179.022 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.66 97.93 0.03 OUTLIER Glycine 0 N--CA 1.486 2.024 0 N-CA-C 109.819 -1.312 . . . . 0.0 109.819 -179.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.5 p -107.22 126.23 52.14 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.219 -1.165 . . . . 0.0 110.391 179.734 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -150.29 148.5 28.93 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.193 -0.942 . . . . 0.0 110.343 -179.514 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -98.01 -38.72 9.27 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.248 -0.907 . . . . 0.0 110.772 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.34 -40.42 74.1 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.037 -1.04 . . . . 0.0 110.101 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 . . . . . 0 N--CA 1.495 1.8 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.348 179.937 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.366 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 111.86 -53.36 0.59 Allowed Glycine 0 N--CA 1.493 2.464 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -134.68 80.82 49.19 Favored Pre-proline 0 N--CA 1.493 1.703 0 O-C-N 121.219 -1.165 . . . . 0.0 110.2 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.87 86.86 1.04 Allowed 'Trans proline' 0 C--N 1.316 -1.179 0 O-C-N 123.443 1.233 . . . . 0.0 110.363 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 9.0 mtp85 -140.79 151.86 44.73 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.243 -0.911 . . . . 0.0 110.246 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.3 pt -142.95 79.34 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 121.161 -0.962 . . . . 0.0 110.35 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 11.5 tttt -113.77 139.09 49.4 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.078 -1.014 . . . . 0.0 110.166 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 86.8 m -140.84 105.51 4.91 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.261 -0.899 . . . . 0.0 110.25 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.05 123.77 14.16 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.282 -0.886 . . . . 0.0 110.123 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 22.7 ttt180 -145.11 99.67 3.36 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.142 -0.974 . . . . 0.0 110.356 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 85.0 p -145.72 139.59 26.61 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.203 -0.936 . . . . 0.0 110.387 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -137.68 73.4 47.84 Favored Pre-proline 0 N--CA 1.494 1.731 0 O-C-N 121.169 -0.957 . . . . 0.0 110.309 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -73.13 159.69 46.96 Favored 'Trans proline' 0 C--N 1.317 -1.124 0 O-C-N 123.388 1.204 . . . . 0.0 110.568 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.712 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -81.35 142.51 50.62 Favored Pre-proline 0 N--CA 1.507 2.405 0 C-N-CA 119.591 -0.844 . . . . 0.0 109.648 179.7 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -71.82 162.1 43.01 Favored 'Trans proline' 0 C--N 1.318 -1.072 0 O-C-N 123.281 1.148 . . . . 0.0 110.896 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -48.82 -31.96 7.94 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 121.464 -0.773 . . . . 0.0 111.344 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.35 -33.91 40.28 Favored Glycine 0 N--CA 1.498 2.827 0 O-C-N 120.992 -1.067 . . . . 0.0 110.584 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -54.89 -32.6 61.08 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 120.972 -1.311 . . . . 0.0 110.634 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -54.44 -37.94 65.73 Favored 'General case' 0 N--CA 1.512 2.659 0 O-C-N 121.04 -1.037 . . . . 0.0 110.251 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.8 mttm -57.94 -37.14 73.58 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.27 -0.894 . . . . 0.0 110.115 179.523 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.89 HD12 HD11 ' A' ' 23' ' ' LEU . 2.6 pt -116.1 35.31 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.206 -0.934 . . . . 0.0 110.402 179.392 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.432 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -83.59 -43.09 0.81 Allowed Pre-proline 0 N--CA 1.51 2.529 0 O-C-N 121.082 -1.011 . . . . 0.0 113.17 -179.179 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.432 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.2 Cg_endo -76.12 -35.79 2.23 Favored 'Trans proline' 0 N--CA 1.487 1.123 0 O-C-N 122.632 0.806 . . . . 0.0 111.66 -178.392 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.781 HG21 ' CE2' ' A' ' 62' ' ' TYR . 88.6 m -60.5 -44.96 95.44 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 120.946 -1.096 . . . . 0.0 109.828 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.89 HD11 HD12 ' A' ' 19' ' ' ILE . 8.4 mt -65.01 -39.36 93.33 Favored 'General case' 0 N--CA 1.505 2.321 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.416 179.401 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 20.2 m -58.5 -35.41 72.19 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.076 -1.015 . . . . 0.0 110.051 179.16 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -56.37 -35.87 68.18 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 121.037 -1.039 . . . . 0.0 110.394 179.586 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.685 ' CD2' HD22 ' A' ' 55' ' ' LEU . 12.9 m-85 -56.82 -36.4 69.9 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.075 -1.016 . . . . 0.0 110.475 179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -57.79 -38.61 75.8 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.069 -1.02 . . . . 0.0 110.499 -179.685 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.422 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.1 mp -65.96 -41.01 88.98 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.412 0 C-N-CA 119.31 -0.956 . . . . 0.0 109.033 179.624 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 8.7 tp60 -68.97 -46.75 67.31 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.108 -0.995 . . . . 0.0 108.826 179.044 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.026 HD11 HG23 ' A' ' 52' ' ' ILE . 2.4 tp -61.89 -36.97 82.86 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.205 -0.935 . . . . 0.0 109.235 178.735 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.1 mtt85 -57.24 -36.46 70.96 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.138 -0.976 . . . . 0.0 110.298 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -62.93 -51.78 65.59 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.072 -1.017 . . . . 0.0 109.503 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.456 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -69.08 -42.27 76.43 Favored 'General case' 0 N--CA 1.504 2.274 0 C-N-CA 119.045 -1.062 . . . . 0.0 108.614 178.81 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -61.26 -33.19 73.13 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 119.455 -0.898 . . . . 0.0 110.297 179.369 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.8 mmtt -94.25 -29.23 15.19 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 120.897 -1.127 . . . . 0.0 111.289 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -53.92 -36.16 62.47 Favored 'General case' 0 N--CA 1.513 2.69 0 O-C-N 120.79 -1.194 . . . . 0.0 110.473 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.6 tptt -55.01 -38.81 68.38 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 121.1 -1.0 . . . . 0.0 110.428 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.5 m -117.63 41.8 2.76 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.203 -0.936 . . . . 0.0 110.208 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.07 -58.37 1.56 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.259 -0.901 . . . . 0.0 110.36 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -98.3 -41.07 8.02 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.199 -0.938 . . . . 0.0 110.446 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.446 HD23 ' C ' ' A' ' 41' ' ' LEU . 4.1 tt 54.16 71.07 0.54 Allowed 'General case' 0 N--CA 1.502 2.135 0 O-C-N 120.988 -1.07 . . . . 0.0 110.616 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -144.9 -65.56 0.33 Allowed 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.224 -0.923 . . . . 0.0 110.228 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -149.6 -177.72 6.03 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.209 -0.932 . . . . 0.0 110.553 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 52.76 85.27 0.05 OUTLIER 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.056 -1.027 . . . . 0.0 110.963 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.8 m -115.19 -56.92 2.32 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.19 -0.944 . . . . 0.0 110.168 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -56.81 -39.07 73.5 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 121.226 -0.921 . . . . 0.0 109.763 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -58.54 -35.16 71.88 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.243 -0.911 . . . . 0.0 110.137 179.36 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.422 ' HG2' ' CB ' ' A' ' 33' ' ' ALA . 0.3 OUTLIER -58.72 -46.31 87.63 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 120.974 -1.079 . . . . 0.0 109.585 179.72 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 92.1 mt -63.28 -37.78 88.58 Favored 'General case' 0 N--CA 1.508 2.463 0 C-N-CA 119.305 -0.958 . . . . 0.0 109.916 179.517 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.498 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 38.3 m0 -59.36 -33.99 71.84 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.153 -0.967 . . . . 0.0 109.405 179.413 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -68.03 -33.49 74.68 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 120.727 -1.233 . . . . 0.0 109.326 178.091 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 1.026 HG23 HD11 ' A' ' 30' ' ' LEU . 11.2 mt -70.82 -53.64 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.245 0 O-C-N 121.03 -1.044 . . . . 0.0 109.491 179.222 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.496 ' CE ' ' HB2' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -59.83 -33.1 71.32 Favored 'General case' 0 N--CA 1.51 2.538 0 C-N-CA 118.764 -1.174 . . . . 0.0 109.718 179.169 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.36 -39.59 91.18 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 120.91 -1.119 . . . . 0.0 109.44 179.129 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.685 HD22 ' CD2' ' A' ' 26' ' ' PHE . 18.0 mt -54.46 -34.31 61.27 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.158 -0.964 . . . . 0.0 110.097 179.235 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.441 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 4.8 t60 -58.55 -39.21 79.6 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 120.983 -1.073 . . . . 0.0 109.85 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.439 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 7.6 m170 -59.95 -48.39 81.91 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.086 -1.009 . . . . 0.0 109.064 179.24 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.88 -38.51 88.59 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.55 -0.86 . . . . 0.0 109.397 179.065 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.23 -44.71 96.83 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.246 -0.909 . . . . 0.0 109.502 179.478 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 52.7 p -66.34 -39.96 89.56 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.091 -1.006 . . . . 0.0 109.151 179.07 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 60.3 ttt-85 -63.04 -40.24 97.11 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.117 -0.989 . . . . 0.0 109.298 179.086 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.781 ' CE2' HG21 ' A' ' 22' ' ' THR . 40.1 t80 -62.2 -50.58 71.23 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.151 -0.968 . . . . 0.0 109.383 179.595 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.842 HD12 ' HB2' ' A' ' 87' ' ' ALA . 82.3 mt -70.59 -37.56 70.19 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 C-N-CA 119.289 -0.964 . . . . 0.0 109.332 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.413 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 8.5 t80 -66.56 -41.65 88.28 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.146 -0.971 . . . . 0.0 108.996 178.854 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 86.3 m -60.84 -41.82 96.54 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.112 -0.992 . . . . 0.0 110.098 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.603 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.18 -35.65 25.32 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 120.958 -1.089 . . . . 0.0 112.716 -178.915 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.58 ' N ' HD12 ' A' ' 66' ' ' LEU . 41.8 t80 -86.58 -33.56 20.17 Favored 'General case' 0 N--CA 1.514 2.751 0 O-C-N 120.614 -1.304 . . . . 0.0 112.044 -179.066 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.413 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 6.8 m-85 -98.25 -3.35 37.56 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.854 -1.153 . . . . 0.0 113.308 -178.351 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -136.32 -57.52 0.75 Allowed 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.374 -1.454 . . . . 0.0 111.134 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.422 ' HB2' ' HA ' ' A' ' 66' ' ' LEU . 14.3 mtp85 -69.19 -28.58 66.51 Favored 'General case' 0 N--CA 1.51 2.557 0 O-C-N 120.949 -1.094 . . . . 0.0 110.731 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.0 tttp 60.22 44.78 12.27 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.781 -1.199 . . . . 0.0 109.985 -179.516 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.54 35.73 3.71 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.343 -0.848 . . . . 0.0 109.817 179.107 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.804 HG13 HD23 ' A' ' 77' ' ' LEU . 14.3 tt -155.99 162.69 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 O-C-N 121.151 -0.968 . . . . 0.0 110.052 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.7 p -109.5 147.08 33.53 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.085 -1.009 . . . . 0.0 110.095 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.3 tttt -45.87 -32.23 2.52 Favored 'General case' 0 N--CA 1.515 2.809 0 O-C-N 121.309 -0.869 . . . . 0.0 111.621 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -61.8 -50.54 71.93 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.955 -1.091 . . . . 0.0 109.274 179.445 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.804 HD23 HG13 ' A' ' 73' ' ' ILE . 38.5 tp -66.68 -44.44 81.78 Favored 'General case' 0 N--CA 1.505 2.295 0 C-N-CA 119.241 -0.984 . . . . 0.0 108.442 178.873 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.435 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 18.5 t80 -60.43 -38.74 85.06 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.327 -0.858 . . . . 0.0 109.564 179.208 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -73.39 -41.92 62.77 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.059 -1.026 . . . . 0.0 109.016 178.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.712 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 84.1 t90 -57.65 -37.3 73.13 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.219 -0.926 . . . . 0.0 109.756 179.143 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.779 HD22 ' CD2' ' A' ' 86' ' ' TYR . 60.9 mt -69.28 -47.86 63.35 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.209 -0.932 . . . . 0.0 108.949 179.217 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.566 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 33.1 mm -56.23 -31.72 32.96 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.64 0 O-C-N 121.264 -0.897 . . . . 0.0 109.975 179.383 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 8.3 ttmt -89.24 -16.55 30.99 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 120.868 -1.145 . . . . 0.0 112.136 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.454 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 15.5 mm-40 -104.53 22.73 14.46 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 120.583 -1.323 . . . . 0.0 112.158 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.6 tptt 75.75 71.44 0.08 Allowed 'General case' 0 N--CA 1.512 2.643 0 O-C-N 121.149 -0.969 . . . . 0.0 111.903 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.779 ' CD2' HD22 ' A' ' 81' ' ' LEU . 33.2 m-85 -134.1 -63.03 0.74 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.42 -0.8 . . . . 0.0 109.019 179.198 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.842 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -128.36 164.08 23.44 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.485 -0.759 . . . . 0.0 109.26 179.168 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.441 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 3.3 t0 -112.04 107.33 16.24 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.102 -0.999 . . . . 0.0 110.468 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.6 mttt -58.82 -39.59 81.64 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.13 -0.981 . . . . 0.0 109.914 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.597 HD23 HD22 ' A' ' 106' ' ' LEU . 16.2 tp -60.61 -39.3 87.65 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.233 -0.917 . . . . 0.0 110.05 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.43 ' HA ' HD21 ' A' ' 106' ' ' LEU . 61.0 tp -70.11 -48.2 58.58 Favored 'General case' 0 N--CA 1.507 2.4 0 C-N-CA 119.203 -0.999 . . . . 0.0 108.669 179.229 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.441 HG22 ' HD2' ' A' ' 96' ' ' ARG . 62.9 mt -61.34 -38.22 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.434 0 C-N-CA 119.32 -0.952 . . . . 0.0 108.552 178.285 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.99 -39.06 83.31 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.146 -0.971 . . . . 0.0 109.087 178.401 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.467 ' HB3' HD22 ' A' ' 103' ' ' LEU . 5.8 mmtt -57.7 -41.85 82.5 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.043 -1.036 . . . . 0.0 109.43 179.363 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.418 ' CZ3' ' HG ' ' A' ' 91' ' ' LEU . 4.7 m0 -68.11 -40.21 82.62 Favored 'General case' 0 N--CA 1.506 2.352 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.475 179.296 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.441 ' HD2' HG22 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -66.16 -36.0 81.95 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.274 -0.891 . . . . 0.0 110.229 179.503 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.2 mmtp -53.84 -179.41 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.637 0 O-C-N 121.075 -1.016 . . . . 0.0 110.471 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -106.03 141.26 37.7 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.308 -0.87 . . . . 0.0 109.58 179.428 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.36 -20.49 49.62 Favored Glycine 0 N--CA 1.491 2.366 0 C-N-CA 119.854 -1.165 . . . . 0.0 110.608 -179.298 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -92.55 57.06 2.85 Favored 'General case' 0 N--CA 1.504 2.233 0 CA-C-N 119.313 1.556 . . . . 0.0 110.282 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -74.93 -38.57 61.76 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.009 -1.057 . . . . 0.0 109.66 179.324 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -111.91 83.95 1.88 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.239 -0.913 . . . . 0.0 109.602 179.583 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.881 HD13 HD13 ' A' ' 109' ' ' ILE . 9.3 tp -121.02 137.39 54.67 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.268 -0.895 . . . . 0.0 110.017 -179.293 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.439 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.8 p -111.6 -38.54 4.88 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.208 -0.932 . . . . 0.0 112.327 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.819 ' O ' HD11 ' A' ' 103' ' ' LEU . 5.5 m -139.65 -168.71 2.54 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 120.25 -1.531 . . . . 0.0 109.884 178.939 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.597 HD22 HD23 ' A' ' 90' ' ' LEU . 12.4 mt -97.59 -37.98 9.72 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.006 -1.059 . . . . 0.0 110.557 179.425 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.8 ttt-85 -101.89 32.2 3.54 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.939 -1.101 . . . . 0.0 109.464 178.067 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.672 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.306 1.7 t -127.36 16.22 7.13 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.231 -0.918 . . . . 0.0 109.119 -179.21 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.881 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -159.77 39.21 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 O-C-N 120.905 -1.122 . . . . 0.0 110.1 -178.891 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.769 ' C ' HG23 ' A' ' 119' ' ' THR . 1.7 tt0 -104.52 105.26 15.29 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.813 -1.179 . . . . 0.0 111.124 -178.518 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.646 ' HG3' HG21 ' A' ' 119' ' ' THR . 2.9 tttt -116.1 176.01 5.29 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.217 -0.927 . . . . 0.0 109.809 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 8.6 m-20 -165.81 -54.61 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.078 -1.014 . . . . 0.0 110.965 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -140.66 -160.2 1.05 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.178 -0.951 . . . . 0.0 109.701 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 1.4 p -90.09 -35.75 15.26 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 120.792 -1.193 . . . . 0.0 110.788 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 20.0 p30 -111.2 165.0 12.28 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.021 -1.049 . . . . 0.0 110.535 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 53.26 -174.22 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.994 -1.066 . . . . 0.0 110.609 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 91.8 -179.23 41.31 Favored Glycine 0 N--CA 1.494 2.521 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 65.1 m -146.07 96.87 2.86 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.177 -1.19 . . . . 0.0 110.531 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.769 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.3 OUTLIER -125.16 171.97 9.88 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.26 -0.9 . . . . 0.0 110.198 179.866 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.462 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 42.5 t -106.59 155.49 19.57 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.25 -0.906 . . . . 0.0 109.282 178.973 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.793 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -71.22 -36.81 63.66 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.336 0 O-C-N 121.098 -1.001 . . . . 0.0 110.757 -179.637 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.439 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 5.1 p -54.92 -32.68 61.44 Favored 'General case' 0 N--CA 1.512 2.636 0 O-C-N 120.84 -1.163 . . . . 0.0 110.968 -179.161 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.45 ' HG2' HG22 ' A' ' 109' ' ' ILE . 0.0 OUTLIER -58.5 -35.59 72.47 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.914 -1.116 . . . . 0.0 109.378 178.171 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 55.8 t -79.92 125.42 82.01 Favored Pre-proline 0 N--CA 1.503 2.187 0 O-C-N 121.21 -0.931 . . . . 0.0 109.478 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -64.94 167.94 14.78 Favored 'Trans proline' 0 N--CA 1.488 1.173 0 O-C-N 123.145 1.076 . . . . 0.0 110.662 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.03 -36.86 61.86 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.259 -0.901 . . . . 0.0 110.794 -179.529 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.11 -40.37 81.02 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.045 -1.035 . . . . 0.0 110.077 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -68.14 -41.52 81.5 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.201 -0.937 . . . . 0.0 109.323 179.434 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.781 HD11 HD11 ' A' ' 121' ' ' ILE . 10.9 mt -62.49 -38.48 90.05 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.496 -0.882 . . . . 0.0 109.859 179.495 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -59.98 -40.32 88.73 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.081 -1.012 . . . . 0.0 109.958 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -64.3 -38.96 92.88 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.174 -0.954 . . . . 0.0 109.822 179.474 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -60.61 -39.94 89.99 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.24 -0.913 . . . . 0.0 109.99 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.08 -45.06 95.18 Favored 'General case' 0 N--CA 1.508 2.452 0 C-N-CA 119.351 -0.94 . . . . 0.0 109.85 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 10.2 ttp85 -60.83 -39.05 87.58 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.203 -0.936 . . . . 0.0 109.789 179.617 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 27.8 mtmt -61.86 -34.38 75.89 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.144 -0.973 . . . . 0.0 110.602 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 29.4 mttt -102.49 18.48 21.06 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.005 -1.059 . . . . 0.0 111.921 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 55.35 45.45 83.34 Favored Glycine 0 N--CA 1.498 2.792 0 O-C-N 120.607 -1.308 . . . . 0.0 110.38 179.491 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.8 t -140.67 -163.44 1.53 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.171 -1.194 . . . . 0.0 110.079 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -138.51 145.41 40.73 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.184 -0.948 . . . . 0.0 110.253 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.571 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.6 p -132.03 160.85 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 O-C-N 121.147 -0.971 . . . . 0.0 110.109 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 41.4 t -168.8 80.68 0.14 Allowed 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.22 -0.925 . . . . 0.0 111.149 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.781 ' CG ' HD12 ' A' ' 121' ' ' ILE . 49.6 t80 -94.4 159.8 14.95 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.222 -0.924 . . . . 0.0 110.195 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 28.8 m170 -136.16 -61.13 0.71 Allowed 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 178.907 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -136.79 152.6 50.48 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.459 -0.776 . . . . 0.0 109.357 179.067 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 26.2 p -94.74 155.65 16.74 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.156 -0.965 . . . . 0.0 110.904 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.8 p -74.15 -25.28 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.532 0 O-C-N 121.344 -0.848 . . . . 0.0 111.583 -179.557 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -50.59 -46.68 58.04 Favored 'General case' 0 N--CA 1.517 2.896 0 O-C-N 120.755 -1.216 . . . . 0.0 109.594 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.498 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 29.5 p -141.5 -178.58 5.7 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.411 -0.806 . . . . 0.0 110.411 179.315 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -91.02 62.21 2.93 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 107.781 -2.128 . . . . 0.0 107.781 178.116 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.5 t -105.68 138.77 41.33 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.382 -1.069 . . . . 0.0 109.626 -178.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 3.7 tpt85 -92.65 57.05 2.81 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.276 -0.89 . . . . 0.0 109.727 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 61.82 96.25 0.01 OUTLIER Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.739 -1.344 . . . . 0.0 109.739 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.3 p -104.71 128.51 52.82 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.308 -1.113 . . . . 0.0 110.401 179.743 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -138.44 142.67 39.5 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.168 -0.957 . . . . 0.0 109.85 -179.856 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -110.54 -58.18 2.12 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.205 -0.934 . . . . 0.0 110.174 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 7.8 t -158.53 39.71 0.24 Allowed 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.149 -0.969 . . . . 0.0 110.824 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 . . . . . 0 N--CA 1.494 1.746 0 CA-C-O 118.065 -0.969 . . . . 0.0 110.394 -179.98 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.233 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -81.62 158.54 39.38 Favored Glycine 0 N--CA 1.493 2.438 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.2 m -125.6 154.42 72.86 Favored Pre-proline 0 N--CA 1.493 1.718 0 O-C-N 121.129 -1.218 . . . . 0.0 110.235 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.8 103.45 1.58 Allowed 'Trans proline' 0 C--N 1.317 -1.111 0 O-C-N 123.325 1.171 . . . . 0.0 110.433 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.1 mtt85 -125.64 57.41 1.34 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.287 -0.883 . . . . 0.0 110.13 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.8 mm -115.49 -57.39 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.161 -0.962 . . . . 0.0 110.105 -179.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 41.0 tttp -131.64 154.9 48.44 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.313 -0.867 . . . . 0.0 110.291 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 16.1 p -118.03 176.16 5.34 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.133 -0.979 . . . . 0.0 110.209 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 10.0 mtt85 -142.14 173.89 11.11 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.221 -0.924 . . . . 0.0 110.218 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.5 ttt-85 -127.01 133.22 50.58 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.231 -0.918 . . . . 0.0 110.259 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 34.6 t -130.84 137.71 49.51 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.134 -0.979 . . . . 0.0 110.137 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.4 mtpp -124.7 150.74 66.32 Favored Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.153 -0.967 . . . . 0.0 110.278 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.481 ' O ' ' HB3' ' A' ' 12' ' ' ALA . 46.7 Cg_endo -73.06 158.08 49.97 Favored 'Trans proline' 0 C--N 1.317 -1.118 0 O-C-N 123.437 1.23 . . . . 0.0 110.655 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.726 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . 61.96 147.79 0.09 OUTLIER Pre-proline 0 N--CA 1.503 2.183 0 O-C-N 121.307 -0.871 . . . . 0.0 110.691 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.56 162.63 40.83 Favored 'Trans proline' 0 C--N 1.318 -1.039 0 O-C-N 123.245 1.129 . . . . 0.0 110.675 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -48.77 -32.14 8.13 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 121.466 -0.771 . . . . 0.0 111.325 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -54.31 -33.42 52.73 Favored Glycine 0 N--CA 1.499 2.847 0 O-C-N 121.067 -1.021 . . . . 0.0 110.572 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -53.51 -31.48 46.27 Favored 'General case' 0 N--CA 1.512 2.662 0 O-C-N 120.903 -1.351 . . . . 0.0 110.818 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -54.37 -36.97 64.45 Favored 'General case' 0 N--CA 1.513 2.711 0 O-C-N 121.038 -1.039 . . . . 0.0 110.33 179.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.6 mmmt -57.14 -35.02 69.0 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.262 -0.899 . . . . 0.0 110.406 179.424 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.656 ' O ' HD12 ' A' ' 23' ' ' LEU . 3.2 pt -117.32 37.55 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.137 -0.977 . . . . 0.0 110.366 179.577 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.435 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 2.7 tmtt? -83.79 -42.91 0.79 Allowed Pre-proline 0 N--CA 1.507 2.394 0 O-C-N 121.142 -0.974 . . . . 0.0 113.254 -179.155 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.435 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.4 Cg_endo -75.85 -39.68 0.89 Allowed 'Trans proline' 0 N--CA 1.487 1.118 0 O-C-N 122.615 0.797 . . . . 0.0 111.853 -178.306 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.806 HG21 ' CE2' ' A' ' 62' ' ' TYR . 90.7 m -59.39 -43.25 92.96 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 120.906 -1.121 . . . . 0.0 109.952 -179.695 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.656 HD12 ' O ' ' A' ' 19' ' ' ILE . 3.6 mt -63.48 -37.8 88.67 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 119.425 -0.91 . . . . 0.0 109.506 179.304 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.3 m -56.63 -34.82 67.65 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.058 -1.026 . . . . 0.0 110.353 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.11 -38.81 73.95 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.004 -1.06 . . . . 0.0 110.014 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.723 ' CD2' HD22 ' A' ' 55' ' ' LEU . 22.6 m-85 -57.85 -40.09 79.28 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.121 -0.987 . . . . 0.0 110.025 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -57.02 -27.64 61.8 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.267 -0.896 . . . . 0.0 111.066 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.499 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.7 mp -78.09 -35.7 20.53 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.386 0 O-C-N 120.996 -1.065 . . . . 0.0 109.423 179.392 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.1 tp60 -79.78 -39.85 30.0 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 120.985 -1.072 . . . . 0.0 108.61 178.344 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.131 HD11 HG23 ' A' ' 52' ' ' ILE . 6.6 tp -69.6 -34.31 73.93 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.235 -0.916 . . . . 0.0 110.369 179.103 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -71.01 -35.54 72.07 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 120.885 -1.134 . . . . 0.0 109.953 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -65.44 -38.58 90.29 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.062 -1.024 . . . . 0.0 110.006 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.431 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -73.81 -42.02 61.51 Favored 'General case' 0 N--CA 1.504 2.251 0 C-N-CA 118.975 -1.09 . . . . 0.0 109.097 179.178 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -63.76 -33.19 75.1 Favored 'General case' 0 N--CA 1.505 2.322 0 C-N-CA 119.471 -0.892 . . . . 0.0 110.129 179.352 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.1 mttm -82.16 -31.35 30.53 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 120.857 -1.152 . . . . 0.0 110.893 179.756 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -54.0 -32.73 55.05 Favored 'General case' 0 N--CA 1.512 2.653 0 O-C-N 120.97 -1.081 . . . . 0.0 110.709 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 31.2 tttt -91.72 -47.15 7.52 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.117 -0.989 . . . . 0.0 110.062 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 71.0 m 52.21 45.37 28.52 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.033 -1.042 . . . . 0.0 110.974 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.1 t 52.88 84.29 0.06 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.049 -1.032 . . . . 0.0 110.854 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 32.6 ttmt 52.49 90.02 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.099 -1.0 . . . . 0.0 110.96 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.7 tt -148.22 -58.34 0.24 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.205 -0.935 . . . . 0.0 110.486 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -115.01 -164.08 0.92 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.205 -0.934 . . . . 0.0 110.08 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -103.95 -170.7 1.81 Allowed 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.103 -0.998 . . . . 0.0 110.054 179.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 52.82 73.49 0.35 Allowed 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.001 -1.062 . . . . 0.0 110.422 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.3 m -105.97 -50.89 3.08 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.227 -0.92 . . . . 0.0 110.434 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.416 ' O ' ' CG ' ' A' ' 50' ' ' TRP . 35.7 m120 -57.92 -40.01 79.36 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.168 -0.958 . . . . 0.0 109.924 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -66.13 -42.88 88.55 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.163 -0.96 . . . . 0.0 109.59 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.401 ' CG ' ' HA ' ' A' ' 33' ' ' ALA . 49.5 tp60 -68.51 -40.58 80.78 Favored 'General case' 0 N--CA 1.505 2.278 0 C-N-CA 119.293 -0.963 . . . . 0.0 109.347 179.283 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.586 HD23 HD12 ' A' ' 52' ' ' ILE . 13.1 mt -63.41 -36.85 85.1 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.238 -0.914 . . . . 0.0 109.924 179.574 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.516 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 53.6 m0 -58.04 -37.28 74.06 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 120.955 -1.09 . . . . 0.0 109.908 179.663 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -30.17 71.32 Favored 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 119.125 -1.03 . . . . 0.0 109.516 178.181 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 1.131 HG23 HD11 ' A' ' 30' ' ' LEU . 17.7 mt -69.61 -58.66 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.268 0 O-C-N 120.875 -1.14 . . . . 0.0 109.181 179.371 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.8 ptm -61.48 -29.96 70.31 Favored 'General case' 0 N--CA 1.51 2.557 0 C-N-CA 118.462 -1.295 . . . . 0.0 109.779 179.144 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -65.92 -38.23 88.13 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 120.887 -1.133 . . . . 0.0 109.167 178.276 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.723 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.3 mt -53.3 -32.23 47.82 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 120.962 -1.086 . . . . 0.0 110.182 179.108 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.461 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 72.6 t60 -55.61 -38.23 69.17 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 120.982 -1.074 . . . . 0.0 110.113 179.634 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.422 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.3 m170 -58.57 -47.17 85.18 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.091 -1.006 . . . . 0.0 109.412 179.261 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 -61.26 -35.64 77.82 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 119.407 -0.917 . . . . 0.0 109.219 178.65 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.459 ' HD3' ' CD1' ' A' ' 26' ' ' PHE . 20.2 mmm-85 -63.9 -51.14 65.88 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.105 -0.997 . . . . 0.0 109.37 179.212 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 52.0 p -60.58 -39.63 88.74 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.22 -0.925 . . . . 0.0 109.661 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.3 ttt85 -65.18 -41.76 94.28 Favored 'General case' 0 N--CA 1.504 2.255 0 C-N-CA 119.115 -1.034 . . . . 0.0 109.012 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.806 ' CE2' HG21 ' A' ' 22' ' ' THR . 46.1 t80 -63.37 -50.06 71.42 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.244 -0.91 . . . . 0.0 109.502 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.578 HD12 ' HB2' ' A' ' 87' ' ' ALA . 84.9 mt -70.2 -37.68 72.31 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.292 0 O-C-N 121.211 -0.931 . . . . 0.0 109.524 179.451 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.461 ' HD2' HD13 ' A' ' 92' ' ' ILE . 12.9 t80 -67.56 -42.17 83.04 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.168 -0.958 . . . . 0.0 108.995 179.04 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.404 ' HA ' ' HD3' ' A' ' 69' ' ' LYS . 90.0 m -61.19 -40.76 95.14 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.123 -0.986 . . . . 0.0 110.322 -179.653 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.599 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.35 -33.28 25.89 Favored 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 118.894 -1.122 . . . . 0.0 112.504 -178.875 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.502 ' N ' HD12 ' A' ' 66' ' ' LEU . 45.6 t80 -86.35 -32.12 21.15 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 120.611 -1.305 . . . . 0.0 111.927 -179.295 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -98.34 -18.98 18.04 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 120.874 -1.141 . . . . 0.0 112.721 -178.732 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.404 ' HD3' ' HA ' ' A' ' 65' ' ' THR . 13.5 mtpt -119.38 -58.77 1.89 Allowed 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.483 -1.385 . . . . 0.0 110.794 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.41 ' HB3' ' HA ' ' A' ' 66' ' ' LEU . 5.8 tpt180 -64.53 -30.59 71.62 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.11 -0.994 . . . . 0.0 110.99 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt 57.51 41.8 25.36 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 120.815 -1.178 . . . . 0.0 110.056 -179.367 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.07 35.46 3.93 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.409 -0.807 . . . . 0.0 109.941 179.288 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.81 HG13 HD23 ' A' ' 77' ' ' LEU . 13.8 tt -152.83 162.19 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.145 -0.972 . . . . 0.0 109.874 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.0 m -109.64 147.58 32.82 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.038 -1.039 . . . . 0.0 110.133 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.7 ttmt -45.81 -32.42 2.56 Favored 'General case' 0 N--CA 1.514 2.774 0 O-C-N 121.317 -0.865 . . . . 0.0 111.556 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.75 -50.28 73.02 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 120.987 -1.071 . . . . 0.0 109.205 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.81 HD23 HG13 ' A' ' 73' ' ' ILE . 41.7 tp -67.24 -44.48 79.35 Favored 'General case' 0 N--CA 1.505 2.292 0 C-N-CA 119.208 -0.997 . . . . 0.0 108.354 178.708 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.436 ' HA ' HD12 ' A' ' 81' ' ' LEU . 14.3 t80 -59.97 -37.58 80.04 Favored 'General case' 0 N--CA 1.507 2.397 0 C-N-CA 119.628 -0.829 . . . . 0.0 109.511 179.117 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.455 ' O ' HG22 ' A' ' 82' ' ' ILE . 32.3 t70 -75.22 -40.93 58.65 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.141 -0.974 . . . . 0.0 108.902 178.819 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.726 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 87.4 t90 -59.26 -37.83 78.6 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.05 -1.031 . . . . 0.0 109.263 178.744 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.54 HD23 ' CE2' ' A' ' 86' ' ' TYR . 11.4 mt -66.68 -57.28 7.48 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.188 -0.945 . . . . 0.0 109.057 178.855 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.553 HD11 ' N ' ' A' ' 89' ' ' LYS . 0.7 OUTLIER -56.01 -27.36 22.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.406 0 O-C-N 121.228 -0.92 . . . . 0.0 110.837 -179.877 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.9 tttt -89.52 -16.75 30.02 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 120.938 -1.101 . . . . 0.0 111.919 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.445 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 76.3 mm-40 -104.89 25.72 10.1 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.516 -1.365 . . . . 0.0 111.98 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.403 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 18.8 ttmt 76.64 66.92 0.05 Allowed 'General case' 0 N--CA 1.511 2.623 0 O-C-N 121.198 -0.938 . . . . 0.0 112.053 179.274 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.609 ' HE2' HD13 ' A' ' 23' ' ' LEU . 26.1 m-85 -129.95 -63.31 0.92 Allowed 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 178.751 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.578 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -135.75 171.21 14.78 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.497 -0.752 . . . . 0.0 109.23 179.164 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.461 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 11.0 t0 -119.49 111.72 18.46 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.151 -0.968 . . . . 0.0 110.273 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.553 ' N ' HD11 ' A' ' 82' ' ' ILE . 8.3 mtpt -57.58 -37.93 73.99 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.207 -0.933 . . . . 0.0 110.077 179.728 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.489 HD23 HD22 ' A' ' 106' ' ' LEU . 17.5 tp -59.08 -37.16 76.44 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.181 -0.949 . . . . 0.0 110.163 179.689 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.442 ' HA ' HD21 ' A' ' 106' ' ' LEU . 58.8 tp -70.03 -49.34 52.29 Favored 'General case' 0 N--CA 1.506 2.354 0 C-N-CA 119.231 -0.988 . . . . 0.0 108.764 179.275 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.461 HD13 ' HD2' ' A' ' 64' ' ' TYR . 68.1 mt -57.57 -38.51 64.37 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.52 0 O-C-N 121.148 -0.97 . . . . 0.0 108.693 178.415 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.04 -41.59 86.29 Favored 'General case' 0 N--CA 1.502 2.165 0 C-N-CA 119.356 -0.938 . . . . 0.0 108.742 178.309 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 8.3 mmtm -53.21 -39.84 64.02 Favored 'General case' 0 N--CA 1.512 2.669 0 O-C-N 121.162 -0.961 . . . . 0.0 109.892 179.177 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 3.6 m0 -68.85 -26.48 65.17 Favored 'General case' 0 N--CA 1.508 2.447 0 C-N-CA 119.436 -0.906 . . . . 0.0 110.723 179.486 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.49 -33.84 25.48 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 120.809 -1.182 . . . . 0.0 110.776 179.48 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? -53.26 -177.7 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.767 0 O-C-N 120.992 -1.068 . . . . 0.0 110.793 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -102.55 146.86 27.53 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.237 -0.914 . . . . 0.0 109.525 179.1 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 86.0 0.31 87.34 Favored Glycine 0 N--CA 1.495 2.619 0 C-N-CA 119.979 -1.105 . . . . 0.0 111.277 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.583 ' HB3' HD23 ' A' ' 103' ' ' LEU . 48.4 m-85 -111.06 67.17 0.64 Allowed 'General case' 0 N--CA 1.498 1.936 0 CA-C-N 119.576 1.688 . . . . 0.0 109.593 179.641 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -96.17 -35.35 11.34 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.111 -0.993 . . . . 0.0 110.935 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.54 63.0 0.77 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.021 -1.049 . . . . 0.0 110.895 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.583 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.5 pp -111.95 154.61 25.0 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.932 -1.105 . . . . 0.0 109.798 179.319 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.422 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.4 p -115.6 -30.47 6.16 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -178.923 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.634 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.5 m -142.09 -167.45 2.47 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 120.052 -1.655 . . . . 0.0 110.087 179.399 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.489 HD22 HD23 ' A' ' 90' ' ' LEU . 13.6 mt -95.53 -40.13 9.61 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.142 -0.974 . . . . 0.0 109.89 179.17 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -101.15 28.51 5.3 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.044 -1.035 . . . . 0.0 110.067 178.189 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.634 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.8 t -126.92 15.6 7.4 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.047 -1.033 . . . . 0.0 109.112 -179.584 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.501 HG22 ' HG3' ' A' ' 123' ' ' ARG . 1.0 OUTLIER -159.34 38.75 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 O-C-N 120.931 -1.106 . . . . 0.0 110.345 -178.783 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.695 ' C ' HG23 ' A' ' 119' ' ' THR . 1.2 tt0 -110.11 117.44 33.73 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 120.79 -1.194 . . . . 0.0 111.452 -178.503 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.444 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 21.9 ttmt -107.82 -57.73 2.06 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.292 -0.88 . . . . 0.0 110.18 179.34 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 50.89 -174.59 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.092 0 O-C-N 120.974 -1.079 . . . . 0.0 110.934 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -167.87 84.61 0.2 Allowed 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.194 -0.941 . . . . 0.0 111.018 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 91.1 m -144.01 -59.27 0.39 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.226 -0.921 . . . . 0.0 110.411 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -154.45 -57.63 0.11 Allowed 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.098 -1.001 . . . . 0.0 110.676 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 53.3 t-20 -119.33 73.22 0.93 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.236 -0.915 . . . . 0.0 110.203 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -93.3 128.67 9.55 Favored Glycine 0 N--CA 1.493 2.457 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 14.1 m -117.27 124.54 49.26 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.202 -1.175 . . . . 0.0 110.141 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.695 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.2 OUTLIER -125.41 174.82 7.91 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.208 -0.932 . . . . 0.0 110.476 -179.931 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.458 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 48.5 t -109.25 155.48 21.07 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.359 -0.838 . . . . 0.0 109.116 178.811 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.962 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -73.65 -30.83 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 121.026 -1.046 . . . . 0.0 111.475 -179.163 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.478 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.4 p -59.79 -35.85 75.51 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 120.598 -1.314 . . . . 0.0 110.486 -179.432 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.501 ' HG3' HG22 ' A' ' 109' ' ' ILE . 0.1 OUTLIER -57.03 -33.13 66.88 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.041 -1.037 . . . . 0.0 109.961 178.807 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 61.6 t -79.78 123.93 83.65 Favored Pre-proline 0 N--CA 1.504 2.25 0 O-C-N 121.062 -1.024 . . . . 0.0 109.965 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.462 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.8 Cg_endo -66.33 -178.22 1.08 Allowed 'Trans proline' 0 N--CA 1.488 1.149 0 O-C-N 123.112 1.059 . . . . 0.0 110.785 179.574 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -75.06 -38.0 61.48 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.208 -0.932 . . . . 0.0 110.413 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.1 -43.37 91.87 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.052 -1.03 . . . . 0.0 109.95 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 64.1 tp60 -67.3 -41.54 85.21 Favored 'General case' 0 N--CA 1.506 2.331 0 C-N-CA 119.296 -0.962 . . . . 0.0 109.298 179.364 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.497 HD11 HD11 ' A' ' 121' ' ' ILE . 4.6 mt -63.44 -38.95 93.11 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.274 -0.891 . . . . 0.0 109.508 179.195 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -59.07 -39.55 82.43 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.058 -1.026 . . . . 0.0 109.989 179.766 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -58.59 -38.04 77.08 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.122 -0.986 . . . . 0.0 110.212 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -59.98 -41.99 93.23 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.177 -0.952 . . . . 0.0 110.048 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.662 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -61.49 -45.12 95.57 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.17 -0.956 . . . . 0.0 109.809 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 14.2 mmt180 -59.58 -39.26 83.55 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.155 -0.966 . . . . 0.0 109.9 179.653 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 3.4 ttmt -58.82 -35.75 73.39 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.148 -0.97 . . . . 0.0 110.515 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 43.8 mttt -107.74 21.62 17.16 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 120.961 -1.087 . . . . 0.0 111.827 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.5 46.26 58.57 Favored Glycine 0 N--CA 1.499 2.888 0 O-C-N 120.695 -1.253 . . . . 0.0 110.656 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.662 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 9.0 t -141.03 -165.06 1.87 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.155 -1.203 . . . . 0.0 110.176 179.822 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -126.54 171.98 10.62 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.12 -0.988 . . . . 0.0 110.355 -179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 8.7 p -157.06 160.94 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.326 -0.859 . . . . 0.0 110.664 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 27.3 t -167.58 107.31 0.57 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.185 -0.947 . . . . 0.0 110.911 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.962 ' CD1' HD12 ' A' ' 121' ' ' ILE . 84.2 t80 -108.79 160.23 16.14 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.247 -0.908 . . . . 0.0 111.035 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -138.61 -61.03 0.59 Allowed 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.587 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -142.15 149.12 39.35 Favored 'General case' 0 N--CA 1.495 1.821 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 178.53 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' CYS . . . . . 0.415 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 29.6 p -89.88 153.88 20.3 Favored 'General case' 0 N--CA 1.506 2.342 0 C-N-CA 119.078 -1.049 . . . . 0.0 111.187 -179.372 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 19.6 m -72.54 -23.43 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 121.428 -0.795 . . . . 0.0 111.385 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -51.52 -62.6 1.52 Allowed 'General case' 0 N--CA 1.513 2.723 0 O-C-N 120.781 -1.2 . . . . 0.0 110.021 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.516 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 21.9 p -123.9 -164.5 1.24 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.27 -0.894 . . . . 0.0 110.321 179.255 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 149' ' ' GLY . . . . . 0.434 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -101.58 64.45 0.5 Allowed Glycine 0 N--CA 1.493 2.462 0 N-CA-C 107.897 -2.081 . . . . 0.0 107.897 178.501 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 28.4 t -104.36 141.42 36.35 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.314 -1.109 . . . . 0.0 109.965 -179.046 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 46.0 ttt180 -97.06 51.01 1.1 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.271 -0.893 . . . . 0.0 109.476 179.044 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.2 99.32 0.05 OUTLIER Glycine 0 N--CA 1.486 2.028 0 N-CA-C 109.969 -1.252 . . . . 0.0 109.969 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 26.2 p -110.19 126.37 54.04 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.269 -1.136 . . . . 0.0 110.148 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -150.33 148.44 28.82 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.038 -1.039 . . . . 0.0 110.472 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -102.24 -45.67 5.05 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.26 -0.9 . . . . 0.0 110.562 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.97 -38.7 68.11 Favored 'General case' 0 N--CA 1.511 2.607 0 O-C-N 121.061 -1.025 . . . . 0.0 110.543 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.494 1.744 0 CA-C-O 118.019 -0.991 . . . . 0.0 110.149 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.28 0 N-CA-C 109.511 -1.435 . . . . 0.0 109.511 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -74.76 155.21 47.95 Favored Glycine 0 N--CA 1.493 2.49 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.5 t -141.79 149.83 54.61 Favored Pre-proline 0 N--CA 1.494 1.747 0 O-C-N 121.154 -1.204 . . . . 0.0 110.245 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.05 -171.22 0.74 Allowed 'Trans proline' 0 C--N 1.317 -1.109 0 O-C-N 123.388 1.204 . . . . 0.0 110.425 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 52.65 95.17 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.098 -1.001 . . . . 0.0 110.845 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.3 tp -142.43 138.66 29.28 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.236 -0.915 . . . . 0.0 110.117 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.2 tttm -134.72 -169.66 2.39 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.216 -0.927 . . . . 0.0 110.023 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.2 p -119.03 75.73 1.06 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.149 -0.969 . . . . 0.0 110.297 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 21.5 mtt180 -141.21 142.84 33.94 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.141 -0.974 . . . . 0.0 110.082 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.8 mmt85 -116.4 107.74 15.17 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.282 -0.886 . . . . 0.0 110.288 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.6 m -129.28 81.02 2.0 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.184 -0.948 . . . . 0.0 110.221 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.12 175.39 0.04 OUTLIER Pre-proline 0 N--CA 1.502 2.146 0 O-C-N 121.102 -0.999 . . . . 0.0 110.687 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.484 ' O ' ' HB3' ' A' ' 12' ' ' ALA . 46.5 Cg_endo -72.57 158.92 50.06 Favored 'Trans proline' 0 C--N 1.315 -1.193 0 O-C-N 123.405 1.213 . . . . 0.0 110.484 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.757 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . 61.86 152.1 0.11 Allowed Pre-proline 0 N--CA 1.504 2.235 0 O-C-N 121.221 -0.925 . . . . 0.0 110.394 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.01 163.77 38.09 Favored 'Trans proline' 0 C--N 1.317 -1.095 0 O-C-N 123.387 1.204 . . . . 0.0 110.718 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -48.27 -32.39 7.22 Favored 'General case' 0 N--CA 1.516 2.841 0 O-C-N 121.435 -0.791 . . . . 0.0 111.426 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.81 -34.89 51.77 Favored Glycine 0 N--CA 1.498 2.812 0 O-C-N 120.967 -1.083 . . . . 0.0 110.417 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.436 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 27.3 t80 -55.17 -33.14 62.72 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 121.039 -1.271 . . . . 0.0 110.739 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.7 tm-20 -54.4 -38.06 65.78 Favored 'General case' 0 N--CA 1.511 2.623 0 O-C-N 120.984 -1.073 . . . . 0.0 110.206 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.8 mttm -59.06 -35.62 73.65 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.257 -0.902 . . . . 0.0 110.21 179.512 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.64 ' O ' HD12 ' A' ' 23' ' ' LEU . 1.9 pt -117.99 37.07 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 121.074 -1.016 . . . . 0.0 110.34 179.756 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.432 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 2.5 tmtt? -84.82 -43.35 0.69 Allowed Pre-proline 0 N--CA 1.509 2.488 0 O-C-N 121.12 -0.988 . . . . 0.0 113.379 -179.041 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.432 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.7 Cg_endo -76.3 -37.15 1.52 Allowed 'Trans proline' 0 N--CA 1.486 1.065 0 O-C-N 122.586 0.782 . . . . 0.0 111.892 -178.018 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.67 HG21 ' CE2' ' A' ' 62' ' ' TYR . 88.2 m -59.85 -42.07 92.84 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 120.919 -1.113 . . . . 0.0 110.131 -179.579 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.704 HD13 ' HE2' ' A' ' 86' ' ' TYR . 2.4 mt -64.85 -39.07 92.98 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 119.387 -0.925 . . . . 0.0 109.577 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.0 -35.59 69.4 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.159 -0.963 . . . . 0.0 110.247 179.502 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -57.24 -36.33 70.8 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.056 -1.027 . . . . 0.0 110.389 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.528 ' CD2' HD22 ' A' ' 55' ' ' LEU . 15.5 m-85 -59.05 -39.64 82.64 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.07 -1.019 . . . . 0.0 110.525 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -59.45 -39.43 83.6 Favored 'General case' 0 N--CA 1.508 2.427 0 C-N-CA 119.362 -0.935 . . . . 0.0 110.42 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.431 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.1 mp -65.37 -41.78 92.04 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.341 0 C-N-CA 119.204 -0.998 . . . . 0.0 108.764 179.452 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.66 -50.83 40.31 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.209 -0.997 . . . . 0.0 108.443 178.617 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.054 HD11 HG23 ' A' ' 52' ' ' ILE . 5.2 tp -58.9 -34.53 71.78 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.25 -0.906 . . . . 0.0 109.502 178.404 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.08 -39.8 79.47 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 121.061 -1.025 . . . . 0.0 110.194 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -63.03 -51.12 67.97 Favored 'General case' 0 N--CA 1.507 2.403 0 C-N-CA 119.27 -0.972 . . . . 0.0 109.57 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.495 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -68.26 -38.71 82.03 Favored 'General case' 0 N--CA 1.505 2.314 0 C-N-CA 119.249 -0.98 . . . . 0.0 109.262 179.031 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -67.41 -34.04 76.42 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.207 -0.933 . . . . 0.0 110.117 179.293 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 9.2 mmtt -78.79 -38.03 39.44 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.0 -1.063 . . . . 0.0 110.293 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -58.45 -39.09 78.93 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.06 -1.025 . . . . 0.0 110.162 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 72.9 tttt -56.72 -37.53 71.09 Favored 'General case' 0 N--CA 1.511 2.579 0 O-C-N 121.131 -0.98 . . . . 0.0 110.382 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.5 m -112.04 50.3 0.86 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.113 -0.992 . . . . 0.0 110.218 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.442 ' OG ' ' HD3' ' A' ' 40' ' ' LYS . 1.6 t -142.98 -62.08 0.42 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.205 -0.935 . . . . 0.0 110.19 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.442 ' HD3' ' OG ' ' A' ' 39' ' ' SER . 0.1 OUTLIER -114.07 -54.9 2.55 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.24 -0.912 . . . . 0.0 110.209 179.969 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.428 ' O ' HD23 ' A' ' 41' ' ' LEU . 1.0 OUTLIER 54.37 47.51 22.76 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.045 -1.035 . . . . 0.0 110.656 -179.959 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -120.62 -58.17 1.85 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.212 -0.93 . . . . 0.0 110.148 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -129.85 153.6 48.11 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.252 -0.905 . . . . 0.0 110.138 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.9 mmmt 52.68 61.35 3.23 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.06 -1.025 . . . . 0.0 110.678 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -111.13 -53.46 2.7 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.227 -0.921 . . . . 0.0 110.406 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -56.87 -39.44 74.33 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 121.167 -0.958 . . . . 0.0 109.962 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -61.48 -40.53 94.86 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.238 -0.914 . . . . 0.0 109.766 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 49.7 tp60 -61.4 -40.54 94.74 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.147 -0.971 . . . . 0.0 109.848 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -60.01 -39.19 84.94 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.124 -0.985 . . . . 0.0 110.083 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.505 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.8 m0 -58.09 -37.03 73.74 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.011 -1.055 . . . . 0.0 110.023 179.603 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -60.59 -30.36 69.76 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.081 -1.012 . . . . 0.0 110.089 178.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 1.054 HG23 HD11 ' A' ' 30' ' ' LEU . 17.1 mt -72.27 -58.78 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.237 0 O-C-N 120.871 -1.143 . . . . 0.0 109.107 179.424 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.3 ptm -60.79 -29.53 69.5 Favored 'General case' 0 N--CA 1.509 2.515 0 C-N-CA 118.52 -1.272 . . . . 0.0 109.684 178.59 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -70.33 -38.91 74.98 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 120.904 -1.122 . . . . 0.0 108.931 177.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.528 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.3 mt -53.69 -31.53 48.29 Favored 'General case' 0 N--CA 1.512 2.642 0 O-C-N 121.058 -1.026 . . . . 0.0 110.3 178.821 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.451 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 3.9 t60 -57.13 -37.38 71.92 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.002 -1.062 . . . . 0.0 110.097 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.489 ' NE2' HD21 ' A' ' 91' ' ' LEU . 5.8 m170 -59.31 -48.67 80.77 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.006 -1.059 . . . . 0.0 109.457 179.044 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.6 tp60 -60.82 -37.27 81.43 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 119.34 -0.944 . . . . 0.0 109.071 178.755 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.434 ' HD2' ' CD2' ' A' ' 26' ' ' PHE . 11.5 mtp85 -66.36 -51.79 53.58 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.147 -0.971 . . . . 0.0 109.024 178.7 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.453 ' HA ' ' HB1' ' A' ' 87' ' ' ALA . 22.2 p -63.46 -38.78 92.45 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.241 -0.912 . . . . 0.0 109.177 179.156 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -65.18 -38.82 91.72 Favored 'General case' 0 N--CA 1.507 2.41 0 C-N-CA 119.242 -0.983 . . . . 0.0 109.25 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.67 ' CE2' HG21 ' A' ' 22' ' ' THR . 37.1 t80 -60.99 -49.8 75.99 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.155 -0.966 . . . . 0.0 109.313 179.441 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.63 HD12 ' HB2' ' A' ' 87' ' ' ALA . 87.7 mt -74.3 -41.76 50.63 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 C-N-CA 119.42 -0.912 . . . . 0.0 109.128 179.219 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.497 ' CD1' ' CD2' ' A' ' 68' ' ' TYR . 45.8 t80 -60.51 -35.38 75.83 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.259 -0.901 . . . . 0.0 109.653 178.873 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.401 ' HA ' ' CD ' ' A' ' 69' ' ' LYS . 79.7 m -74.52 -38.24 62.85 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.926 -1.109 . . . . 0.0 110.422 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.561 ' C ' HD12 ' A' ' 66' ' ' LEU . 3.7 pp -83.08 -30.86 27.66 Favored 'General case' 0 N--CA 1.505 2.288 0 C-N-CA 119.028 -1.069 . . . . 0.0 112.512 -179.046 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.482 ' N ' HD12 ' A' ' 66' ' ' LEU . 42.1 t80 -86.04 -33.25 21.07 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 120.634 -1.291 . . . . 0.0 111.724 -179.203 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.497 ' CD2' ' CD1' ' A' ' 64' ' ' TYR . 29.4 m-85 -97.4 -25.73 15.11 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.708 -1.245 . . . . 0.0 112.432 -178.774 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.401 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 4.6 mttt -113.37 -60.14 1.92 Allowed 'General case' 0 N--CA 1.501 2.078 0 O-C-N 120.659 -1.275 . . . . 0.0 111.131 -179.645 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.418 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 3.0 ttt85 -62.68 -31.06 71.88 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.127 -0.983 . . . . 0.0 110.641 -179.714 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.1 tttt 58.29 44.33 18.78 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 120.813 -1.18 . . . . 0.0 110.001 -179.635 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.33 36.36 3.59 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.358 -0.839 . . . . 0.0 109.891 179.238 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.79 HG13 HD23 ' A' ' 77' ' ' LEU . 14.2 tt -157.32 162.53 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.206 -0.934 . . . . 0.0 110.175 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.56 149.49 29.57 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.164 -0.96 . . . . 0.0 110.232 179.848 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.9 tttt -46.29 -32.35 3.06 Favored 'General case' 0 N--CA 1.515 2.807 0 O-C-N 121.362 -0.836 . . . . 0.0 111.584 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -63.1 -51.96 64.49 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.925 -1.109 . . . . 0.0 109.274 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.79 HD23 HG13 ' A' ' 73' ' ' ILE . 40.5 tp -65.04 -43.48 92.2 Favored 'General case' 0 N--CA 1.506 2.347 0 C-N-CA 119.141 -1.024 . . . . 0.0 108.559 178.905 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.71 ' HA ' HD12 ' A' ' 81' ' ' LEU . 14.0 t80 -60.99 -41.72 97.03 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.301 -0.875 . . . . 0.0 109.242 179.151 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -70.57 -42.69 70.77 Favored 'General case' 0 N--CA 1.503 2.221 0 C-N-CA 119.321 -0.951 . . . . 0.0 108.518 178.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.757 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 86.6 t90 -56.99 -35.19 68.89 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.338 -0.851 . . . . 0.0 109.519 178.526 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.71 HD12 ' HA ' ' A' ' 78' ' ' TYR . 13.4 mt -67.53 -57.94 5.6 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.084 -1.01 . . . . 0.0 109.081 179.077 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.417 ' CD1' ' CE1' ' A' ' 78' ' ' TYR . 0.5 OUTLIER -57.24 -27.22 27.45 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.685 0 C-N-CA 119.044 -1.063 . . . . 0.0 109.897 179.218 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -83.34 -20.42 34.35 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 120.885 -1.134 . . . . 0.0 111.391 179.399 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.437 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 16.5 mm-40 -107.21 22.97 15.17 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 120.652 -1.28 . . . . 0.0 111.989 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 8.1 tttp 74.44 78.45 0.12 Allowed 'General case' 0 N--CA 1.511 2.61 0 O-C-N 121.072 -1.017 . . . . 0.0 111.37 179.446 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.704 ' HE2' HD13 ' A' ' 23' ' ' LEU . 28.4 m-85 -136.52 -63.79 0.61 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.622 -0.674 . . . . 0.0 109.707 -179.781 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.63 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -128.5 -173.42 2.95 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.349 -0.844 . . . . 0.0 109.755 179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.451 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 7.8 t0 -126.18 102.57 7.26 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.151 -0.968 . . . . 0.0 110.53 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.6 mtmt -59.37 -38.48 80.57 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 121.184 -0.948 . . . . 0.0 109.95 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.665 HD23 HD13 ' A' ' 106' ' ' LEU . 26.0 tp -60.44 -41.71 94.62 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.194 -0.941 . . . . 0.0 109.864 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.495 ' N ' HD11 ' A' ' 106' ' ' LEU . 60.5 tp -67.01 -49.42 65.38 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.068 -1.02 . . . . 0.0 108.961 179.321 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.482 HG23 ' CE1' ' A' ' 64' ' ' TYR . 40.7 mt -56.81 -36.36 49.32 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.47 0 O-C-N 121.124 -0.985 . . . . 0.0 108.918 178.609 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.77 -39.64 94.79 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.121 -0.987 . . . . 0.0 109.082 178.224 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.436 ' HD2' ' CZ ' ' A' ' 100' ' ' TYR . 4.3 mmtt -59.32 -46.58 88.19 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.087 -1.008 . . . . 0.0 109.276 179.274 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.0 m0 -60.17 -37.54 80.48 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.247 -0.908 . . . . 0.0 110.111 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.6 mtp85 -75.14 -31.92 61.21 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.064 -1.023 . . . . 0.0 110.615 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -53.97 -176.9 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.699 0 O-C-N 121.014 -1.054 . . . . 0.0 110.572 179.754 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 2.4 m -102.89 133.38 48.08 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.183 -0.948 . . . . 0.0 109.751 179.217 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.39 9.09 57.08 Favored Glycine 0 N--CA 1.493 2.486 0 C-N-CA 120.152 -1.023 . . . . 0.0 111.242 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.486 ' HB3' HD23 ' A' ' 103' ' ' LEU . 51.4 m-85 -116.08 69.02 0.73 Allowed 'General case' 0 N--CA 1.495 1.801 0 CA-C-N 119.569 1.685 . . . . 0.0 109.971 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -97.29 -35.25 10.79 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.143 -0.973 . . . . 0.0 110.915 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.98 71.88 0.95 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.999 -1.063 . . . . 0.0 110.8 -179.611 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.486 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.3 pp -123.58 161.78 24.3 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.038 -1.039 . . . . 0.0 109.946 179.38 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.483 ' N ' HD12 ' A' ' 103' ' ' LEU . 26.8 p -120.48 -33.0 3.95 Favored 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -178.83 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.626 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.8 m -140.92 -168.39 2.59 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.067 -1.646 . . . . 0.0 110.162 179.51 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.665 HD13 HD23 ' A' ' 90' ' ' LEU . 13.2 mt -95.47 -39.4 10.0 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.235 -0.916 . . . . 0.0 109.909 178.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 9.3 ttm180 -101.15 27.23 6.28 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.913 -1.117 . . . . 0.0 110.271 178.174 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.626 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.287 1.8 t -124.82 14.38 8.6 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.054 -1.029 . . . . 0.0 109.213 -179.779 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.458 HG23 ' C ' ' A' ' 108' ' ' CYS . 1.0 OUTLIER -158.67 35.64 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.339 0 O-C-N 120.714 -1.241 . . . . 0.0 111.116 -178.8 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.59 ' O ' HG23 ' A' ' 119' ' ' THR . 12.3 mt-30 -136.31 152.76 51.03 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 120.604 -1.31 . . . . 0.0 111.498 -178.894 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.439 ' HB3' ' OG1' ' A' ' 119' ' ' THR . 0.0 OUTLIER -132.13 -176.09 3.95 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.213 -0.93 . . . . 0.0 110.065 179.581 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -124.29 175.92 6.77 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.247 -0.908 . . . . 0.0 110.24 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -116.13 154.21 30.39 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.147 -0.971 . . . . 0.0 110.124 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 65.32 -68.53 0.11 Allowed 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.13 -0.982 . . . . 0.0 110.888 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 13.6 t30 -149.21 -172.76 4.2 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.837 -1.164 . . . . 0.0 110.457 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 4.0 t30 53.05 50.94 16.76 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 120.945 -1.097 . . . . 0.0 110.794 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -83.19 134.61 12.99 Favored Glycine 0 N--CA 1.493 2.485 0 N-CA-C 109.469 -1.452 . . . . 0.0 109.469 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 13.8 m -147.06 95.16 2.52 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.174 -1.192 . . . . 0.0 110.48 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.59 HG23 ' O ' ' A' ' 110' ' ' GLN . 2.8 m -132.96 169.84 16.22 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.22 -0.925 . . . . 0.0 110.069 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 46.7 t -101.49 155.55 18.01 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.259 -0.9 . . . . 0.0 109.785 179.698 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.815 HD12 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -71.64 -37.47 63.33 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.347 0 O-C-N 121.087 -1.008 . . . . 0.0 110.682 -179.554 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.463 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 9.2 p -52.82 -32.98 47.13 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 120.953 -1.092 . . . . 0.0 111.262 -178.773 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -33.19 68.71 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 120.907 -1.121 . . . . 0.0 109.852 178.34 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 48.4 t -81.11 125.73 78.85 Favored Pre-proline 0 N--CA 1.503 2.216 0 O-C-N 121.1 -1.0 . . . . 0.0 109.746 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.661 ' HD3' ' HB1' ' A' ' 154' ' ' ALA . 38.1 Cg_endo -65.91 172.02 9.04 Favored 'Trans proline' 0 N--CA 1.489 1.224 0 O-C-N 123.145 1.076 . . . . 0.0 110.815 179.696 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 5.1 tpt180 -75.07 -37.88 61.47 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.304 -0.873 . . . . 0.0 110.426 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.53 -40.28 78.45 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.071 -1.018 . . . . 0.0 110.107 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -69.41 -40.89 77.03 Favored 'General case' 0 N--CA 1.505 2.302 0 C-N-CA 119.344 -0.942 . . . . 0.0 109.333 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.663 ' O ' HG11 ' A' ' 140' ' ' VAL . 4.3 mt -67.14 -38.93 86.39 Favored 'General case' 0 N--CA 1.507 2.377 0 C-N-CA 119.494 -0.882 . . . . 0.0 109.591 179.254 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -65.96 -40.07 90.96 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.133 -0.98 . . . . 0.0 109.573 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.71 -39.64 94.66 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.165 -0.959 . . . . 0.0 109.791 179.551 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -60.41 -41.78 94.64 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.287 -0.883 . . . . 0.0 110.031 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.41 -40.63 91.69 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.223 -0.923 . . . . 0.0 110.025 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -60.16 -39.59 86.94 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.239 -0.913 . . . . 0.0 109.95 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -61.76 -34.92 76.71 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.247 -0.908 . . . . 0.0 110.697 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.14 19.24 19.93 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 120.948 -1.095 . . . . 0.0 111.942 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 53.35 41.47 62.7 Favored Glycine 0 N--CA 1.5 2.903 0 O-C-N 120.612 -1.305 . . . . 0.0 110.593 179.406 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.7 t -131.54 -163.49 1.33 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.091 -1.241 . . . . 0.0 109.969 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -142.1 140.78 32.61 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.131 -0.981 . . . . 0.0 110.494 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.663 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.4 p -131.87 161.2 41.69 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.186 -0.946 . . . . 0.0 109.886 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 33.2 t -167.59 83.25 0.21 Allowed 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.175 -0.953 . . . . 0.0 111.48 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.815 ' CG ' HD12 ' A' ' 121' ' ' ILE . 36.5 t80 -93.56 162.1 14.09 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.187 -0.946 . . . . 0.0 109.943 179.501 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -139.07 -59.51 0.59 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.417 -0.802 . . . . 0.0 109.379 179.129 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.82 152.14 51.51 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.324 -0.86 . . . . 0.0 109.384 179.179 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 145' ' ' CYS . . . . . 0.408 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 25.1 p -97.19 156.89 16.21 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.21 -0.931 . . . . 0.0 110.894 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 12.9 p -77.83 -22.18 13.84 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.509 0 O-C-N 121.337 -0.852 . . . . 0.0 111.872 -179.472 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 62.8 m170 -50.96 -57.88 7.44 Favored 'General case' 0 N--CA 1.516 2.839 0 O-C-N 120.834 -1.166 . . . . 0.0 109.9 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.505 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.8 p -128.78 -163.43 1.29 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.303 -0.873 . . . . 0.0 110.279 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.41 65.22 0.57 Allowed Glycine 0 N--CA 1.493 2.435 0 N-CA-C 108.036 -2.026 . . . . 0.0 108.036 178.405 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 37.3 t -104.59 147.36 27.71 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.31 -1.111 . . . . 0.0 110.297 -178.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 28.7 mtt85 -102.79 42.94 1.11 Allowed 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.327 -0.858 . . . . 0.0 109.482 179.237 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 77.06 96.72 0.19 Allowed Glycine 0 N--CA 1.487 2.08 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 22.7 p -111.53 128.42 56.02 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.23 -1.159 . . . . 0.0 110.554 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 154' ' ' ALA . . . . . 0.661 ' HB1' ' HD3' ' A' ' 125' ' ' PRO . . . -154.83 145.86 22.68 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.162 -0.962 . . . . 0.0 110.474 -179.735 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -119.21 -57.61 1.99 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.199 -0.938 . . . . 0.0 110.349 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -151.24 39.25 0.66 Allowed 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.195 -0.941 . . . . 0.0 110.588 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 . . . . . 0 N--CA 1.494 1.773 0 O-C-N 121.129 -0.982 . . . . 0.0 110.169 -179.958 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.361 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -117.34 75.02 0.28 Allowed Glycine 0 N--CA 1.493 2.494 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.3 p -136.45 94.59 13.51 Favored Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.114 -1.227 . . . . 0.0 110.198 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.32 123.4 9.14 Favored 'Trans proline' 0 C--N 1.317 -1.116 0 O-C-N 123.426 1.224 . . . . 0.0 110.467 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.2 ptt-85 -137.61 64.21 1.53 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.206 -0.934 . . . . 0.0 110.187 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 8.0 tt -132.88 149.32 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.077 -1.014 . . . . 0.0 110.279 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.2 tttt -137.3 151.96 49.23 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.206 -0.934 . . . . 0.0 110.28 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 26.5 m -128.69 135.08 48.76 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.18 -0.95 . . . . 0.0 110.246 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 19.5 mtt85 -120.49 118.3 29.9 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.191 -0.943 . . . . 0.0 110.184 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.06 -60.42 0.68 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.264 -0.898 . . . . 0.0 110.322 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.1 t -164.2 167.23 20.29 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.119 -0.988 . . . . 0.0 110.953 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.74 98.78 24.01 Favored Pre-proline 0 N--CA 1.494 1.774 0 O-C-N 121.182 -0.949 . . . . 0.0 110.077 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -71.55 158.13 54.51 Favored 'Trans proline' 0 C--N 1.316 -1.154 0 O-C-N 123.45 1.237 . . . . 0.0 110.847 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.676 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -65.89 145.78 99.01 Favored Pre-proline 0 N--CA 1.51 2.539 0 O-C-N 121.406 -0.809 . . . . 0.0 109.615 179.742 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.405 ' HG2' HD13 ' A' ' 77' ' ' LEU . 45.2 Cg_endo -70.6 162.26 43.13 Favored 'Trans proline' 0 N--CA 1.487 1.13 0 O-C-N 123.335 1.177 . . . . 0.0 110.772 -179.744 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -48.53 -32.03 7.36 Favored 'General case' 0 N--CA 1.514 2.772 0 O-C-N 121.443 -0.786 . . . . 0.0 111.402 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.12 -34.0 38.74 Favored Glycine 0 N--CA 1.499 2.867 0 O-C-N 120.938 -1.101 . . . . 0.0 110.641 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.434 ' CE2' ' HG2' ' A' ' 20' ' ' LYS . 27.2 t80 -55.19 -32.4 62.17 Favored 'General case' 0 N--CA 1.511 2.585 0 O-C-N 120.882 -1.363 . . . . 0.0 110.795 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -53.15 -37.84 62.21 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 120.975 -1.078 . . . . 0.0 110.276 179.792 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.5 mmtt -59.56 -36.48 76.27 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.579 -0.848 . . . . 0.0 110.213 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.879 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.2 pt -120.79 35.6 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.175 -0.953 . . . . 0.0 110.602 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.434 ' HG2' ' CE2' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -85.22 -43.11 0.66 Allowed Pre-proline 0 N--CA 1.509 2.522 0 O-C-N 121.052 -1.03 . . . . 0.0 113.561 -178.892 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.1 Cg_endo -75.37 -35.86 2.66 Favored 'Trans proline' 0 N--CA 1.486 1.051 0 O-C-N 122.521 0.748 . . . . 0.0 112.007 -177.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.597 HG21 ' CE2' ' A' ' 62' ' ' TYR . 79.5 m -61.83 -46.38 89.75 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 120.982 -1.074 . . . . 0.0 109.945 -179.717 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.879 HD12 ' O ' ' A' ' 19' ' ' ILE . 5.0 mt -60.8 -37.2 81.13 Favored 'General case' 0 N--CA 1.507 2.397 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.812 179.512 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 72.6 m -57.22 -36.45 70.91 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 121.066 -1.021 . . . . 0.0 110.22 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -57.4 -38.82 74.93 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.06 -1.025 . . . . 0.0 110.081 179.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.641 ' CD2' HD22 ' A' ' 55' ' ' LEU . 15.0 m-85 -58.24 -40.03 80.67 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.094 -1.004 . . . . 0.0 110.131 179.697 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -59.18 -24.45 63.09 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.247 -0.908 . . . . 0.0 111.406 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.489 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.8 mp -77.96 -36.22 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.459 0 O-C-N 120.877 -1.14 . . . . 0.0 109.851 179.826 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.583 ' OE1' HD21 ' A' ' 55' ' ' LEU . 44.1 tt0 -80.73 -37.18 30.99 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.006 -1.058 . . . . 0.0 109.311 178.733 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.724 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -73.74 -31.84 63.55 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.134 -0.979 . . . . 0.0 110.164 179.023 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.401 ' CD ' ' HA ' ' A' ' 28' ' ' ILE . 6.0 ptm85 -71.3 -36.74 71.75 Favored 'General case' 0 N--CA 1.505 2.302 0 C-N-CA 118.738 -1.185 . . . . 0.0 109.724 179.257 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.42 -41.4 98.71 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.069 -1.052 . . . . 0.0 109.168 179.107 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.606 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -68.62 -43.13 77.04 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.221 -0.925 . . . . 0.0 109.05 179.053 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.84 -38.36 85.22 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.312 -0.868 . . . . 0.0 109.604 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -57.7 -34.49 69.5 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 121.125 -0.984 . . . . 0.0 110.467 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -55.8 -36.88 67.89 Favored 'General case' 0 N--CA 1.511 2.608 0 O-C-N 121.078 -1.014 . . . . 0.0 110.335 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -55.27 -39.29 69.64 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 121.059 -1.025 . . . . 0.0 110.369 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 60.1 p -115.24 39.74 2.85 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.209 -0.932 . . . . 0.0 110.2 179.824 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.1 p -168.38 106.74 0.48 Allowed 'General case' 0 N--CA 1.502 2.125 0 O-C-N 121.246 -0.909 . . . . 0.0 110.664 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.6 tptp 53.66 94.55 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.022 -1.049 . . . . 0.0 110.305 -179.604 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -130.69 65.62 1.54 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.193 -0.942 . . . . 0.0 110.407 -179.697 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -112.22 -55.05 2.56 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.063 -1.023 . . . . 0.0 110.106 179.69 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -122.84 159.43 28.16 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.212 -0.93 . . . . 0.0 110.164 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.2 ttpp 52.87 59.65 4.32 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 121.0 -1.063 . . . . 0.0 110.777 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 68.4 m -113.5 -54.81 2.58 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.192 -0.942 . . . . 0.0 110.392 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -55.54 -37.88 68.54 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.202 -0.936 . . . . 0.0 110.092 179.688 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -60.32 -39.73 88.07 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.269 -0.894 . . . . 0.0 109.998 179.72 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.4 tp60 -61.73 -40.9 96.73 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.157 -0.964 . . . . 0.0 109.819 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.477 HD23 HD12 ' A' ' 52' ' ' ILE . 16.9 mt -61.12 -37.86 84.31 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.243 -0.911 . . . . 0.0 110.146 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 49.3 m0 -58.8 -37.75 77.05 Favored 'General case' 0 N--CA 1.511 2.596 0 O-C-N 121.146 -0.971 . . . . 0.0 110.086 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -61.81 -31.02 71.22 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.038 -1.039 . . . . 0.0 109.83 178.614 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.724 HG23 ' CG ' ' A' ' 30' ' ' LEU . 79.3 mt -71.81 -59.25 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.272 0 O-C-N 121.078 -1.014 . . . . 0.0 109.047 179.238 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -60.86 -29.45 69.54 Favored 'General case' 0 N--CA 1.509 2.523 0 C-N-CA 118.626 -1.23 . . . . 0.0 109.948 178.882 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -70.15 -37.82 75.33 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 120.808 -1.182 . . . . 0.0 109.136 178.277 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.641 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.7 mt -54.35 -33.02 58.16 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.146 -0.971 . . . . 0.0 110.296 179.109 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.454 ' NE2' ' N ' ' A' ' 88' ' ' ASP . 5.5 t60 -55.67 -37.33 68.14 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 120.993 -1.067 . . . . 0.0 110.205 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.446 ' NE2' HD21 ' A' ' 91' ' ' LEU . 6.0 m170 -61.48 -49.81 75.28 Favored 'General case' 0 N--CA 1.507 2.412 0 C-N-CA 119.254 -0.978 . . . . 0.0 109.332 179.231 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -60.33 -38.51 83.97 Favored 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 119.346 -0.942 . . . . 0.0 109.074 178.626 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.449 ' CD ' ' CD2' ' A' ' 26' ' ' PHE . 9.3 mtp180 -64.42 -51.49 62.89 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.256 -0.902 . . . . 0.0 109.315 178.753 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.0 p -60.75 -37.5 82.02 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.198 -0.939 . . . . 0.0 109.61 179.486 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -64.78 -39.76 94.14 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.058 -1.026 . . . . 0.0 109.442 179.17 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.597 ' CE2' HG21 ' A' ' 22' ' ' THR . 26.6 t80 -61.58 -49.19 77.66 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.124 -0.985 . . . . 0.0 109.487 179.491 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.453 ' CG2' ' CD1' ' A' ' 78' ' ' TYR . 74.3 mt -73.34 -41.64 57.34 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.381 0 O-C-N 121.232 -0.918 . . . . 0.0 109.0 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.4 ' O ' ' HB2' ' A' ' 68' ' ' TYR . 66.3 t80 -62.64 -40.44 97.0 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.309 -0.869 . . . . 0.0 109.386 179.303 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 86.7 m -66.53 -40.83 89.32 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.997 -1.064 . . . . 0.0 110.477 -179.689 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.553 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.2 -32.76 26.37 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 120.922 -1.111 . . . . 0.0 112.643 -178.76 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.491 ' N ' HD12 ' A' ' 66' ' ' LEU . 35.3 t80 -86.28 -32.45 21.08 Favored 'General case' 0 N--CA 1.513 2.697 0 O-C-N 120.635 -1.291 . . . . 0.0 111.953 -178.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.4 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 10.3 m-85 -97.98 -18.19 18.76 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.632 -1.293 . . . . 0.0 112.674 -178.694 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.1 mttm -118.64 -58.92 1.92 Allowed 'General case' 0 N--CA 1.503 2.187 0 O-C-N 120.574 -1.329 . . . . 0.0 110.676 179.842 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.404 ' HB3' ' HA ' ' A' ' 66' ' ' LEU . 1.1 tpt180 -67.63 -29.25 68.51 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.204 -0.935 . . . . 0.0 110.984 -179.578 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.7 mttt 56.45 42.92 26.83 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 120.858 -1.151 . . . . 0.0 109.971 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.45 34.68 3.8 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.482 -0.761 . . . . 0.0 109.851 179.15 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.673 HG13 HD23 ' A' ' 77' ' ' LEU . 13.8 tt -152.52 162.6 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.197 -0.94 . . . . 0.0 109.753 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.0 m -108.36 144.81 35.41 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.106 -0.996 . . . . 0.0 110.434 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.4 tttp -45.9 -32.28 2.59 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.302 -0.874 . . . . 0.0 111.636 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.63 -49.67 75.65 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 120.861 -1.149 . . . . 0.0 109.312 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.673 HD23 HG13 ' A' ' 73' ' ' ILE . 37.0 tp -68.24 -44.54 75.45 Favored 'General case' 0 N--CA 1.506 2.348 0 C-N-CA 119.148 -1.021 . . . . 0.0 108.294 178.737 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.453 ' CD1' ' CG2' ' A' ' 63' ' ' ILE . 13.4 t80 -59.78 -37.51 79.28 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.369 -0.832 . . . . 0.0 109.471 179.091 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -71.33 -41.58 69.64 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 120.981 -1.074 . . . . 0.0 108.919 178.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.676 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 63.3 t90 -57.11 -39.59 75.38 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.172 -0.955 . . . . 0.0 109.512 179.095 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.49 HD23 ' CD2' ' A' ' 86' ' ' TYR . 3.7 mp -65.92 -50.85 62.96 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.222 -0.924 . . . . 0.0 109.183 179.127 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.9 mm -56.42 -34.62 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.658 0 O-C-N 121.121 -0.987 . . . . 0.0 110.02 179.509 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.7 mmtt -89.44 -5.8 57.06 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 120.947 -1.095 . . . . 0.0 112.526 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.436 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 45.9 mm-40 -114.99 24.16 11.95 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 120.447 -1.408 . . . . 0.0 112.05 -179.781 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.5 tttt 75.45 71.18 0.09 Allowed 'General case' 0 N--CA 1.512 2.657 0 O-C-N 121.159 -0.963 . . . . 0.0 111.724 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.586 ' HE2' HD13 ' A' ' 23' ' ' LEU . 27.2 m-85 -131.56 -62.48 0.87 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.468 -0.77 . . . . 0.0 109.255 179.29 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.443 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -136.49 175.92 9.17 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.49 -0.756 . . . . 0.0 109.528 179.438 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.454 ' N ' ' NE2' ' A' ' 56' ' ' HIS . 13.4 t0 -114.79 108.85 17.31 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.186 -0.946 . . . . 0.0 110.417 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 11.2 mtpp -59.02 -40.32 84.64 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.153 -0.967 . . . . 0.0 109.732 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.731 HD23 HD13 ' A' ' 106' ' ' LEU . 16.0 tp -60.08 -37.84 81.1 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.202 -0.936 . . . . 0.0 109.946 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.446 HD21 ' NE2' ' A' ' 57' ' ' HIS . 64.5 tp -68.82 -50.02 53.61 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.013 -1.054 . . . . 0.0 108.808 179.336 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 50.0 mt -57.85 -36.62 56.29 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.511 0 O-C-N 121.179 -0.951 . . . . 0.0 108.803 178.41 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.31 -39.7 89.47 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.178 -0.951 . . . . 0.0 109.244 178.537 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.453 ' HD2' ' CE2' ' A' ' 100' ' ' TYR . 7.0 mmtt -57.8 -46.1 85.13 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.088 -1.008 . . . . 0.0 109.395 179.313 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.1 m0 -58.24 -25.67 61.99 Favored 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 119.186 -1.006 . . . . 0.0 110.484 179.375 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.7 24.46 12.88 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 120.927 -1.108 . . . . 0.0 111.461 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.6 mmtt -92.52 -83.44 0.3 Allowed 'General case' 0 N--CA 1.505 2.284 0 O-C-N 120.694 -1.254 . . . . 0.0 109.897 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.439 HG23 ' O ' ' A' ' 98' ' ' THR . 5.9 t -177.52 128.88 0.15 Allowed 'General case' 0 N--CA 1.506 2.358 0 O-C-N 120.843 -1.161 . . . . 0.0 110.764 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.21 11.81 79.48 Favored Glycine 0 N--CA 1.492 2.376 0 C-N-CA 120.131 -1.033 . . . . 0.0 111.551 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.453 ' CE2' ' HD2' ' A' ' 94' ' ' LYS . 20.0 m-85 -100.5 46.88 0.94 Allowed 'General case' 0 N--CA 1.504 2.261 0 CA-C-N 119.746 1.773 . . . . 0.0 110.239 179.389 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -62.93 -39.96 96.19 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.163 -0.961 . . . . 0.0 109.539 179.586 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.421 ' HB2' ' OG ' ' A' ' 155' ' ' SER . 1.0 OUTLIER -111.94 100.45 8.9 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.215 -0.928 . . . . 0.0 109.684 179.358 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.925 HD13 HD13 ' A' ' 109' ' ' ILE . 9.6 tp -137.41 132.63 33.73 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.226 -0.921 . . . . 0.0 109.925 -179.385 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.442 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.0 p -109.5 -37.53 5.69 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.286 -0.883 . . . . 0.0 112.197 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.801 ' O ' HD11 ' A' ' 103' ' ' LEU . 7.4 m -140.57 -168.03 2.48 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 120.355 -1.466 . . . . 0.0 110.001 179.018 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.731 HD13 HD23 ' A' ' 90' ' ' LEU . 12.5 mt -97.41 -38.38 9.64 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.007 -1.058 . . . . 0.0 110.489 179.277 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 26.8 ttt85 -102.21 31.64 3.88 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 120.995 -1.066 . . . . 0.0 109.614 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.66 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.305 1.7 t -126.94 15.47 7.4 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.193 -0.942 . . . . 0.0 109.003 -179.279 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.925 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -158.59 36.87 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.361 0 O-C-N 120.799 -1.188 . . . . 0.0 110.844 -178.646 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.592 ' O ' HG23 ' A' ' 119' ' ' THR . 89.3 mt-30 -122.26 137.44 54.84 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 120.735 -1.228 . . . . 0.0 111.563 -178.673 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.536 ' HA ' ' HG1' ' A' ' 119' ' ' THR . 15.7 ptpt -130.24 154.81 47.2 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.166 -0.959 . . . . 0.0 110.392 179.494 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -158.59 -56.54 0.07 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.209 -0.932 . . . . 0.0 110.801 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -131.23 -165.47 1.57 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.231 -0.918 . . . . 0.0 110.159 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.58 53.48 1.99 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.133 -0.979 . . . . 0.0 110.233 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -115.41 -54.92 2.5 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.116 -0.99 . . . . 0.0 110.458 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 15.5 p-10 -125.79 -169.93 2.09 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.104 -0.998 . . . . 0.0 110.339 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -58.69 108.86 1.7 Allowed Glycine 0 N--CA 1.495 2.622 0 N-CA-C 109.915 -1.274 . . . . 0.0 109.915 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 4.0 m -115.38 -55.74 2.42 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.279 -1.13 . . . . 0.0 110.536 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.592 HG23 ' O ' ' A' ' 110' ' ' GLN . 0.7 OUTLIER -111.47 174.23 5.97 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.192 -0.942 . . . . 0.0 110.353 -179.92 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.401 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 44.4 t -105.02 155.26 19.13 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.409 -0.807 . . . . 0.0 109.575 179.394 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.802 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -70.47 -36.28 65.63 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 121.151 -0.968 . . . . 0.0 110.872 -179.374 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.455 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.9 p -54.83 -32.49 60.53 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 120.809 -1.182 . . . . 0.0 110.932 -179.153 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.465 ' HG3' HG22 ' A' ' 109' ' ' ILE . 0.0 OUTLIER -61.26 -34.87 75.87 Favored 'General case' 0 N--CA 1.509 2.525 0 O-C-N 120.986 -1.071 . . . . 0.0 109.415 178.047 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 48.4 t -79.84 126.0 81.0 Favored Pre-proline 0 N--CA 1.504 2.267 0 O-C-N 121.109 -0.994 . . . . 0.0 109.707 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.477 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.7 Cg_endo -65.65 172.3 8.3 Favored 'Trans proline' 0 N--CA 1.489 1.255 0 O-C-N 123.159 1.083 . . . . 0.0 110.795 179.676 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.1 -37.55 61.47 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.287 -0.883 . . . . 0.0 110.548 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.68 -41.0 80.71 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.071 -1.018 . . . . 0.0 110.044 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -69.48 -41.58 75.98 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.175 -0.953 . . . . 0.0 109.187 179.248 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.531 ' CD1' HD11 ' A' ' 121' ' ' ILE . 1.9 mt -65.86 -39.26 90.56 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.258 -0.901 . . . . 0.0 109.455 179.088 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -60.93 -39.69 90.42 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.199 -0.938 . . . . 0.0 109.829 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -59.62 -38.14 80.51 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.208 -0.933 . . . . 0.0 110.188 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -61.16 -44.61 97.04 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.209 -0.932 . . . . 0.0 109.929 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.27 -41.53 93.49 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.103 -0.998 . . . . 0.0 109.961 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.57 -35.37 72.26 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.187 -0.946 . . . . 0.0 110.322 179.652 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 21.3 mttm -71.74 -32.55 67.86 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.088 -1.007 . . . . 0.0 110.94 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 33.8 mttm -98.26 19.35 14.41 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.923 -1.111 . . . . 0.0 111.829 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 54.56 43.59 78.28 Favored Glycine 0 N--CA 1.498 2.825 0 O-C-N 120.591 -1.318 . . . . 0.0 110.502 179.372 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 7.3 t -142.88 -164.78 1.91 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.127 -1.219 . . . . 0.0 110.088 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.5 mp0 -138.25 149.57 45.87 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.193 -0.942 . . . . 0.0 110.407 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.429 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.5 p -131.86 161.49 41.19 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.165 -0.96 . . . . 0.0 109.949 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 29.1 t -165.79 88.88 0.41 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.164 -0.96 . . . . 0.0 111.167 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.766 ' CG ' HD12 ' A' ' 121' ' ' ILE . 47.1 t80 -97.58 159.9 14.65 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.317 -0.864 . . . . 0.0 110.239 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 68.8 m80 -137.11 -61.6 0.65 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.482 -0.761 . . . . 0.0 109.001 179.051 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -133.63 151.96 51.79 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.41 -0.806 . . . . 0.0 108.912 178.601 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 31.2 p -92.92 153.19 18.93 Favored 'General case' 0 N--CA 1.504 2.243 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.179 -179.462 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 27.0 m -71.64 -25.94 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 O-C-N 121.396 -0.815 . . . . 0.0 111.387 -179.603 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 63.2 m170 -50.65 -55.42 16.49 Favored 'General case' 0 N--CA 1.515 2.779 0 O-C-N 120.764 -1.21 . . . . 0.0 110.079 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 25.5 p -130.96 -165.64 1.59 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.276 -0.89 . . . . 0.0 110.566 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.77 56.61 0.76 Allowed Glycine 0 N--CA 1.493 2.457 0 N-CA-C 107.961 -2.056 . . . . 0.0 107.961 178.438 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 17.7 t -99.99 142.25 31.72 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.374 -1.074 . . . . 0.0 109.85 -179.225 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 5.2 mtt-85 -95.46 53.69 1.51 Allowed 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.301 -0.874 . . . . 0.0 109.593 179.27 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 64.5 96.68 0.02 OUTLIER Glycine 0 N--CA 1.487 2.087 0 N-CA-C 109.915 -1.274 . . . . 0.0 109.915 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 26.2 p -106.3 124.8 50.15 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.311 -1.111 . . . . 0.0 110.048 179.437 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -134.59 135.31 42.12 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.131 -0.981 . . . . 0.0 110.1 -179.397 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 155' ' ' SER . . . . . 0.561 ' O ' HG23 ' A' ' 156' ' ' THR . 0.7 OUTLIER -104.31 41.43 1.31 Allowed 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.231 -0.918 . . . . 0.0 109.855 179.647 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 156' ' ' THR . . . . . 0.561 HG23 ' O ' ' A' ' 155' ' ' SER . 0.8 OUTLIER -156.26 -56.73 0.09 Allowed 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.331 -0.855 . . . . 0.0 110.656 -179.868 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 . . . . . 0 N--CA 1.494 1.732 0 CA-C-O 118.033 -0.984 . . . . 0.0 110.254 179.865 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.333 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 95.1 -131.57 10.75 Favored Glycine 0 N--CA 1.493 2.46 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 -179.996 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.23 90.27 50.96 Favored Pre-proline 0 N--CA 1.493 1.721 0 O-C-N 121.292 -1.122 . . . . 0.0 110.214 -179.981 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.98 123.31 8.8 Favored 'Trans proline' 0 C--N 1.317 -1.109 0 O-C-N 123.493 1.26 . . . . 0.0 110.432 -179.92 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 18.9 mtm180 -120.18 109.72 15.76 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.183 -0.948 . . . . 0.0 110.205 -179.985 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 82.0 mt -127.67 134.61 65.13 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 O-C-N 121.192 -0.942 . . . . 0.0 109.945 -179.901 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 30.7 tptt -143.6 50.2 1.38 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.284 -0.885 . . . . 0.0 110.27 179.983 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -129.09 111.43 12.95 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.221 -0.924 . . . . 0.0 110.232 -179.973 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -122.47 103.9 9.02 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.172 -0.955 . . . . 0.0 110.169 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 48.2 mtm180 -127.62 84.36 2.25 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.16 -0.963 . . . . 0.0 110.225 -179.967 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.8 t -143.2 46.04 1.54 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.191 -0.943 . . . . 0.0 110.325 179.888 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.7 mmtt -127.49 93.07 41.57 Favored Pre-proline 0 N--CA 1.494 1.742 0 O-C-N 121.201 -0.937 . . . . 0.0 110.218 -179.973 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -73.85 158.59 46.34 Favored 'Trans proline' 0 C--N 1.317 -1.09 0 O-C-N 123.399 1.21 . . . . 0.0 110.668 179.948 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.691 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -94.19 146.63 31.94 Favored Pre-proline 0 N--CA 1.502 2.147 0 O-C-N 121.404 -0.81 . . . . 0.0 109.738 179.542 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.31 162.01 43.84 Favored 'Trans proline' 0 C--N 1.317 -1.109 0 O-C-N 123.335 1.176 . . . . 0.0 110.833 -179.421 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -48.79 -31.92 7.82 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.476 -0.765 . . . . 0.0 111.358 -179.828 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.5 -34.95 43.5 Favored Glycine 0 N--CA 1.498 2.825 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 179.776 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -55.95 -33.45 64.76 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 121.057 -1.261 . . . . 0.0 110.656 179.814 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -53.9 -37.94 64.29 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.085 -1.01 . . . . 0.0 110.149 179.693 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 44.1 mmtt -59.55 -37.38 78.26 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.268 -0.895 . . . . 0.0 110.045 179.504 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.738 HG22 ' OH ' ' A' ' 62' ' ' TYR . 2.1 pt -116.37 35.29 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.182 -0.949 . . . . 0.0 110.552 179.814 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.423 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 4.5 tttt -84.38 -42.89 0.73 Allowed Pre-proline 0 N--CA 1.509 2.491 0 O-C-N 121.136 -0.977 . . . . 0.0 113.334 -179.163 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.0 Cg_endo -75.44 -35.17 2.99 Favored 'Trans proline' 0 N--CA 1.486 1.073 0 O-C-N 122.467 0.72 . . . . 0.0 111.805 -178.138 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.547 HG21 ' CE2' ' A' ' 62' ' ' TYR . 85.4 m -61.62 -46.79 88.32 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 120.932 -1.105 . . . . 0.0 109.896 -179.875 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.714 HD13 ' HE2' ' A' ' 86' ' ' TYR . 6.1 mt -62.58 -39.61 94.24 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 119.4 -0.92 . . . . 0.0 109.605 179.446 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.7 m -57.62 -35.69 70.81 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 121.123 -0.985 . . . . 0.0 110.256 179.524 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -57.6 -36.42 71.72 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 121.089 -1.007 . . . . 0.0 110.287 179.756 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.717 ' CD2' HD22 ' A' ' 55' ' ' LEU . 16.7 m-85 -57.42 -39.98 77.34 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.062 -1.024 . . . . 0.0 110.323 179.994 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -60.38 -23.28 64.19 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.224 -0.922 . . . . 0.0 111.514 -179.668 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.538 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.8 mp -81.18 -34.2 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.347 0 O-C-N 120.776 -1.202 . . . . 0.0 109.738 179.655 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.6 tp60 -80.96 -36.32 31.02 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.948 -1.095 . . . . 0.0 109.453 178.752 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.726 ' CD2' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -75.12 -31.83 61.23 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.131 -0.981 . . . . 0.0 109.96 178.913 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -70.17 -36.15 74.48 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 120.865 -1.147 . . . . 0.0 109.745 179.196 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.33 -41.85 93.54 Favored 'General case' 0 N--CA 1.507 2.387 0 C-N-CA 119.145 -1.022 . . . . 0.0 109.329 179.407 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.59 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -69.06 -42.16 76.63 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.301 -0.874 . . . . 0.0 109.53 179.323 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -68.67 -30.89 69.67 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.344 -0.847 . . . . 0.0 110.435 179.575 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.1 mtpt -92.07 -31.46 15.54 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 120.99 -1.068 . . . . 0.0 111.088 -179.971 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -55.53 -37.07 67.46 Favored 'General case' 0 N--CA 1.513 2.692 0 O-C-N 120.838 -1.164 . . . . 0.0 110.309 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.5 ttpt -65.34 -38.38 89.93 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.102 -0.999 . . . . 0.0 110.175 179.938 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.1 t -115.36 52.75 0.86 Allowed 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.075 -1.015 . . . . 0.0 110.418 -179.934 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.5 t -157.45 -56.77 0.08 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.147 -0.97 . . . . 0.0 110.739 179.973 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 31.5 mttp -96.15 -34.37 11.71 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.283 -0.886 . . . . 0.0 110.755 179.967 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 55.83 82.71 0.1 Allowed 'General case' 0 N--CA 1.502 2.131 0 O-C-N 120.82 -1.175 . . . . 0.0 110.419 -179.819 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -137.96 -162.63 1.33 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.274 -0.891 . . . . 0.0 109.94 -179.954 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -85.13 179.29 7.28 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.056 -1.028 . . . . 0.0 109.891 179.614 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 64.3 mttt 53.16 60.5 3.72 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.005 -1.059 . . . . 0.0 110.571 -179.767 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.85 -42.9 6.61 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.069 -1.019 . . . . 0.0 110.693 -179.907 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -58.0 -39.32 77.98 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 121.077 -1.014 . . . . 0.0 110.115 -179.935 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -59.68 -40.02 86.47 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.158 -0.964 . . . . 0.0 110.128 179.943 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 51.3 tp60 -59.5 -39.56 84.2 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.063 -1.023 . . . . 0.0 110.186 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 49' ' ' LEU . 12.5 mt -59.62 -39.66 85.01 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.137 -0.977 . . . . 0.0 110.181 -179.923 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.498 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.3 m0 -59.14 -37.19 76.68 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.186 -0.947 . . . . 0.0 110.164 179.827 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -59.94 -30.95 69.42 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.015 -1.053 . . . . 0.0 110.139 179.119 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.726 HG23 ' CD2' ' A' ' 30' ' ' LEU . 77.6 mt -71.28 -58.4 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.286 0 O-C-N 120.989 -1.069 . . . . 0.0 109.102 179.355 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.1 ptm -62.84 -29.94 71.12 Favored 'General case' 0 N--CA 1.507 2.408 0 C-N-CA 118.646 -1.221 . . . . 0.0 109.883 178.851 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.6 mm100 -69.43 -36.82 77.05 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.867 -1.146 . . . . 0.0 109.157 178.117 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.717 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.4 mt -53.24 -32.16 46.93 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.018 -1.052 . . . . 0.0 110.196 179.032 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.459 ' NE2' ' CB ' ' A' ' 88' ' ' ASP . 41.2 t60 -54.6 -39.76 68.18 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.09 -1.006 . . . . 0.0 110.07 179.859 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.428 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 4.9 m170 -62.41 -49.15 76.63 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.668 179.213 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -59.22 -36.23 75.05 Favored 'General case' 0 N--CA 1.508 2.438 0 C-N-CA 119.355 -0.938 . . . . 0.0 109.523 179.154 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.453 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -68.71 -52.09 34.58 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.085 -1.009 . . . . 0.0 108.761 178.769 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 91.7 p -61.21 -38.57 87.05 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.268 -0.895 . . . . 0.0 109.263 178.862 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 57.6 ttp85 -64.05 -38.49 91.26 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.094 -1.004 . . . . 0.0 109.456 179.028 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.738 ' OH ' HG22 ' A' ' 19' ' ' ILE . 48.1 t80 -60.31 -47.2 87.03 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.083 -1.011 . . . . 0.0 109.617 179.565 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.606 HD12 ' HB2' ' A' ' 87' ' ' ALA . 82.8 mt -77.77 -42.47 28.93 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.365 0 O-C-N 121.242 -0.911 . . . . 0.0 109.098 179.16 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.506 ' CE1' HG23 ' A' ' 92' ' ' ILE . 18.7 t80 -61.35 -23.37 65.7 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.354 -0.841 . . . . 0.0 110.659 179.01 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 97.2 m -91.02 -38.78 12.59 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.643 -1.286 . . . . 0.0 110.198 179.831 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.517 ' C ' HD12 ' A' ' 66' ' ' LEU . 3.5 pp -83.04 -30.28 28.19 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.893 -1.13 . . . . 0.0 111.924 -179.429 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.464 ' HD2' HG23 ' A' ' 73' ' ' ILE . 39.9 t80 -86.25 -35.96 19.68 Favored 'General case' 0 N--CA 1.511 2.591 0 O-C-N 120.573 -1.329 . . . . 0.0 111.467 -179.81 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.419 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 15.1 m-85 -94.08 -29.88 14.96 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.828 -1.17 . . . . 0.0 112.422 -178.158 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.8 mtpp -105.52 -59.46 1.76 Allowed 'General case' 0 N--CA 1.504 2.268 0 O-C-N 120.684 -1.26 . . . . 0.0 110.42 -179.81 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.407 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 29.9 ttt85 -57.13 -33.27 67.21 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 121.109 -0.994 . . . . 0.0 110.366 -179.996 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.6 mttt 57.47 45.84 18.99 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.887 -1.133 . . . . 0.0 110.328 179.965 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -111.11 -57.17 2.28 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.372 -0.83 . . . . 0.0 109.38 179.289 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.786 HG13 HD23 ' A' ' 77' ' ' LEU . 15.1 tt -56.17 162.21 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.574 0 O-C-N 121.443 -0.786 . . . . 0.0 110.121 179.533 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.8 t -111.62 149.76 31.06 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.07 -1.019 . . . . 0.0 109.921 179.106 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.39 -32.71 1.42 Allowed 'General case' 0 N--CA 1.517 2.902 0 O-C-N 121.282 -0.886 . . . . 0.0 111.984 -179.709 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -61.68 -50.94 70.48 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 120.941 -1.099 . . . . 0.0 109.36 179.635 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.786 HD23 HG13 ' A' ' 73' ' ' ILE . 52.1 tp -67.96 -42.88 80.22 Favored 'General case' 0 N--CA 1.506 2.345 0 C-N-CA 119.139 -1.024 . . . . 0.0 108.466 178.727 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.709 ' HA ' HD12 ' A' ' 81' ' ' LEU . 21.8 t80 -60.1 -38.54 83.28 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.324 -0.86 . . . . 0.0 109.479 178.869 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -70.58 -42.67 70.74 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.067 -1.021 . . . . 0.0 108.73 178.745 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.691 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 72.0 t90 -59.03 -38.41 79.24 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.262 -0.899 . . . . 0.0 109.545 178.926 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.709 HD12 ' HA ' ' A' ' 78' ' ' TYR . 11.8 mt -64.86 -51.27 62.95 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.167 -0.958 . . . . 0.0 109.519 179.365 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.4 mm -57.75 -33.13 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.592 0 O-C-N 121.169 -0.957 . . . . 0.0 110.102 179.645 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -89.23 -9.03 52.27 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 120.898 -1.126 . . . . 0.0 112.437 -179.862 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.438 ' HB2' ' CE1' ' A' ' 86' ' ' TYR . 4.3 mm-40 -111.16 22.11 15.6 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 120.449 -1.407 . . . . 0.0 111.974 -179.984 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.4 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 0.0 OUTLIER 74.94 73.58 0.1 Allowed 'General case' 0 N--CA 1.51 2.562 0 O-C-N 121.031 -1.043 . . . . 0.0 111.66 179.451 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.714 ' HE2' HD13 ' A' ' 23' ' ' LEU . 32.6 m-85 -134.2 -62.8 0.74 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.557 -0.715 . . . . 0.0 109.215 179.456 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.606 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -131.16 163.04 28.59 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.478 -0.764 . . . . 0.0 109.248 179.313 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.459 ' CB ' ' NE2' ' A' ' 56' ' ' HIS . 30.7 t0 -111.27 118.27 35.43 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.084 -1.01 . . . . 0.0 110.314 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -57.67 -35.76 71.02 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 121.34 -0.85 . . . . 0.0 110.194 179.72 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.423 HD12 ' HA ' ' A' ' 90' ' ' LEU . 7.9 tp -60.68 -38.51 85.19 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.121 -0.987 . . . . 0.0 109.684 179.481 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.691 HD12 ' CZ3' ' A' ' 95' ' ' TRP . 0.3 OUTLIER -66.56 -56.71 9.5 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.085 -1.009 . . . . 0.0 108.829 179.078 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.506 HG23 ' CE1' ' A' ' 64' ' ' TYR . 38.8 mt -61.0 -33.74 57.03 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.416 0 C-N-CA 119.339 -0.944 . . . . 0.0 109.165 178.851 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.24 -41.1 86.2 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 120.985 -1.072 . . . . 0.0 109.239 178.854 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.474 ' HB3' HD22 ' A' ' 103' ' ' LEU . 10.0 mmtm -57.62 -44.25 85.38 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.177 -0.952 . . . . 0.0 109.49 179.387 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.691 ' CZ3' HD12 ' A' ' 91' ' ' LEU . 2.3 m0 -59.05 -26.37 64.54 Favored 'General case' 0 N--CA 1.508 2.44 0 C-N-CA 119.148 -1.021 . . . . 0.0 110.786 179.165 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.18 -35.51 25.43 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 120.736 -1.227 . . . . 0.0 110.671 179.587 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -51.1 175.79 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.803 0 O-C-N 121.025 -1.047 . . . . 0.0 110.831 179.89 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 60.8 m -103.79 138.83 39.85 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.168 -0.957 . . . . 0.0 109.487 179.219 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 103.47 -29.15 12.87 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.84 -1.304 . . . . 0.0 109.84 -178.881 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -94.43 58.16 2.37 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.867 -1.372 . . . . 0.0 109.898 179.658 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -73.0 -38.76 66.49 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.026 -1.046 . . . . 0.0 109.864 179.717 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.01 73.86 1.05 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.157 -0.964 . . . . 0.0 110.143 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.474 HD22 ' HB3' ' A' ' 94' ' ' LYS . 1.1 pp -110.1 148.77 31.1 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.068 -1.02 . . . . 0.0 110.149 179.941 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.428 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.7 p -110.21 -30.08 7.89 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.238 -0.914 . . . . 0.0 112.997 -179.727 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.625 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.3 m -143.56 -168.13 2.75 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 120.256 -1.527 . . . . 0.0 109.884 179.159 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.425 HD23 ' HA ' ' A' ' 106' ' ' LEU . 44.4 mt -96.73 -38.14 10.02 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.088 -1.007 . . . . 0.0 110.066 178.986 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 18.0 ttp180 -102.45 30.56 4.53 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 120.972 -1.08 . . . . 0.0 109.826 178.051 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.625 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.304 1.8 t -128.65 18.43 6.27 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.11 -0.994 . . . . 0.0 108.97 -179.575 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.469 HG23 ' C ' ' A' ' 108' ' ' CYS . 1.7 pt -156.39 36.81 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.158 0 O-C-N 120.78 -1.2 . . . . 0.0 110.493 -178.631 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.503 ' C ' HG23 ' A' ' 119' ' ' THR . 9.5 tt0 -66.09 77.87 0.09 Allowed 'General case' 0 N--CA 1.51 2.554 0 O-C-N 120.995 -1.066 . . . . 0.0 110.788 -178.854 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -148.89 168.77 22.14 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.053 -1.029 . . . . 0.0 110.366 179.473 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -171.5 -61.03 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.181 -0.95 . . . . 0.0 110.804 179.922 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -168.1 44.33 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.223 -0.923 . . . . 0.0 110.968 -179.945 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 14.3 p -140.54 -175.15 4.17 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.27 -0.894 . . . . 0.0 110.227 -179.939 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 31.8 t-20 -128.73 92.36 3.4 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.195 -0.941 . . . . 0.0 110.25 179.997 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -137.79 -173.65 3.56 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.231 -0.918 . . . . 0.0 110.275 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -120.97 48.48 0.95 Allowed Glycine 0 N--CA 1.493 2.465 0 N-CA-C 109.633 -1.387 . . . . 0.0 109.633 -179.923 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 71.3 m -129.35 46.46 2.63 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.108 -1.231 . . . . 0.0 110.134 179.985 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.503 HG23 ' C ' ' A' ' 110' ' ' GLN . 7.1 m -139.88 165.52 27.09 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.233 -0.917 . . . . 0.0 109.996 -179.859 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 41.5 t -82.21 153.93 25.7 Favored 'General case' 0 N--CA 1.501 2.109 0 C-N-CA 119.321 -0.952 . . . . 0.0 108.802 178.766 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.71 HG23 ' CE1' ' A' ' 142' ' ' PHE . 14.1 tt -81.11 -29.33 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 O-C-N 121.047 -1.033 . . . . 0.0 112.448 -178.787 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.489 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 14.4 p -53.97 -35.14 61.47 Favored 'General case' 0 N--CA 1.512 2.647 0 O-C-N 120.707 -1.246 . . . . 0.0 110.658 -178.736 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -58.54 -26.85 63.98 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.118 -0.988 . . . . 0.0 109.836 177.707 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 48.9 t -73.89 118.24 67.74 Favored Pre-proline 0 N--CA 1.509 2.48 0 O-C-N 120.866 -1.146 . . . . 0.0 110.584 179.975 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.473 ' HB3' ' HB1' ' A' ' 154' ' ' ALA . 37.4 Cg_endo -64.79 168.11 14.15 Favored 'Trans proline' 0 N--CA 1.489 1.224 0 O-C-N 123.026 1.013 . . . . 0.0 110.553 178.611 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.18 -38.81 60.67 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.203 -0.935 . . . . 0.0 110.189 179.971 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.28 -40.65 82.48 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.034 -1.041 . . . . 0.0 110.053 -179.811 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 -67.08 -41.1 86.96 Favored 'General case' 0 N--CA 1.507 2.42 0 C-N-CA 119.359 -0.936 . . . . 0.0 109.399 179.46 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.478 ' O ' HG11 ' A' ' 140' ' ' VAL . 5.4 mt -64.27 -40.66 96.43 Favored 'General case' 0 N--CA 1.507 2.389 0 C-N-CA 119.446 -0.902 . . . . 0.0 109.552 179.318 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.68 -39.91 86.1 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.16 -0.962 . . . . 0.0 109.936 179.78 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -60.93 -40.02 91.67 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.148 -0.97 . . . . 0.0 109.964 179.781 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -62.19 -41.92 98.8 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.201 -0.937 . . . . 0.0 109.872 179.797 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.558 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -61.37 -41.6 97.34 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.215 -0.928 . . . . 0.0 109.886 179.955 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 6.9 mmt85 -59.65 -38.55 81.72 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.143 -0.973 . . . . 0.0 109.991 179.658 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 13.9 mttp -61.63 -35.68 78.61 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.18 -0.95 . . . . 0.0 110.567 -179.902 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -105.45 21.68 16.77 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.007 -1.058 . . . . 0.0 111.836 -179.913 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.39 46.06 58.14 Favored Glycine 0 N--CA 1.498 2.812 0 O-C-N 120.641 -1.287 . . . . 0.0 110.773 179.315 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.558 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 9.5 t -138.74 -165.31 1.8 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.113 -1.228 . . . . 0.0 110.189 179.747 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.4 mp0 -133.34 167.72 19.88 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.188 -0.945 . . . . 0.0 110.471 -179.896 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.478 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.6 p -159.82 161.14 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.041 0 O-C-N 121.336 -0.853 . . . . 0.0 110.646 -179.981 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 38.8 t -169.05 113.92 0.57 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.18 -0.95 . . . . 0.0 111.256 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.71 ' CE1' HG23 ' A' ' 121' ' ' ILE . 85.1 t80 -102.97 158.79 16.04 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.234 -0.916 . . . . 0.0 110.156 179.586 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 15.2 m80 -137.17 -61.54 0.65 Allowed 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.822 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -148.01 149.33 31.93 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.576 -0.702 . . . . 0.0 109.247 178.81 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 145' ' ' CYS . . . . . 0.462 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 26.3 p -93.67 155.24 17.37 Favored 'General case' 0 N--CA 1.505 2.275 0 C-N-CA 119.038 -1.065 . . . . 0.0 110.813 -179.485 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.9 p -71.86 -25.15 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.493 0 O-C-N 121.287 -0.883 . . . . 0.0 111.77 -179.252 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -50.25 -59.78 3.62 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 120.832 -1.168 . . . . 0.0 110.171 -179.898 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.498 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.8 p -126.95 -165.11 1.42 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.213 -0.929 . . . . 0.0 110.491 179.424 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 149' ' ' GLY . . . . . 0.441 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.51 60.99 0.65 Allowed Glycine 0 N--CA 1.492 2.38 0 N-CA-C 107.945 -2.062 . . . . 0.0 107.945 178.3 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 16.9 t -99.15 138.69 35.9 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.353 -1.087 . . . . 0.0 109.64 -179.182 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.63 49.45 1.03 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.23 -0.919 . . . . 0.0 109.882 179.398 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 75.16 93.58 0.16 Allowed Glycine 0 N--CA 1.488 2.156 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 179.757 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.4 p -104.83 127.25 52.58 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.237 -1.154 . . . . 0.0 109.665 179.107 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 154' ' ' ALA . . . . . 0.473 ' HB1' ' HB3' ' A' ' 125' ' ' PRO . . . -153.98 149.51 27.31 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.052 -1.03 . . . . 0.0 110.554 -179.057 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -96.5 -39.12 9.71 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.269 -0.895 . . . . 0.0 110.422 179.949 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 6.8 m -56.8 -38.82 73.07 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.024 -1.047 . . . . 0.0 110.383 179.994 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 . . . . . 0 N--CA 1.493 1.69 0 CA-C-O 117.961 -1.018 . . . . 0.0 110.21 179.955 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.306 0 N-CA-C 109.564 -1.415 . . . . 0.0 109.564 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 70.83 42.04 61.68 Favored Glycine 0 N--CA 1.492 2.43 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 -179.972 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.7 t -142.27 70.89 22.35 Favored Pre-proline 0 N--CA 1.494 1.741 0 O-C-N 121.182 -1.187 . . . . 0.0 110.21 -179.97 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -73.05 132.5 18.27 Favored 'Trans proline' 0 C--N 1.317 -1.093 0 O-C-N 123.356 1.187 . . . . 0.0 110.466 -179.95 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -119.68 95.36 4.74 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.204 -0.935 . . . . 0.0 110.157 -179.982 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 38.9 pt -138.13 151.9 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.224 -0.922 . . . . 0.0 110.268 -179.934 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.6 mtmm -143.53 -174.03 4.12 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.273 -0.892 . . . . 0.0 110.268 179.993 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.1 p -116.95 170.81 8.34 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.253 -0.904 . . . . 0.0 110.187 -179.99 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 62.8 mtt-85 -142.87 85.74 1.9 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.203 -0.936 . . . . 0.0 110.292 -179.952 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.84 148.93 41.31 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.194 -0.941 . . . . 0.0 110.21 179.94 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.6 m 52.41 77.03 0.16 Allowed 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.077 -1.014 . . . . 0.0 110.816 -179.985 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.1 tptp -132.12 96.57 19.6 Favored Pre-proline 0 N--CA 1.494 1.748 0 O-C-N 121.198 -0.939 . . . . 0.0 110.224 -179.95 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.474 ' O ' ' HB3' ' A' ' 12' ' ' ALA . 46.8 Cg_endo -72.8 157.46 51.79 Favored 'Trans proline' 0 C--N 1.317 -1.115 0 O-C-N 123.408 1.215 . . . . 0.0 110.678 179.992 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.737 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . 62.2 144.32 0.07 OUTLIER Pre-proline 0 N--CA 1.503 2.212 0 O-C-N 121.367 -0.833 . . . . 0.0 110.62 179.911 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -74.02 161.11 41.79 Favored 'Trans proline' 0 N--CA 1.485 1.0 0 O-C-N 123.192 1.101 . . . . 0.0 110.611 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -49.15 -31.81 8.97 Favored 'General case' 0 N--CA 1.515 2.815 0 O-C-N 121.431 -0.793 . . . . 0.0 111.318 -179.82 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.2 -33.37 45.42 Favored Glycine 0 N--CA 1.499 2.851 0 O-C-N 121.031 -1.043 . . . . 0.0 110.635 179.855 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -54.18 -32.01 54.32 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 120.962 -1.317 . . . . 0.0 110.766 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -54.93 -37.34 66.29 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 121.037 -1.04 . . . . 0.0 110.242 179.868 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.8 mtpp -57.68 -35.39 70.52 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.152 -0.968 . . . . 0.0 110.359 179.588 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.726 HD12 HD11 ' A' ' 23' ' ' LEU . 3.1 pt -116.26 36.73 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.15 -0.969 . . . . 0.0 110.428 179.592 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.441 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -82.53 -43.03 0.95 Allowed Pre-proline 0 N--CA 1.508 2.459 0 O-C-N 121.078 -1.014 . . . . 0.0 113.003 -179.436 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.441 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.2 Cg_endo -76.14 -34.73 2.74 Favored 'Trans proline' 0 N--CA 1.486 1.07 0 O-C-N 122.571 0.774 . . . . 0.0 111.875 -178.366 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.959 HG21 ' CE2' ' A' ' 62' ' ' TYR . 91.4 m -61.3 -47.99 83.41 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.885 -1.135 . . . . 0.0 109.833 -179.762 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.726 HD11 HD12 ' A' ' 19' ' ' ILE . 7.8 mt -62.07 -40.21 95.03 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.465 179.555 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.426 ' O ' HD12 ' A' ' 28' ' ' ILE . 7.7 m -57.56 -35.41 70.31 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.155 -0.966 . . . . 0.0 110.187 179.229 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -56.72 -37.9 71.62 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.041 -1.037 . . . . 0.0 110.128 179.691 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.59 ' CD2' HD22 ' A' ' 55' ' ' LEU . 14.1 m-85 -58.69 -39.05 79.64 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.101 -1.0 . . . . 0.0 110.284 179.965 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -59.81 -40.14 87.38 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.17 -0.956 . . . . 0.0 110.362 -179.512 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.429 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.2 mp -65.65 -42.07 91.94 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.376 0 C-N-CA 119.12 -1.032 . . . . 0.0 108.668 179.48 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.7 tp60 -68.03 -50.99 51.99 Favored 'General case' 0 N--CA 1.506 2.337 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 178.494 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.11 HD11 HG23 ' A' ' 52' ' ' ILE . 5.6 tp -59.09 -36.28 74.84 Favored 'General case' 0 N--CA 1.509 2.516 0 C-N-CA 119.546 -0.861 . . . . 0.0 109.471 178.403 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.6 mtt85 -57.93 -37.79 74.73 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.124 -0.985 . . . . 0.0 110.333 179.675 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -62.74 -50.42 71.14 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.094 -1.003 . . . . 0.0 109.748 -179.636 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.544 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -71.46 -40.0 70.58 Favored 'General case' 0 N--CA 1.503 2.188 0 C-N-CA 118.829 -1.149 . . . . 0.0 108.827 178.796 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -62.1 -32.7 73.28 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.21 -0.931 . . . . 0.0 110.246 179.207 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.3 mtpt -96.42 -35.85 11.02 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 120.934 -1.104 . . . . 0.0 111.065 -179.818 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -56.43 -36.85 69.47 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 120.955 -1.09 . . . . 0.0 110.359 179.975 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.5 ttmt -55.75 -42.7 75.82 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 121.134 -0.979 . . . . 0.0 110.306 -179.928 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.2 m 52.15 54.22 11.15 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.033 -1.042 . . . . 0.0 110.768 -179.975 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.3 t 53.26 -164.55 0.09 Allowed 'General case' 0 N--CA 1.501 2.108 0 O-C-N 120.986 -1.071 . . . . 0.0 110.552 -179.971 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.5 mmtt -78.13 69.47 4.35 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.094 -1.004 . . . . 0.0 109.754 179.703 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.4 tp -146.04 42.12 1.2 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.297 -0.877 . . . . 0.0 110.366 -179.77 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -167.54 -179.55 4.43 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.124 -0.985 . . . . 0.0 111.062 -179.871 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -117.01 175.84 5.4 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.231 -0.918 . . . . 0.0 110.096 179.866 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 21.1 mttt 52.67 57.88 5.94 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.04 -1.037 . . . . 0.0 110.566 -179.951 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 5.6 m -95.31 -38.14 10.66 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.217 -0.927 . . . . 0.0 110.578 179.957 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.417 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 34.7 m120 -60.28 -45.03 94.75 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.126 -0.984 . . . . 0.0 109.828 179.937 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -60.16 -44.89 94.65 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.144 -0.973 . . . . 0.0 109.708 179.867 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.56 -43.78 92.85 Favored 'General case' 0 N--CA 1.506 2.375 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.272 179.29 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 20.6 mt -61.46 -35.65 78.21 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.332 -0.855 . . . . 0.0 110.185 179.818 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.51 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 49.4 m0 -58.7 -39.28 80.31 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 120.962 -1.086 . . . . 0.0 109.742 179.762 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -62.16 -31.25 71.72 Favored 'General case' 0 N--CA 1.504 2.257 0 C-N-CA 119.144 -1.022 . . . . 0.0 109.715 178.409 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 1.11 HG23 HD11 ' A' ' 30' ' ' LEU . 17.8 mt -71.81 -58.19 5.68 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.145 0 O-C-N 120.93 -1.106 . . . . 0.0 109.157 179.298 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.0 ptm -61.48 -29.58 70.06 Favored 'General case' 0 N--CA 1.508 2.458 0 C-N-CA 118.57 -1.252 . . . . 0.0 109.787 178.81 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -69.11 -38.17 78.78 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 120.793 -1.192 . . . . 0.0 109.009 178.078 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.59 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.1 mt -53.34 -32.05 47.33 Favored 'General case' 0 N--CA 1.513 2.681 0 O-C-N 120.951 -1.093 . . . . 0.0 110.163 178.963 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.467 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 67.6 t60 -56.19 -38.9 71.6 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.061 -1.025 . . . . 0.0 110.24 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.405 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 7.4 m170 -60.13 -47.99 83.61 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.103 -0.998 . . . . 0.0 109.449 179.361 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -60.38 -35.88 76.77 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.262 -0.899 . . . . 0.0 109.651 178.974 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.441 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -64.97 -49.11 71.61 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.045 -1.034 . . . . 0.0 109.615 179.385 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.7 p -62.77 -38.56 91.09 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.139 -0.976 . . . . 0.0 109.409 179.329 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 19.5 ttt85 -63.13 -40.31 97.22 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.064 -1.022 . . . . 0.0 109.342 179.281 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.959 ' CE2' HG21 ' A' ' 22' ' ' THR . 43.0 t80 -62.35 -50.87 69.86 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.181 -0.949 . . . . 0.0 109.379 179.506 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.748 HD12 ' HB2' ' A' ' 87' ' ' ALA . 86.9 mt -69.5 -39.53 78.67 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.345 0 C-N-CA 119.271 -0.972 . . . . 0.0 109.126 179.351 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 9.5 t80 -64.48 -42.39 95.92 Favored 'General case' 0 N--CA 1.503 2.216 0 C-N-CA 119.409 -0.917 . . . . 0.0 109.055 179.022 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.417 ' HA ' ' CD ' ' A' ' 69' ' ' LYS . 87.4 m -60.89 -42.01 97.14 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.055 -1.028 . . . . 0.0 110.5 -179.575 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.581 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.29 -33.16 26.03 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 118.923 -1.111 . . . . 0.0 112.759 -178.766 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.498 ' N ' HD12 ' A' ' 66' ' ' LEU . 51.0 t80 -86.32 -32.43 21.04 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 120.599 -1.313 . . . . 0.0 111.734 -179.363 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -98.38 -16.75 19.17 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 120.827 -1.171 . . . . 0.0 112.713 -178.872 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.417 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 4.8 mttt -124.15 -59.31 1.5 Allowed 'General case' 0 N--CA 1.501 2.114 0 O-C-N 120.46 -1.4 . . . . 0.0 111.008 179.79 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.413 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 4.8 tpt180 -61.87 -30.21 70.71 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.147 -0.971 . . . . 0.0 110.825 -179.649 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.2 tttp 57.87 42.05 23.75 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 120.754 -1.216 . . . . 0.0 110.093 -179.592 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.38 35.72 3.88 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.369 -0.832 . . . . 0.0 109.952 179.303 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.825 HG13 HD23 ' A' ' 77' ' ' LEU . 14.0 tt -154.64 162.37 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 O-C-N 121.214 -0.929 . . . . 0.0 109.905 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.8 m -110.02 147.82 32.83 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.172 -0.955 . . . . 0.0 110.18 179.791 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.9 ttmt -45.42 -32.27 2.06 Favored 'General case' 0 N--CA 1.516 2.835 0 O-C-N 121.401 -0.812 . . . . 0.0 111.656 -179.971 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -62.25 -50.99 69.54 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 120.938 -1.101 . . . . 0.0 109.3 179.559 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.825 HD23 HG13 ' A' ' 73' ' ' ILE . 50.1 tp -65.63 -46.03 80.82 Favored 'General case' 0 N--CA 1.505 2.306 0 C-N-CA 119.106 -1.038 . . . . 0.0 108.481 178.959 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.434 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 18.8 t80 -59.8 -38.98 83.47 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.276 -0.89 . . . . 0.0 109.545 179.224 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -72.73 -42.14 64.41 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.112 -0.993 . . . . 0.0 108.971 178.933 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.737 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 83.0 t90 -57.48 -37.27 72.64 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.218 -0.927 . . . . 0.0 109.717 179.091 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.777 HD22 ' CD2' ' A' ' 86' ' ' TYR . 62.9 mt -68.5 -48.12 65.22 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.19 -0.944 . . . . 0.0 108.981 179.149 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.456 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 34.4 mm -56.01 -33.36 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.56 0 O-C-N 121.206 -0.934 . . . . 0.0 109.941 179.374 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -89.29 -16.23 31.65 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.004 -1.06 . . . . 0.0 112.082 179.929 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.451 ' HB2' ' CE1' ' A' ' 86' ' ' TYR . 8.4 mm-40 -102.88 21.61 15.29 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.547 -1.345 . . . . 0.0 112.05 -179.829 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 17.1 tttp 75.54 72.04 0.09 Allowed 'General case' 0 N--CA 1.511 2.599 0 O-C-N 121.201 -0.937 . . . . 0.0 111.735 179.443 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.777 ' CD2' HD22 ' A' ' 81' ' ' LEU . 33.9 m-85 -134.2 -62.89 0.74 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.519 -0.738 . . . . 0.0 109.119 179.267 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.748 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -129.09 160.15 33.72 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.507 -0.745 . . . . 0.0 109.4 179.243 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.467 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 8.2 t70 -107.61 115.25 29.82 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.035 -1.041 . . . . 0.0 110.346 -179.866 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -58.64 -37.22 75.47 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.255 -0.903 . . . . 0.0 110.03 179.668 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.482 HD23 HD22 ' A' ' 106' ' ' LEU . 7.1 tp -60.79 -38.79 86.5 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.124 -0.985 . . . . 0.0 109.601 179.504 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.598 HD12 ' CZ3' ' A' ' 95' ' ' TRP . 0.3 OUTLIER -65.13 -55.54 18.1 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.094 -1.004 . . . . 0.0 108.856 179.155 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 57.7 mt -61.67 -36.97 76.75 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.41 0 C-N-CA 119.401 -0.919 . . . . 0.0 109.038 178.974 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.74 -39.3 90.99 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.164 -0.96 . . . . 0.0 109.428 178.891 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.43 ' HD2' ' CE1' ' A' ' 100' ' ' TYR . 12.8 mmtm -59.36 -43.94 92.78 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.115 -0.99 . . . . 0.0 109.635 179.543 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.598 ' CZ3' HD12 ' A' ' 91' ' ' LEU . 2.9 m0 -63.86 -33.86 76.65 Favored 'General case' 0 N--CA 1.51 2.526 0 C-N-CA 119.311 -0.956 . . . . 0.0 110.343 179.461 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.54 -30.49 29.69 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.043 -1.036 . . . . 0.0 110.993 179.722 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -54.15 -176.57 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.68 0 O-C-N 120.912 -1.118 . . . . 0.0 110.601 179.87 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -104.16 136.54 43.59 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.16 -0.962 . . . . 0.0 109.874 179.296 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 94.09 13.17 55.28 Favored Glycine 0 N--CA 1.494 2.501 0 C-N-CA 120.295 -0.955 . . . . 0.0 110.938 -179.418 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.584 ' HB3' HD23 ' A' ' 103' ' ' LEU . 49.6 m-85 -120.14 71.34 0.9 Allowed 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 119.322 1.561 . . . . 0.0 110.003 179.748 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -92.84 -36.66 12.71 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.08 -1.012 . . . . 0.0 110.474 179.89 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.28 76.94 1.52 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.051 -1.031 . . . . 0.0 110.698 -179.854 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.584 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.2 pp -122.58 147.34 46.52 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.06 -1.025 . . . . 0.0 109.957 179.536 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.405 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.6 p -111.58 -32.06 6.8 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 119.491 -0.884 . . . . 0.0 112.988 -179.447 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.617 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.1 m -142.22 -168.15 2.65 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 120.26 -1.525 . . . . 0.0 110.156 179.246 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.482 HD22 HD23 ' A' ' 90' ' ' LEU . 44.2 mt -95.97 -38.26 10.31 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.153 -0.967 . . . . 0.0 110.021 179.018 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 18.0 ttt85 -102.46 30.83 4.37 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.958 -1.089 . . . . 0.0 109.721 178.109 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.617 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.311 1.8 t -130.51 20.07 5.19 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.168 -0.958 . . . . 0.0 108.746 -179.429 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.492 HG22 ' HD3' ' A' ' 123' ' ' ARG . 2.1 pt -156.63 38.17 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 O-C-N 120.938 -1.101 . . . . 0.0 110.107 -178.574 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.784 ' C ' HG23 ' A' ' 119' ' ' THR . 31.0 mt-30 -88.19 97.23 10.89 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 120.953 -1.092 . . . . 0.0 110.869 -178.639 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.411 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 7.6 tttm -104.57 -49.57 3.51 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.3 -0.875 . . . . 0.0 110.278 179.586 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -115.79 -173.17 2.3 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.183 -0.948 . . . . 0.0 110.251 179.814 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 52.71 50.45 18.09 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.111 -0.993 . . . . 0.0 110.8 179.951 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -145.8 154.74 42.35 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.086 -1.009 . . . . 0.0 110.373 -179.994 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -116.05 -57.06 2.26 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.215 -0.928 . . . . 0.0 110.07 179.886 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 52.8 m-20 -116.4 110.13 18.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.268 -0.895 . . . . 0.0 110.05 179.814 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 143.15 -168.37 26.12 Favored Glycine 0 N--CA 1.493 2.497 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 -179.87 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 12.3 m -145.86 -164.54 1.98 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.194 -1.18 . . . . 0.0 110.358 -179.777 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.784 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.6 m -107.51 158.24 17.37 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.179 -0.951 . . . . 0.0 109.934 179.814 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.439 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 43.0 t -70.27 153.23 43.3 Favored 'General case' 0 N--CA 1.501 2.087 0 C-N-CA 118.895 -1.122 . . . . 0.0 108.244 178.527 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.941 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -70.41 -31.74 47.78 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.391 0 O-C-N 121.072 -1.017 . . . . 0.0 111.523 -178.667 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.5 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.4 p -60.95 -35.98 78.18 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 120.701 -1.249 . . . . 0.0 110.28 -179.8 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.492 ' HD3' HG22 ' A' ' 109' ' ' ILE . 23.5 tpt85 -57.31 -36.93 71.71 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 120.905 -1.122 . . . . 0.0 109.603 178.539 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 49.1 t -75.13 119.5 77.23 Favored Pre-proline 0 N--CA 1.505 2.302 0 O-C-N 121.204 -0.935 . . . . 0.0 109.85 179.718 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -64.43 178.9 1.43 Allowed 'Trans proline' 0 N--CA 1.488 1.188 0 O-C-N 123.133 1.07 . . . . 0.0 110.768 179.584 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.7 mmm-85 -74.99 -37.53 61.85 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.193 -0.942 . . . . 0.0 110.596 -179.784 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.46 -40.61 83.14 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.071 -1.018 . . . . 0.0 109.968 -179.867 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -69.92 -41.49 74.56 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 119.382 -0.927 . . . . 0.0 109.266 179.246 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.501 HD11 HD11 ' A' ' 121' ' ' ILE . 11.1 mt -65.34 -38.69 90.87 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.272 -0.893 . . . . 0.0 109.576 179.188 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -60.98 -38.75 87.07 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.179 -0.951 . . . . 0.0 109.924 179.653 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.26 -36.21 72.91 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.148 -0.97 . . . . 0.0 110.416 179.845 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -63.77 -49.42 73.02 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.182 -0.949 . . . . 0.0 109.807 179.973 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.496 ' HB1' ' CA ' ' A' ' 139' ' ' GLN . . . -61.25 -38.25 86.01 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.122 -0.986 . . . . 0.0 109.84 179.733 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 15.6 mtp85 -61.69 -36.24 80.32 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.114 -0.991 . . . . 0.0 110.12 179.562 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 6.7 mttm -87.13 -34.96 18.9 Favored 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.029 -1.044 . . . . 0.0 110.747 179.798 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -82.48 -35.99 26.92 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 120.987 -1.07 . . . . 0.0 110.667 179.776 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.87 34.78 8.09 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.804 -1.319 . . . . 0.0 109.804 -179.861 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.9 t -131.17 23.14 4.85 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.992 -1.299 . . . . 0.0 111.531 179.702 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 139' ' ' GLN . . . . . 0.496 ' CA ' ' HB1' ' A' ' 133' ' ' ALA . 5.2 mt-30 48.62 -179.06 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.862 -1.149 . . . . 0.0 111.928 179.462 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.7 p -174.07 159.28 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.307 0 O-C-N 121.051 -1.031 . . . . 0.0 110.698 -179.841 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 41.5 t -171.98 92.5 0.13 Allowed 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.219 -0.926 . . . . 0.0 110.939 179.787 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.941 ' CD1' HD12 ' A' ' 121' ' ' ILE . 80.8 t80 -99.79 158.9 15.46 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.24 -0.912 . . . . 0.0 110.724 -179.881 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -139.46 -61.33 0.55 Allowed 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 178.615 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 1.6 pm0 -137.67 150.81 47.65 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.49 -0.756 . . . . 0.0 108.972 178.621 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 145' ' ' CYS . . . . . 0.411 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.4 p -91.99 153.88 19.16 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.973 -1.08 . . . . 0.0 111.034 -179.735 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.3 p -72.4 -23.4 21.21 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.416 0 C-N-CA 119.733 -0.787 . . . . 0.0 111.51 -179.76 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 59.0 m170 -51.55 -60.6 2.96 Favored 'General case' 0 N--CA 1.514 2.746 0 O-C-N 120.711 -1.243 . . . . 0.0 110.044 179.921 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.51 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 21.6 p -125.8 -164.11 1.28 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.265 -0.897 . . . . 0.0 110.395 179.327 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -101.64 61.53 0.55 Allowed Glycine 0 N--CA 1.492 2.384 0 N-CA-C 107.958 -2.057 . . . . 0.0 107.958 178.202 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 18.9 t -100.32 146.38 27.02 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.293 -1.122 . . . . 0.0 109.866 -179.13 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 6.7 ttm-85 -100.42 45.65 0.97 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.254 -0.904 . . . . 0.0 109.566 179.349 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 74.08 97.03 0.1 OUTLIER Glycine 0 N--CA 1.486 2.015 0 N-CA-C 109.806 -1.318 . . . . 0.0 109.806 179.993 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 26.3 p -109.47 125.74 52.77 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.275 -1.132 . . . . 0.0 110.133 179.606 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -144.79 144.93 31.41 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.088 -1.008 . . . . 0.0 110.181 -179.414 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.73 -35.28 10.6 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.235 -0.916 . . . . 0.0 111.025 -179.824 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 41.7 p -77.63 -40.33 42.28 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 120.888 -1.132 . . . . 0.0 110.217 179.978 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 . . . . . 0 N--CA 1.496 1.837 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.45 179.881 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.3 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 66.78 90.14 0.05 OUTLIER Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.633 -1.387 . . . . 0.0 109.633 -179.972 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 60.2 p -121.11 84.84 40.39 Favored Pre-proline 0 N--CA 1.494 1.769 0 O-C-N 121.242 -1.152 . . . . 0.0 110.212 -179.99 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.89 117.75 5.26 Favored 'Trans proline' 0 C--N 1.316 -1.132 0 O-C-N 123.413 1.217 . . . . 0.0 110.38 -179.973 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.9 ttm-85 -120.51 58.51 0.93 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.198 -0.939 . . . . 0.0 110.157 179.964 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.6 mm -116.62 141.3 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.144 -0.973 . . . . 0.0 110.016 -179.994 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.6 mttp -120.08 158.86 25.98 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.174 -0.954 . . . . 0.0 110.219 -179.984 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 12.8 p -118.84 54.58 0.95 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.235 -0.915 . . . . 0.0 110.155 -179.994 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.92 84.56 2.17 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.134 -0.979 . . . . 0.0 110.178 -179.981 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.8 ttm-85 -117.55 -57.56 2.12 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.247 -0.908 . . . . 0.0 110.093 179.892 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.4 t -128.79 98.51 5.0 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.177 -0.952 . . . . 0.0 110.13 179.977 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.3 tptt -127.9 95.77 33.68 Favored Pre-proline 0 N--CA 1.494 1.753 0 O-C-N 121.251 -0.906 . . . . 0.0 110.227 -179.908 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.52 158.59 50.76 Favored 'Trans proline' 0 C--N 1.316 -1.161 0 O-C-N 123.414 1.218 . . . . 0.0 110.508 179.858 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.655 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -55.26 148.61 30.53 Favored Pre-proline 0 N--CA 1.514 2.728 0 O-C-N 121.312 -0.868 . . . . 0.0 110.079 -179.982 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -70.97 160.43 49.38 Favored 'Trans proline' 0 C--N 1.316 -1.152 0 O-C-N 123.314 1.165 . . . . 0.0 110.831 -179.538 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -48.72 -32.06 7.87 Favored 'General case' 0 N--CA 1.515 2.816 0 O-C-N 121.384 -0.822 . . . . 0.0 111.403 -179.718 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.63 -33.27 41.12 Favored Glycine 0 N--CA 1.498 2.773 0 O-C-N 121.011 -1.055 . . . . 0.0 110.653 179.751 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.445 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 16.6 t80 -55.3 -34.23 63.96 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 120.939 -1.33 . . . . 0.0 110.701 179.888 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -55.17 -37.22 66.74 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 121.05 -1.031 . . . . 0.0 110.239 179.727 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.3 mtpt -57.65 -35.51 70.62 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.237 -0.915 . . . . 0.0 110.319 179.604 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.894 HD12 HD11 ' A' ' 23' ' ' LEU . 3.2 pt -115.25 36.33 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 O-C-N 121.186 -0.947 . . . . 0.0 110.328 179.548 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.445 ' HD2' ' CE2' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -84.98 -42.93 0.67 Allowed Pre-proline 0 N--CA 1.511 2.59 0 O-C-N 121.149 -0.969 . . . . 0.0 113.509 -179.143 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.8 Cg_endo -75.06 -37.23 2.09 Favored 'Trans proline' 0 N--CA 1.488 1.188 0 O-C-N 122.63 0.805 . . . . 0.0 111.921 -177.828 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.756 HG21 ' CE2' ' A' ' 62' ' ' TYR . 70.6 m -61.32 -43.38 98.96 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.019 -1.051 . . . . 0.0 110.139 -179.569 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.894 HD11 HD12 ' A' ' 19' ' ' ILE . 34.1 mt -65.07 -40.18 94.32 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.219 -0.926 . . . . 0.0 109.58 179.746 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -34.17 69.2 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.107 -0.995 . . . . 0.0 110.276 179.337 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -56.72 -36.36 69.62 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.004 -1.06 . . . . 0.0 110.288 179.628 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.742 ' CD1' HD22 ' A' ' 55' ' ' LEU . 26.2 m-85 -57.2 -39.89 76.33 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.098 -1.001 . . . . 0.0 110.325 179.866 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -60.06 -23.63 63.92 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.316 -0.865 . . . . 0.0 111.483 -179.461 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.568 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.7 mp -81.19 -34.72 13.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.426 0 O-C-N 120.767 -1.208 . . . . 0.0 109.727 179.623 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.429 ' OE1' HD21 ' A' ' 55' ' ' LEU . 25.3 tt0 -82.53 -36.21 26.56 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 120.951 -1.093 . . . . 0.0 109.179 178.543 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.726 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -74.18 -31.65 62.75 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.134 -0.979 . . . . 0.0 110.054 178.864 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -69.56 -36.71 76.57 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 120.808 -1.183 . . . . 0.0 109.911 179.419 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -64.19 -42.09 96.82 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.104 -1.038 . . . . 0.0 109.168 179.277 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.589 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -68.43 -41.95 79.59 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.272 -0.893 . . . . 0.0 109.096 178.964 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -59.41 -35.13 73.4 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.226 -0.922 . . . . 0.0 110.218 179.579 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -82.79 -39.73 21.39 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.009 -1.057 . . . . 0.0 110.147 179.818 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -59.98 -39.76 86.82 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.214 -0.929 . . . . 0.0 109.959 179.681 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.67 -38.05 74.47 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.148 -0.97 . . . . 0.0 110.374 179.937 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 6.4 t -109.82 59.71 0.6 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.047 -1.033 . . . . 0.0 110.077 179.847 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.3 t -146.95 -58.59 0.28 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.206 -0.934 . . . . 0.0 110.506 -179.962 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 42.2 mttt -103.63 -48.09 4.06 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.215 -0.928 . . . . 0.0 110.311 179.907 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.428 HD22 ' HA ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER 54.07 53.84 10.53 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 120.932 -1.105 . . . . 0.0 110.615 -179.88 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -142.94 -59.64 0.43 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.167 -0.958 . . . . 0.0 110.28 179.87 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -136.16 157.61 46.4 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.27 -0.894 . . . . 0.0 110.178 179.868 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.2 tttm 52.92 49.28 20.56 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.04 -1.038 . . . . 0.0 110.759 179.986 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.0 m -112.7 -54.15 2.65 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.123 -0.985 . . . . 0.0 110.501 179.983 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -56.25 -38.36 71.02 Favored 'General case' 0 N--CA 1.511 2.599 0 O-C-N 121.138 -0.976 . . . . 0.0 110.06 179.884 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -62.01 -40.84 97.05 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.211 -0.931 . . . . 0.0 109.804 179.773 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 48.9 tp60 -62.21 -40.49 96.26 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.183 -0.948 . . . . 0.0 109.782 179.805 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.442 HD23 ' HA ' ' A' ' 49' ' ' LEU . 12.6 mt -59.32 -39.28 82.61 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.142 -0.974 . . . . 0.0 110.092 179.87 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.482 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.8 m0 -61.17 -36.22 79.24 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.114 -0.991 . . . . 0.0 110.149 179.86 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.96 -31.21 68.52 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.988 -1.07 . . . . 0.0 110.107 178.871 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.726 HG23 ' CG ' ' A' ' 30' ' ' LEU . 79.6 mt -72.08 -60.29 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.286 0 O-C-N 120.921 -1.112 . . . . 0.0 108.816 179.148 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 5.6 ptm -61.67 -29.32 70.0 Favored 'General case' 0 N--CA 1.508 2.443 0 C-N-CA 118.771 -1.171 . . . . 0.0 109.685 178.568 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -70.39 -38.32 74.65 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.832 -1.168 . . . . 0.0 109.001 178.307 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.742 HD22 ' CD1' ' A' ' 26' ' ' PHE . 11.7 mt -53.72 -33.39 55.42 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.057 -1.027 . . . . 0.0 110.067 178.959 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.471 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 38.4 t60 -54.63 -38.79 67.28 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 120.961 -1.087 . . . . 0.0 109.943 179.816 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.427 ' CD2' HD21 ' A' ' 91' ' ' LEU . 5.2 m170 -59.15 -46.14 89.14 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.152 -0.967 . . . . 0.0 109.321 179.354 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 -61.64 -37.36 83.71 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.406 -0.917 . . . . 0.0 109.272 178.93 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.442 ' HG2' ' CE1' ' A' ' 26' ' ' PHE . 3.5 mmm-85 -64.51 -50.46 67.29 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.125 -0.984 . . . . 0.0 109.216 178.999 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 89.4 p -62.82 -40.11 96.39 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.197 -0.939 . . . . 0.0 109.193 179.455 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 12.5 ttm-85 -64.72 -38.25 90.34 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.127 -0.983 . . . . 0.0 109.399 178.995 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.756 ' CE2' HG21 ' A' ' 22' ' ' THR . 37.7 t80 -60.61 -48.69 80.66 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.094 -1.004 . . . . 0.0 109.583 179.542 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.728 HD12 ' HB2' ' A' ' 87' ' ' ALA . 84.7 mt -76.51 -42.25 35.32 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.338 0 O-C-N 121.222 -0.924 . . . . 0.0 108.875 179.119 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.463 ' CE1' HG23 ' A' ' 92' ' ' ILE . 44.4 t80 -61.44 -22.74 65.31 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.402 -0.811 . . . . 0.0 110.507 178.824 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 86.9 m -90.73 -36.0 14.56 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.609 -1.307 . . . . 0.0 110.503 179.955 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.548 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.6 pp -82.9 -32.3 27.37 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.898 -1.126 . . . . 0.0 112.343 -179.179 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.491 ' N ' HD12 ' A' ' 66' ' ' LEU . 34.3 t80 -86.21 -37.87 18.21 Favored 'General case' 0 N--CA 1.512 2.648 0 O-C-N 120.738 -1.226 . . . . 0.0 111.299 -179.375 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.408 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 12.9 m-85 -89.68 -21.63 22.64 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.977 -1.077 . . . . 0.0 112.548 -178.647 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.6 mttm -119.87 -60.71 1.68 Allowed 'General case' 0 N--CA 1.501 2.104 0 O-C-N 120.489 -1.382 . . . . 0.0 111.153 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.41 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 31.8 ttt85 -60.38 -30.33 69.51 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.079 -1.013 . . . . 0.0 110.92 -179.464 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.1 tttt 57.5 42.04 25.03 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.859 -1.15 . . . . 0.0 110.025 -179.462 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -111.93 35.31 3.76 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.342 -0.849 . . . . 0.0 109.87 179.219 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.781 HG13 HD23 ' A' ' 77' ' ' LEU . 13.6 tt -156.14 162.1 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.214 -0.929 . . . . 0.0 109.913 -179.956 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 40.5 m -108.78 149.56 28.88 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.117 -0.989 . . . . 0.0 110.211 179.967 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.0 tttt -46.83 -32.08 3.48 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.307 -0.871 . . . . 0.0 111.462 -179.972 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.19 -50.6 71.14 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 120.893 -1.129 . . . . 0.0 109.39 179.521 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.781 HD23 HG13 ' A' ' 73' ' ' ILE . 38.0 tp -66.9 -44.3 81.17 Favored 'General case' 0 N--CA 1.505 2.301 0 C-N-CA 119.108 -1.037 . . . . 0.0 108.488 178.856 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.653 ' HA ' HD12 ' A' ' 81' ' ' LEU . 17.5 t80 -60.24 -38.64 84.05 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.305 -0.872 . . . . 0.0 109.425 178.933 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -72.75 -42.7 63.78 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.04 -1.037 . . . . 0.0 108.656 178.495 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.655 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 75.0 t90 -57.68 -37.13 72.91 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.271 -0.893 . . . . 0.0 109.576 178.825 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.653 HD12 ' HA ' ' A' ' 78' ' ' TYR . 12.7 mt -67.6 -51.44 50.27 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.18 -0.95 . . . . 0.0 109.113 179.178 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 36.3 mm -57.34 -31.64 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.507 0 O-C-N 121.246 -0.909 . . . . 0.0 110.228 179.559 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -89.26 -13.13 38.81 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 120.907 -1.12 . . . . 0.0 112.222 -179.804 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.441 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 76.4 mm-40 -108.84 23.12 15.0 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 120.535 -1.353 . . . . 0.0 111.977 -179.879 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.65 74.18 0.11 Allowed 'General case' 0 N--CA 1.512 2.671 0 O-C-N 121.188 -0.945 . . . . 0.0 111.71 179.227 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.496 ' HE2' HD13 ' A' ' 23' ' ' LEU . 32.0 m-85 -134.05 -62.94 0.75 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.512 -0.743 . . . . 0.0 109.22 179.433 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.728 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -131.2 163.06 28.56 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.472 -0.768 . . . . 0.0 109.418 179.315 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.471 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 8.3 t0 -107.93 108.65 19.89 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.091 -1.006 . . . . 0.0 110.417 -179.911 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -58.7 -37.54 76.32 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.249 -0.907 . . . . 0.0 110.19 179.742 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.626 HD23 HD13 ' A' ' 106' ' ' LEU . 18.4 tp -59.03 -39.01 80.63 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.102 -0.999 . . . . 0.0 110.19 -179.973 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.587 ' HA ' HD21 ' A' ' 106' ' ' LEU . 58.4 tp -71.02 -45.5 63.8 Favored 'General case' 0 N--CA 1.505 2.29 0 C-N-CA 119.123 -1.031 . . . . 0.0 108.884 179.318 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.463 HG23 ' CE1' ' A' ' 64' ' ' TYR . 20.6 mt -60.91 -39.09 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.384 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 178.358 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.77 -39.88 95.57 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.116 -0.99 . . . . 0.0 109.355 178.741 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.552 ' HB3' HD22 ' A' ' 103' ' ' LEU . 13.5 mmtm -59.54 -47.73 84.4 Favored 'General case' 0 N--CA 1.51 2.575 0 O-C-N 121.137 -0.977 . . . . 0.0 109.287 179.455 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.6 m0 -59.68 -35.18 73.96 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.364 -0.835 . . . . 0.0 110.244 179.549 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.429 ' HD2' ' OH ' ' A' ' 64' ' ' TYR . 8.9 mtp85 -81.94 -33.02 30.53 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.112 -0.992 . . . . 0.0 110.757 179.76 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 7.9 mmtt -51.82 178.01 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.782 0 O-C-N 121.007 -1.058 . . . . 0.0 110.851 -179.855 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 28.5 m -105.38 140.43 38.5 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.252 -0.905 . . . . 0.0 109.395 179.188 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.88 -22.85 37.84 Favored Glycine 0 N--CA 1.494 2.534 0 C-N-CA 119.709 -1.234 . . . . 0.0 110.465 -179.26 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.649 ' HB3' HD23 ' A' ' 103' ' ' LEU . 70.0 m-85 -91.22 58.43 3.68 Favored 'General case' 0 N--CA 1.505 2.277 0 CA-C-N 119.181 1.49 . . . . 0.0 110.056 179.831 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -66.6 -36.08 81.75 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.076 -1.015 . . . . 0.0 110.272 179.891 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.1 mmmt -127.95 97.36 4.77 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.054 -1.029 . . . . 0.0 110.819 -179.708 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.649 HD23 ' HB3' ' A' ' 100' ' ' TYR . 2.2 pp -134.64 136.62 42.98 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.111 -0.993 . . . . 0.0 109.983 179.24 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.427 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.9 p -103.9 -28.42 11.6 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.193 -0.942 . . . . 0.0 112.337 -179.787 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.705 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 14.3 m -145.46 -166.63 2.48 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.301 -1.499 . . . . 0.0 109.547 178.955 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.626 HD13 HD23 ' A' ' 90' ' ' LEU . 25.6 mt -99.0 -45.84 5.81 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.111 -0.993 . . . . 0.0 109.63 178.613 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 61.8 ttt-85 -93.42 -1.67 55.5 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 120.977 -1.077 . . . . 0.0 111.498 178.911 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.705 ' HB2' ' HB2' ' A' ' 105' ' ' CYS . 1.6 t -83.04 -48.13 10.94 Favored 'General case' 0 N--CA 1.512 2.635 0 N-CA-C 105.331 -2.1 . . . . 0.0 105.331 178.61 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.787 ' O ' HG21 ' A' ' 119' ' ' THR . 14.4 pt -76.13 -25.21 16.69 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.553 0 O-C-N 121.208 -0.933 . . . . 0.0 110.83 177.568 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.469 ' C ' HG23 ' A' ' 119' ' ' THR . 7.1 mt-30 -120.61 -174.68 2.86 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.004 -1.06 . . . . 0.0 110.127 -179.767 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.81 -167.74 1.74 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.202 -0.936 . . . . 0.0 110.412 179.9 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -146.01 -58.32 0.31 Allowed 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.212 -0.93 . . . . 0.0 110.73 -179.748 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -125.49 50.51 1.8 Allowed 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.174 -0.954 . . . . 0.0 110.49 -179.97 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.52 -163.63 1.19 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.282 -0.886 . . . . 0.0 109.735 179.768 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 12.8 t30 -106.45 179.78 4.17 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.068 -1.02 . . . . 0.0 110.151 179.954 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 50.9 m-20 -60.44 141.65 56.11 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.146 -0.971 . . . . 0.0 110.037 -179.827 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 68.78 46.96 58.54 Favored Glycine 0 N--CA 1.491 2.367 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.992 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 64.4 m -139.17 61.02 1.57 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.199 -1.177 . . . . 0.0 110.219 179.975 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.787 HG21 ' O ' ' A' ' 109' ' ' ILE . 0.3 OUTLIER -115.56 179.35 3.99 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.112 -0.993 . . . . 0.0 109.952 179.72 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.408 ' HB3' ' O ' ' A' ' 108' ' ' CYS . 34.3 t -58.72 153.91 15.76 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.172 -0.955 . . . . 0.0 109.87 179.802 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.799 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -72.87 -34.53 46.78 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.394 0 O-C-N 121.126 -0.984 . . . . 0.0 111.217 -179.207 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.493 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 12.3 p -55.64 -33.82 64.39 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 120.817 -1.177 . . . . 0.0 111.165 -178.788 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 6.6 ttp85 -59.56 -35.15 73.7 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 120.882 -1.136 . . . . 0.0 109.55 178.382 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 58.7 t -79.95 125.19 82.43 Favored Pre-proline 0 N--CA 1.503 2.18 0 O-C-N 121.121 -0.987 . . . . 0.0 109.653 179.468 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.595 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.3 Cg_endo -65.12 177.12 2.66 Favored 'Trans proline' 0 N--CA 1.488 1.155 0 O-C-N 123.104 1.055 . . . . 0.0 110.814 179.734 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 3.8 tpp85 -75.01 -38.12 61.64 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.257 -0.902 . . . . 0.0 110.529 -179.818 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.18 -40.67 82.08 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.066 -1.021 . . . . 0.0 110.031 -179.946 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 14.8 tm0? -69.94 -42.28 73.46 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.21 -0.931 . . . . 0.0 109.17 179.25 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.595 HD12 ' O ' ' A' ' 125' ' ' PRO . 8.2 mt -65.5 -38.44 89.72 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 119.526 -0.869 . . . . 0.0 109.464 179.08 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -59.81 -38.53 82.22 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.113 -0.992 . . . . 0.0 110.013 179.563 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -58.44 -37.29 75.11 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.133 -0.98 . . . . 0.0 110.379 179.895 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -60.19 -43.38 95.96 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.091 -1.006 . . . . 0.0 110.041 -179.969 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.682 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -61.91 -45.79 92.16 Favored 'General case' 0 N--CA 1.509 2.487 0 C-N-CA 119.305 -0.958 . . . . 0.0 109.726 179.875 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 3.3 mmt85 -58.19 -34.28 70.18 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.207 -0.933 . . . . 0.0 110.373 179.618 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -76.73 -31.42 57.13 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.116 -0.99 . . . . 0.0 110.914 179.919 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 42.0 mttt -98.73 23.93 8.16 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 120.812 -1.18 . . . . 0.0 111.642 -179.9 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.71 47.02 53.68 Favored Glycine 0 N--CA 1.5 2.905 0 O-C-N 120.696 -1.252 . . . . 0.0 110.717 179.212 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.682 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.7 t -153.47 -171.06 3.78 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.087 -1.243 . . . . 0.0 110.726 179.822 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -123.65 176.77 6.03 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.232 -0.917 . . . . 0.0 110.241 -179.831 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.2 p -158.89 161.17 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.193 -0.942 . . . . 0.0 110.765 -179.953 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 31.6 t -166.3 97.62 0.6 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.325 -0.859 . . . . 0.0 110.971 -179.999 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.728 ' CG ' HD12 ' A' ' 121' ' ' ILE . 59.4 t80 -101.08 158.65 15.85 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.295 -0.878 . . . . 0.0 110.483 -179.87 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -137.59 -60.51 0.65 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.437 -0.789 . . . . 0.0 109.102 179.04 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -138.0 149.13 45.82 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.374 -0.829 . . . . 0.0 109.139 178.793 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 145' ' ' CYS . . . . . 0.425 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.3 p -88.88 154.98 19.81 Favored 'General case' 0 N--CA 1.507 2.397 0 C-N-CA 119.112 -1.035 . . . . 0.0 111.033 -179.553 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.1 p -74.89 -23.78 17.71 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.327 0 O-C-N 121.318 -0.864 . . . . 0.0 111.678 -179.382 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 62.7 m170 -52.01 -61.5 2.22 Favored 'General case' 0 N--CA 1.515 2.791 0 O-C-N 120.659 -1.276 . . . . 0.0 110.115 -179.933 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.482 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.9 p -125.61 -167.12 1.65 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.224 -0.923 . . . . 0.0 110.404 179.711 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -97.79 66.93 0.8 Allowed Glycine 0 N--CA 1.493 2.47 0 N-CA-C 108.076 -2.009 . . . . 0.0 108.076 178.54 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 36.7 t -102.97 144.18 31.58 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.305 -1.115 . . . . 0.0 110.111 -179.165 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 32.5 mtp85 -99.29 48.39 0.95 Allowed 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.156 -0.965 . . . . 0.0 109.38 178.993 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.17 96.39 0.05 OUTLIER Glycine 0 N--CA 1.486 1.994 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 -179.814 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 22.8 p -109.17 127.88 54.57 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.151 -1.205 . . . . 0.0 110.339 179.72 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -141.96 141.99 32.96 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.115 -0.991 . . . . 0.0 109.863 -179.734 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -106.75 -49.74 3.25 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.252 -0.905 . . . . 0.0 110.563 -179.801 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 27.9 p -54.09 -38.28 65.18 Favored 'General case' 0 N--CA 1.513 2.683 0 O-C-N 121.012 -1.055 . . . . 0.0 110.614 -179.79 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 117.987 -1.006 . . . . 0.0 110.326 179.923 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.337 0 N-CA-C 109.584 -1.407 . . . . 0.0 109.584 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -93.66 -169.17 38.5 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.981 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.434 ' OG ' ' HD2' ' A' ' 2' ' ' PRO . 0.3 OUTLIER -120.51 162.98 31.52 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.194 -1.18 . . . . 0.0 110.164 -179.978 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.434 ' HD2' ' OG ' ' A' ' 1' ' ' SER . 46.4 Cg_endo -72.75 132.43 18.62 Favored 'Trans proline' 0 C--N 1.317 -1.111 0 O-C-N 123.419 1.221 . . . . 0.0 110.367 -179.993 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.432 ' C ' HG23 ' A' ' 4' ' ' ILE . 0.1 OUTLIER -116.97 74.62 0.92 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.188 -0.945 . . . . 0.0 110.201 -179.969 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.432 HG23 ' C ' ' A' ' 3' ' ' ARG . 1.7 pp -148.36 127.37 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.129 -0.982 . . . . 0.0 110.455 179.75 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.7 tttp -134.98 103.14 5.46 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.301 -0.875 . . . . 0.0 110.157 -179.943 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 74.8 p -117.37 172.0 7.61 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.273 -0.892 . . . . 0.0 110.246 -179.972 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.3 mmm-85 -136.01 177.5 7.79 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.197 -0.939 . . . . 0.0 110.245 179.982 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 75.9 mtt180 -125.34 47.59 2.16 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.148 -0.97 . . . . 0.0 110.246 179.991 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.4 t -139.33 41.21 2.07 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.225 -0.922 . . . . 0.0 110.234 -179.966 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 39.1 mttp -130.31 72.28 81.96 Favored Pre-proline 0 N--CA 1.493 1.696 0 O-C-N 121.126 -0.984 . . . . 0.0 110.082 179.996 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -74.23 158.5 45.01 Favored 'Trans proline' 0 C--N 1.317 -1.121 0 O-C-N 123.345 1.182 . . . . 0.0 110.758 -179.963 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.655 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -103.74 143.47 26.7 Favored Pre-proline 0 N--CA 1.5 2.071 0 O-C-N 121.482 -0.761 . . . . 0.0 109.654 179.566 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -68.36 164.24 33.35 Favored 'Trans proline' 0 C--N 1.317 -1.131 0 O-C-N 123.282 1.148 . . . . 0.0 110.94 -179.772 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -48.11 -31.65 5.85 Favored 'General case' 0 N--CA 1.516 2.825 0 O-C-N 121.484 -0.76 . . . . 0.0 111.544 -179.739 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.76 -36.15 40.3 Favored Glycine 0 N--CA 1.498 2.8 0 O-C-N 120.898 -1.126 . . . . 0.0 110.548 179.887 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.601 ' HB2' HD11 ' A' ' 77' ' ' LEU . 23.0 t80 -57.48 -34.18 68.76 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.983 -1.304 . . . . 0.0 110.504 179.76 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -52.58 -36.64 56.47 Favored 'General case' 0 N--CA 1.513 2.697 0 O-C-N 120.912 -1.117 . . . . 0.0 110.212 179.743 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.9 mtmt -58.56 -36.09 73.37 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.216 -0.927 . . . . 0.0 110.259 179.534 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.865 HD12 HD11 ' A' ' 23' ' ' LEU . 1.7 pt -120.7 35.01 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 O-C-N 121.109 -0.995 . . . . 0.0 110.77 179.881 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.436 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.7 OUTLIER -83.7 -43.33 0.8 Allowed Pre-proline 0 N--CA 1.51 2.557 0 O-C-N 121.031 -1.043 . . . . 0.0 113.313 -179.085 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.436 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.5 Cg_endo -75.37 -35.24 3.0 Favored 'Trans proline' 0 N--CA 1.486 1.044 0 O-C-N 122.6 0.789 . . . . 0.0 111.903 -178.094 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.732 HG21 ' CE2' ' A' ' 62' ' ' TYR . 88.6 m -60.16 -43.26 95.94 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 120.95 -1.094 . . . . 0.0 110.1 -179.738 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.865 HD11 HD12 ' A' ' 19' ' ' ILE . 5.9 mt -65.95 -41.16 91.61 Favored 'General case' 0 N--CA 1.507 2.418 0 C-N-CA 119.472 -0.891 . . . . 0.0 109.355 179.512 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.17 -34.63 72.34 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.259 -0.9 . . . . 0.0 110.077 179.277 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -58.49 -36.72 74.19 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.145 -0.972 . . . . 0.0 110.349 179.869 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.693 ' CD2' HD22 ' A' ' 55' ' ' LEU . 11.6 m-85 -55.78 -41.47 74.11 Favored 'General case' 0 N--CA 1.512 2.634 0 O-C-N 120.905 -1.122 . . . . 0.0 109.869 179.56 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -58.24 -25.98 62.35 Favored 'General case' 0 N--CA 1.506 2.352 0 C-N-CA 119.302 -0.959 . . . . 0.0 110.501 179.05 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 15.2 mm -68.41 -52.23 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.342 0 O-C-N 120.923 -1.111 . . . . 0.0 109.162 179.488 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -66.89 -42.47 85.45 Favored 'General case' 0 N--CA 1.508 2.451 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.018 179.31 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.686 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -64.69 -35.53 81.35 Favored 'General case' 0 N--CA 1.506 2.358 0 C-N-CA 119.44 -0.904 . . . . 0.0 109.106 178.744 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.71 -40.38 83.54 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.082 -1.011 . . . . 0.0 109.997 179.582 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -62.55 -47.74 82.57 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.202 -0.937 . . . . 0.0 109.717 -179.957 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.652 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -69.05 -40.24 78.65 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.164 -0.96 . . . . 0.0 109.278 179.213 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 41.4 mm-40 -67.57 -31.69 71.93 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.248 -0.907 . . . . 0.0 110.398 179.465 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.2 mmmt -92.89 -34.66 13.72 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 120.861 -1.149 . . . . 0.0 110.736 179.965 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -57.54 -36.07 71.14 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.017 -1.052 . . . . 0.0 110.153 179.836 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.688 ' HA ' HD22 ' A' ' 41' ' ' LEU . 9.2 mtmt -54.39 -37.2 64.75 Favored 'General case' 0 N--CA 1.512 2.627 0 O-C-N 121.064 -1.022 . . . . 0.0 110.461 179.879 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.3 p -106.2 39.19 1.85 Allowed 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.092 -1.005 . . . . 0.0 110.194 179.657 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.1 m -154.94 89.54 1.23 Allowed 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.151 -0.968 . . . . 0.0 110.496 -179.995 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt 53.48 86.98 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.06 -1.025 . . . . 0.0 110.664 -179.852 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.688 HD22 ' HA ' ' A' ' 37' ' ' LYS . 4.4 tp -154.36 87.58 1.19 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.194 -0.941 . . . . 0.0 110.648 -179.986 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.21 -39.08 10.27 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.214 -0.929 . . . . 0.0 110.275 179.801 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -115.56 170.11 8.67 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.027 -1.045 . . . . 0.0 110.226 179.94 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 17.1 mttt 53.24 77.27 0.18 Allowed 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.017 -1.052 . . . . 0.0 110.752 179.952 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.9 t -115.31 -55.16 2.48 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.178 -0.951 . . . . 0.0 110.508 179.958 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.7 m-20 -55.12 -38.29 68.0 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.094 -1.004 . . . . 0.0 110.036 179.763 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -59.8 -38.31 81.58 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.274 -0.891 . . . . 0.0 110.144 179.708 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -64.47 -40.71 96.22 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.113 -0.992 . . . . 0.0 109.925 179.947 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.548 HD21 ' HE2' ' A' ' 37' ' ' LYS . 24.8 mt -67.85 -35.78 79.17 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.223 -0.923 . . . . 0.0 110.344 179.899 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 47.1 m0 -58.79 -37.82 77.16 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.003 -1.06 . . . . 0.0 110.019 179.879 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -62.96 -32.17 73.44 Favored 'General case' 0 N--CA 1.504 2.235 0 C-N-CA 119.074 -1.05 . . . . 0.0 109.494 178.425 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.686 HG23 ' CG ' ' A' ' 30' ' ' LEU . 68.6 mt -71.83 -59.04 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.232 0 O-C-N 120.91 -1.119 . . . . 0.0 108.999 179.216 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -60.69 -29.11 69.12 Favored 'General case' 0 N--CA 1.511 2.605 0 C-N-CA 118.483 -1.287 . . . . 0.0 109.918 178.9 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.4 mm-40 -68.75 -37.9 79.72 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 120.846 -1.159 . . . . 0.0 109.138 178.215 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.693 HD22 ' CD2' ' A' ' 26' ' ' PHE . 10.9 mt -53.74 -32.18 51.22 Favored 'General case' 0 N--CA 1.511 2.6 0 O-C-N 120.92 -1.112 . . . . 0.0 110.375 179.026 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.444 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 17.6 t60 -56.62 -37.0 70.09 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.004 -1.06 . . . . 0.0 110.302 179.91 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.495 ' NE2' HD21 ' A' ' 91' ' ' LEU . 5.5 m170 -61.41 -51.13 70.04 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.141 -0.974 . . . . 0.0 109.458 179.407 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -57.98 -35.92 71.88 Favored 'General case' 0 N--CA 1.509 2.478 0 C-N-CA 119.377 -0.929 . . . . 0.0 109.715 179.206 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.435 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -65.48 -50.27 65.95 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.102 -0.999 . . . . 0.0 109.353 179.272 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 60.7 p -62.24 -39.12 91.77 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.097 -1.002 . . . . 0.0 109.209 179.24 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -63.78 -37.39 87.2 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.292 -0.963 . . . . 0.0 109.416 179.001 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.732 ' CE2' HG21 ' A' ' 22' ' ' THR . 36.0 t80 -61.0 -50.6 72.71 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.154 -0.966 . . . . 0.0 109.344 179.504 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.64 HD12 ' HB2' ' A' ' 87' ' ' ALA . 92.0 mt -74.5 -41.91 49.23 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 C-N-CA 119.329 -0.949 . . . . 0.0 108.872 179.193 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.435 ' OH ' ' NH1' ' A' ' 96' ' ' ARG . 58.6 t80 -59.77 -36.21 76.21 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.3 -0.875 . . . . 0.0 109.821 179.032 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 76.2 m -75.04 -38.77 61.34 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.943 -1.098 . . . . 0.0 110.356 180.0 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.529 ' C ' HD12 ' A' ' 66' ' ' LEU . 3.5 pp -83.23 -31.47 26.99 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.85 -1.156 . . . . 0.0 112.142 -179.275 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.472 ' HD2' HG23 ' A' ' 73' ' ' ILE . 40.8 t80 -86.4 -41.47 14.44 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 120.658 -1.277 . . . . 0.0 111.874 -179.575 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -90.39 -26.36 19.94 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 120.89 -1.131 . . . . 0.0 112.818 -177.723 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.42 ' HE2' ' CD2' ' A' ' 64' ' ' TYR . 0.7 OUTLIER -109.11 -58.2 2.06 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.673 -1.267 . . . . 0.0 110.668 -179.988 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.418 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 8.1 tpt180 -58.32 -33.58 69.66 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.015 -1.053 . . . . 0.0 110.364 179.721 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.7 tttp 59.26 47.21 11.8 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 120.896 -1.128 . . . . 0.0 110.37 179.903 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.8 -58.1 2.2 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.378 -0.826 . . . . 0.0 109.507 179.339 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.705 HG13 HD23 ' A' ' 77' ' ' LEU . 14.8 tt -54.91 162.39 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.601 0 O-C-N 121.366 -0.834 . . . . 0.0 110.224 179.55 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.0 t -110.53 147.36 34.32 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.188 -0.945 . . . . 0.0 109.805 178.975 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -43.15 -33.83 0.98 Allowed 'General case' 0 N--CA 1.52 3.04 0 O-C-N 121.376 -0.828 . . . . 0.0 111.986 -179.594 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.6 -48.04 83.52 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 120.956 -1.09 . . . . 0.0 109.474 179.556 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.705 HD23 HG13 ' A' ' 73' ' ' ILE . 23.9 tp -70.52 -41.79 72.12 Favored 'General case' 0 N--CA 1.504 2.233 0 C-N-CA 119.236 -0.986 . . . . 0.0 108.705 178.611 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.54 ' HA ' HD12 ' A' ' 81' ' ' LEU . 26.2 t80 -61.71 -36.56 81.29 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.27 -0.894 . . . . 0.0 109.478 178.821 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -71.96 -43.77 64.63 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.024 -1.048 . . . . 0.0 108.905 179.047 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.655 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 72.8 t90 -59.42 -37.97 79.42 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.227 -0.921 . . . . 0.0 109.428 178.979 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.54 HD12 ' HA ' ' A' ' 78' ' ' TYR . 18.8 mt -65.74 -49.77 67.21 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.247 -0.908 . . . . 0.0 109.55 179.531 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.527 HD12 ' HG3' ' A' ' 89' ' ' LYS . 39.7 mm -59.6 -33.16 50.92 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.515 0 O-C-N 121.258 -0.901 . . . . 0.0 110.164 179.68 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.13 -6.3 57.11 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 120.909 -1.119 . . . . 0.0 112.379 -179.802 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.42 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 7.6 mm-40 -114.46 21.81 14.24 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.537 -1.352 . . . . 0.0 111.899 -179.941 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.01 77.74 0.12 Allowed 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.014 -1.054 . . . . 0.0 111.433 179.371 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.578 ' HE2' HD13 ' A' ' 23' ' ' LEU . 33.0 m-85 -136.7 -63.46 0.62 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.499 -0.75 . . . . 0.0 109.418 179.653 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.64 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -125.6 -174.26 3.03 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.431 -0.793 . . . . 0.0 109.293 179.342 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.444 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 5.4 t0 -121.67 102.76 8.43 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.098 -1.001 . . . . 0.0 110.343 -179.956 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.527 ' HG3' HD12 ' A' ' 82' ' ' ILE . 19.5 mtpt -60.37 -40.38 90.6 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.143 -0.973 . . . . 0.0 109.874 179.618 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.581 HD23 HD13 ' A' ' 106' ' ' LEU . 30.9 tp -59.97 -42.78 94.88 Favored 'General case' 0 N--CA 1.508 2.425 0 C-N-CA 119.408 -0.917 . . . . 0.0 109.67 179.711 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.746 ' HA ' HD21 ' A' ' 106' ' ' LEU . 37.0 tp -64.97 -50.44 66.34 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.168 -0.957 . . . . 0.0 108.927 179.529 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 55.9 mt -59.25 -36.04 61.19 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.413 0 O-C-N 121.188 -0.945 . . . . 0.0 108.797 178.593 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -64.53 -44.93 89.29 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.135 -0.978 . . . . 0.0 109.341 178.726 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.507 ' HD3' HD23 ' A' ' 106' ' ' LEU . 8.7 mttp -59.66 -44.68 93.46 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.087 -1.008 . . . . 0.0 109.862 179.163 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.5 m0 -59.04 -35.49 73.4 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.158 -0.964 . . . . 0.0 110.105 179.262 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.435 ' NH1' ' OH ' ' A' ' 64' ' ' TYR . 13.2 mtp85 -85.04 -30.4 24.16 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.07 -1.019 . . . . 0.0 110.513 179.269 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.43 -176.93 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.719 0 O-C-N 120.987 -1.07 . . . . 0.0 110.697 179.865 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 12.0 m -102.23 135.11 44.4 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.208 -0.933 . . . . 0.0 109.594 179.012 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 97.04 10.42 54.92 Favored Glycine 0 N--CA 1.494 2.522 0 O-C-N 121.132 -0.98 . . . . 0.0 111.081 -179.345 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.579 ' HB3' HD23 ' A' ' 103' ' ' LEU . 48.5 m-85 -118.35 71.87 0.85 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 119.339 1.57 . . . . 0.0 109.641 179.576 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -94.62 -33.75 12.88 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.158 -0.964 . . . . 0.0 110.871 -179.804 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.68 77.08 1.77 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.99 -1.069 . . . . 0.0 110.997 -179.49 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.579 HD23 ' HB3' ' A' ' 100' ' ' TYR . 2.3 pp -125.44 159.36 32.1 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.031 -1.043 . . . . 0.0 109.83 179.042 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.441 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.6 p -120.3 -33.06 3.98 Favored 'General case' 0 N--CA 1.501 2.101 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -178.709 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.636 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.3 m -140.27 -168.04 2.45 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 120.056 -1.653 . . . . 0.0 110.254 179.573 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.746 HD21 ' HA ' ' A' ' 91' ' ' LEU . 46.1 mt -95.65 -39.45 9.9 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.166 -0.959 . . . . 0.0 110.069 179.134 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.86 28.26 5.36 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 120.934 -1.104 . . . . 0.0 110.042 178.006 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.636 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.8 t -126.32 15.55 7.75 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.093 -1.004 . . . . 0.0 108.855 -179.669 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.497 HG22 ' HG3' ' A' ' 123' ' ' ARG . 1.2 pt -157.81 36.86 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.292 0 O-C-N 120.803 -1.185 . . . . 0.0 110.55 -178.776 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.599 ' O ' HG23 ' A' ' 119' ' ' THR . 3.5 tt0 -117.58 134.05 55.3 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 120.73 -1.231 . . . . 0.0 111.824 -178.071 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.519 ' HA ' ' HG1' ' A' ' 119' ' ' THR . 9.5 ptpp? -130.86 -170.05 2.28 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.249 -0.907 . . . . 0.0 110.097 179.406 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 60.31 -74.64 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.514 -0.741 . . . . 0.0 111.38 -179.899 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.412 ' N ' ' O ' ' A' ' 111' ' ' LYS . 13.7 mm-40 -112.6 123.83 51.17 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.868 -1.145 . . . . 0.0 110.237 -179.955 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 17.3 p -137.02 -179.82 5.94 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.177 -0.952 . . . . 0.0 110.185 -179.971 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -118.82 -57.05 2.07 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.243 -0.911 . . . . 0.0 110.285 179.995 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -123.42 103.42 8.46 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.128 -0.982 . . . . 0.0 110.205 -179.955 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 98.18 -143.71 16.83 Favored Glycine 0 N--CA 1.493 2.469 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.981 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 14.9 m -145.81 -167.84 2.82 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.234 -1.156 . . . . 0.0 110.359 179.999 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.599 HG23 ' O ' ' A' ' 110' ' ' GLN . 1.5 m -60.6 169.06 1.92 Allowed 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.228 -0.92 . . . . 0.0 109.978 179.908 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 49.3 t -95.2 154.13 17.33 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 119.555 -0.858 . . . . 0.0 109.186 178.913 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.803 HD12 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -71.56 -37.18 62.85 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.441 0 O-C-N 121.115 -0.99 . . . . 0.0 110.987 -179.053 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.455 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 10.8 p -53.97 -34.35 59.49 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 120.932 -1.105 . . . . 0.0 111.127 -178.703 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.497 ' HG3' HG22 ' A' ' 109' ' ' ILE . 10.9 ttp85 -59.53 -34.88 73.18 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 120.966 -1.084 . . . . 0.0 109.542 178.38 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 49.5 t -79.9 124.75 83.07 Favored Pre-proline 0 N--CA 1.505 2.29 0 O-C-N 121.14 -0.975 . . . . 0.0 109.925 179.614 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.628 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.0 Cg_endo -65.13 178.7 1.81 Allowed 'Trans proline' 0 N--CA 1.488 1.205 0 O-C-N 123.113 1.06 . . . . 0.0 110.804 179.517 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.2 mmt85 -75.05 -37.73 61.61 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.233 -0.917 . . . . 0.0 110.489 -179.803 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.64 -42.81 89.18 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.043 -1.035 . . . . 0.0 109.971 -179.752 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -68.79 -41.65 78.44 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.281 -0.968 . . . . 0.0 109.128 179.256 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.628 HD12 ' O ' ' A' ' 125' ' ' PRO . 5.6 mt -64.17 -38.57 91.54 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.172 -0.955 . . . . 0.0 109.701 179.166 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -60.61 -40.15 90.81 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.095 -1.003 . . . . 0.0 109.853 179.765 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -59.62 -37.07 77.64 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.12 -0.987 . . . . 0.0 110.16 179.739 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -60.67 -45.15 95.23 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.114 -0.991 . . . . 0.0 109.843 179.859 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.458 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -62.13 -46.41 89.12 Favored 'General case' 0 N--CA 1.507 2.389 0 C-N-CA 119.337 -0.945 . . . . 0.0 109.687 179.759 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.79 -35.2 74.16 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.192 -0.943 . . . . 0.0 110.11 179.559 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -73.89 -32.64 63.69 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.101 -1.0 . . . . 0.0 110.773 179.887 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 1.4 ttmt -98.87 23.32 9.0 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.944 -1.098 . . . . 0.0 111.685 179.996 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.92 46.73 55.06 Favored Glycine 0 N--CA 1.499 2.873 0 O-C-N 120.69 -1.256 . . . . 0.0 110.702 179.288 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.458 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.8 t -148.79 -165.15 2.2 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.154 -1.204 . . . . 0.0 110.468 179.848 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -131.62 153.52 49.84 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.214 -0.929 . . . . 0.0 110.186 -179.874 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.447 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.1 p -131.55 160.66 42.2 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 O-C-N 121.193 -0.942 . . . . 0.0 110.349 179.964 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 47.7 t -168.57 86.68 0.19 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.232 -0.917 . . . . 0.0 110.744 179.99 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.803 ' CG ' HD12 ' A' ' 121' ' ' ILE . 57.8 t80 -102.47 161.72 13.49 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.181 -0.949 . . . . 0.0 110.821 -179.483 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 3.3 m170 -139.5 -60.96 0.55 Allowed 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 178.995 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -134.86 150.17 50.42 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.339 -0.85 . . . . 0.0 108.774 178.47 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 28.3 p -92.65 154.09 18.58 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.096 -1.042 . . . . 0.0 111.117 -179.42 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.9 p -73.31 -25.19 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 O-C-N 121.39 -0.819 . . . . 0.0 111.475 -179.603 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 61.9 m170 -49.73 -55.79 12.61 Favored 'General case' 0 N--CA 1.516 2.835 0 O-C-N 120.828 -1.17 . . . . 0.0 110.231 -179.875 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 23.1 p -131.55 -163.41 1.32 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.218 -0.926 . . . . 0.0 110.226 179.651 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -102.23 63.47 0.48 Allowed Glycine 0 N--CA 1.492 2.394 0 N-CA-C 108.015 -2.034 . . . . 0.0 108.015 178.4 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 31.6 t -104.01 141.48 36.11 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.362 -1.081 . . . . 0.0 110.162 -178.993 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 6.0 ttt-85 -96.33 53.26 1.31 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.303 -0.873 . . . . 0.0 109.423 178.995 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.23 96.87 0.03 OUTLIER Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.714 -1.355 . . . . 0.0 109.714 -179.857 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.2 p -107.24 127.21 53.33 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.165 -1.197 . . . . 0.0 110.34 179.608 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -152.99 148.82 27.53 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.167 -0.958 . . . . 0.0 110.355 -179.546 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -104.14 -45.89 4.59 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.191 -0.943 . . . . 0.0 110.759 -179.727 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 3.0 m -52.89 -38.57 61.87 Favored 'General case' 0 N--CA 1.513 2.682 0 O-C-N 120.935 -1.103 . . . . 0.0 110.722 -179.742 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 . . . . . 0 N--CA 1.495 1.802 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.223 179.893 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.291 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -74.36 168.82 54.34 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 179.986 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 60.1 p -131.57 93.88 27.44 Favored Pre-proline 0 N--CA 1.495 1.793 0 O-C-N 121.207 -1.173 . . . . 0.0 110.228 179.999 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.59 173.47 13.25 Favored 'Trans proline' 0 C--N 1.317 -1.124 0 O-C-N 123.402 1.211 . . . . 0.0 110.437 179.958 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.7 tpp85 -116.99 130.0 56.4 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.198 -0.939 . . . . 0.0 110.159 -179.991 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 85.1 mt -119.73 92.64 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 O-C-N 121.257 -0.902 . . . . 0.0 110.021 -179.999 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.4 tttt -119.03 98.72 6.32 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.195 -0.941 . . . . 0.0 110.159 179.965 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.6 m -134.46 61.19 1.68 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.183 -0.948 . . . . 0.0 110.19 -179.974 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 80.2 mtt-85 -119.91 40.17 3.48 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.15 -0.969 . . . . 0.0 110.238 179.998 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.2 179.42 4.7 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.181 -0.95 . . . . 0.0 110.057 -179.948 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.0 p -124.59 -167.89 1.73 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.234 -0.916 . . . . 0.0 110.168 -180.0 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 24.7 mmtt -137.7 160.32 65.42 Favored Pre-proline 0 N--CA 1.494 1.739 0 O-C-N 121.25 -0.906 . . . . 0.0 110.35 -179.945 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -73.22 158.28 49.06 Favored 'Trans proline' 0 C--N 1.318 -1.059 0 O-C-N 123.362 1.19 . . . . 0.0 110.543 -179.935 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.663 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -60.41 144.2 88.56 Favored Pre-proline 0 N--CA 1.51 2.566 0 C-N-CA 119.566 -0.854 . . . . 0.0 109.65 179.995 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -72.45 160.41 46.85 Favored 'Trans proline' 0 C--N 1.317 -1.116 0 O-C-N 123.346 1.182 . . . . 0.0 110.722 -179.823 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -49.37 -31.55 9.67 Favored 'General case' 0 N--CA 1.515 2.789 0 O-C-N 121.394 -0.816 . . . . 0.0 111.361 -179.869 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.55 -33.4 40.76 Favored Glycine 0 N--CA 1.498 2.798 0 O-C-N 120.941 -1.099 . . . . 0.0 110.686 179.888 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -55.21 -33.08 62.75 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 120.938 -1.331 . . . . 0.0 110.665 179.939 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -54.16 -37.71 64.73 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 120.981 -1.074 . . . . 0.0 110.325 179.776 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.3 mtpp -59.74 -36.94 77.64 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.227 -0.921 . . . . 0.0 110.201 179.545 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.846 ' O ' HD12 ' A' ' 23' ' ' LEU . 1.6 pt -114.96 33.85 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 O-C-N 121.129 -0.982 . . . . 0.0 110.702 179.759 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.427 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 1.1 ttpt -83.81 -43.21 0.79 Allowed Pre-proline 0 N--CA 1.508 2.469 0 O-C-N 121.005 -1.059 . . . . 0.0 113.102 -179.356 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.3 Cg_endo -75.7 -35.14 2.82 Favored 'Trans proline' 0 N--CA 1.487 1.103 0 O-C-N 122.592 0.785 . . . . 0.0 111.563 -178.448 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.778 HG21 ' CE2' ' A' ' 62' ' ' TYR . 90.5 m -58.48 -41.86 86.21 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 120.948 -1.095 . . . . 0.0 110.05 -179.926 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.846 HD12 ' O ' ' A' ' 19' ' ' ILE . 5.0 mt -68.18 -41.3 81.64 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.514 -0.874 . . . . 0.0 109.297 179.398 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.3 m -60.42 -33.95 73.26 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.168 -0.958 . . . . 0.0 109.845 178.926 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -55.57 -34.96 65.24 Favored 'General case' 0 N--CA 1.511 2.579 0 O-C-N 121.01 -1.056 . . . . 0.0 110.198 179.465 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.714 ' CD2' HD22 ' A' ' 55' ' ' LEU . 15.7 m-85 -55.32 -35.79 65.52 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.103 -0.998 . . . . 0.0 110.516 179.704 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -57.16 -38.19 73.2 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.095 -1.003 . . . . 0.0 110.647 -179.628 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.427 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.2 mp -66.36 -40.81 87.66 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 C-N-CA 119.316 -0.954 . . . . 0.0 109.158 179.725 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -70.32 -46.87 63.35 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.125 -0.985 . . . . 0.0 108.784 178.97 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.141 HD11 HG23 ' A' ' 52' ' ' ILE . 2.2 tp -62.07 -35.54 78.94 Favored 'General case' 0 N--CA 1.507 2.419 0 C-N-CA 119.377 -0.929 . . . . 0.0 109.305 178.555 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.92 -36.08 69.78 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.106 -0.996 . . . . 0.0 110.391 179.699 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -62.88 -52.4 63.23 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.054 -1.029 . . . . 0.0 109.458 -179.883 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.535 ' HB1' ' HG2' ' A' ' 48' ' ' GLN . . . -68.91 -41.96 77.48 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 119.042 -1.063 . . . . 0.0 108.589 178.809 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -60.45 -32.42 71.36 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.22 -0.925 . . . . 0.0 110.187 179.309 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 41.8 mtpt -93.6 -30.16 15.1 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 120.939 -1.1 . . . . 0.0 111.037 179.952 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -54.54 -35.78 63.59 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 120.861 -1.15 . . . . 0.0 110.407 -179.947 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.2 ttpt -55.79 -48.55 75.16 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.007 -1.058 . . . . 0.0 110.316 -179.965 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 53.04 -179.95 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.073 -1.017 . . . . 0.0 110.912 179.959 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.0 t -117.61 161.26 19.93 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.105 -0.997 . . . . 0.0 110.092 179.994 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 31.2 mtpt 52.11 38.52 24.43 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.091 -1.006 . . . . 0.0 110.803 -179.826 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.4 tp -128.15 -57.0 1.24 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.234 -0.916 . . . . 0.0 110.475 -179.753 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 53.96 95.62 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.043 -1.036 . . . . 0.0 110.865 -179.735 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -173.48 103.92 0.12 Allowed 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.289 -0.882 . . . . 0.0 110.604 179.85 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 30.2 mtmt 51.81 60.98 3.46 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.037 -1.039 . . . . 0.0 110.496 -179.719 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.5 m -96.14 -39.32 9.76 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.235 -0.915 . . . . 0.0 110.616 -179.819 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -61.34 -40.88 95.89 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.112 -0.992 . . . . 0.0 109.66 179.99 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -61.03 -39.45 89.81 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.217 -0.927 . . . . 0.0 109.788 179.455 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.535 ' HG2' ' HB1' ' A' ' 33' ' ' ALA . 0.3 OUTLIER -59.44 -44.59 92.9 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.187 -0.946 . . . . 0.0 109.53 179.694 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.466 HD23 ' HA ' ' A' ' 49' ' ' LEU . 20.8 mt -59.41 -35.97 74.97 Favored 'General case' 0 N--CA 1.508 2.449 0 C-N-CA 119.318 -0.953 . . . . 0.0 110.296 -179.736 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.536 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.1 m0 -54.0 -38.62 65.28 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 120.885 -1.135 . . . . 0.0 109.52 179.195 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -67.83 -37.27 81.71 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.328 -0.857 . . . . 0.0 109.553 178.817 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 1.141 HG23 HD11 ' A' ' 30' ' ' LEU . 16.6 mt -66.97 -42.84 89.27 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.329 0 O-C-N 121.038 -1.039 . . . . 0.0 109.42 179.604 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.457 ' CE ' ' HB3' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -68.68 -29.44 67.9 Favored 'General case' 0 N--CA 1.502 2.166 0 C-N-CA 118.66 -1.216 . . . . 0.0 109.864 179.285 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.427 ' N ' ' HG3' ' A' ' 53' ' ' MET . 23.4 mt-30 -66.24 -37.69 86.12 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.997 -1.065 . . . . 0.0 109.282 178.896 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.714 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.6 mt -52.77 -32.83 45.68 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.013 -1.054 . . . . 0.0 109.959 179.187 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.435 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 8.4 t60 -56.93 -37.27 71.25 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.058 -1.026 . . . . 0.0 109.966 179.247 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.44 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 5.5 m170 -59.42 -49.35 78.15 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.097 -1.002 . . . . 0.0 109.103 179.215 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -58.78 -35.99 73.69 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.305 -0.872 . . . . 0.0 109.43 178.856 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.459 ' HD3' ' CD1' ' A' ' 26' ' ' PHE . 32.6 mmm-85 -62.81 -51.98 64.97 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.159 -0.963 . . . . 0.0 109.078 178.978 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.443 ' HA ' ' HB1' ' A' ' 87' ' ' ALA . 92.9 p -63.7 -39.23 93.79 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.237 -0.914 . . . . 0.0 109.127 179.262 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 58.7 ttt-85 -64.48 -37.88 89.06 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 121.094 -1.004 . . . . 0.0 109.634 179.195 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.778 ' CE2' HG21 ' A' ' 22' ' ' THR . 48.3 t80 -62.3 -49.54 75.22 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.075 -1.016 . . . . 0.0 109.485 179.528 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.905 HD12 ' HB2' ' A' ' 87' ' ' ALA . 86.9 mt -75.43 -40.62 42.25 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.328 0 O-C-N 121.168 -0.957 . . . . 0.0 109.313 179.382 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.481 ' CE1' HG23 ' A' ' 92' ' ' ILE . 38.6 t80 -63.03 -22.06 66.59 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.202 -0.937 . . . . 0.0 110.551 178.758 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 87.4 m -90.78 -35.51 14.81 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 120.665 -1.272 . . . . 0.0 110.39 179.751 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.531 ' C ' HD12 ' A' ' 66' ' ' LEU . 3.7 pp -82.87 -31.95 27.67 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.917 -1.114 . . . . 0.0 112.207 -179.246 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.467 ' N ' HD12 ' A' ' 66' ' ' LEU . 40.3 t80 -86.13 -38.01 18.18 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 120.657 -1.277 . . . . 0.0 111.271 -179.477 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.403 ' CD2' ' CD1' ' A' ' 64' ' ' TYR . 17.2 m-85 -89.65 -21.93 22.53 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.896 -1.128 . . . . 0.0 112.614 -178.663 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.7 mttm -119.58 -61.07 1.66 Allowed 'General case' 0 N--CA 1.501 2.093 0 O-C-N 120.466 -1.396 . . . . 0.0 111.211 -179.671 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.408 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 0.2 OUTLIER -58.81 -30.65 67.78 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.113 -0.992 . . . . 0.0 110.808 -179.502 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.0 ttmm 57.28 41.59 26.48 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 120.852 -1.155 . . . . 0.0 110.023 -179.498 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.14 35.64 3.87 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.425 -0.797 . . . . 0.0 109.871 179.288 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.81 HG13 HD23 ' A' ' 77' ' ' LEU . 14.1 tt -155.29 162.14 1.89 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.197 -0.939 . . . . 0.0 109.918 -179.975 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.1 148.92 30.09 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.105 -0.997 . . . . 0.0 110.245 179.966 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -46.38 -32.29 3.12 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 121.35 -0.843 . . . . 0.0 111.553 179.97 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -62.02 -50.55 71.57 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 120.843 -1.16 . . . . 0.0 109.349 179.427 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.81 HD23 HG13 ' A' ' 73' ' ' ILE . 54.4 tp -66.37 -45.4 80.25 Favored 'General case' 0 N--CA 1.506 2.336 0 C-N-CA 119.141 -1.024 . . . . 0.0 108.465 178.818 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.588 ' HA ' HD12 ' A' ' 81' ' ' LEU . 18.4 t80 -59.78 -38.26 81.36 Favored 'General case' 0 N--CA 1.506 2.331 0 C-N-CA 119.694 -0.802 . . . . 0.0 109.551 179.112 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -73.75 -42.43 61.11 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.102 -0.999 . . . . 0.0 108.764 178.726 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.663 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 72.1 t90 -57.88 -36.12 71.93 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.228 -0.92 . . . . 0.0 109.772 178.943 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.588 HD12 ' HA ' ' A' ' 78' ' ' TYR . 11.9 mt -69.56 -50.28 46.29 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.119 -0.988 . . . . 0.0 108.84 179.213 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.448 HG21 ' HG3' ' A' ' 89' ' ' LYS . 35.5 mm -57.16 -30.88 35.88 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.639 0 O-C-N 121.205 -0.934 . . . . 0.0 110.117 179.362 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -89.18 -20.87 23.68 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 120.886 -1.134 . . . . 0.0 112.159 -179.549 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.45 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 77.9 mm-40 -101.63 22.19 13.17 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 120.659 -1.276 . . . . 0.0 112.08 -179.767 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 73.46 77.75 0.13 Allowed 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.05 -1.031 . . . . 0.0 111.659 179.079 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.516 ' HE2' HD13 ' A' ' 23' ' ' LEU . 29.0 m-85 -134.64 -64.71 0.66 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.553 -0.717 . . . . 0.0 109.468 179.721 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.905 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -120.63 -174.06 2.72 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.378 -0.826 . . . . 0.0 109.513 179.336 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.435 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 5.9 t0 -124.7 102.86 7.8 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.165 -0.96 . . . . 0.0 110.348 -179.878 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.448 ' HG3' HG21 ' A' ' 82' ' ' ILE . 4.2 mmmt -60.22 -40.28 89.6 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.226 -0.921 . . . . 0.0 109.806 179.646 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.2 tp -60.33 -37.85 81.89 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 121.204 -0.935 . . . . 0.0 110.045 179.829 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.689 HD21 ' CH2' ' A' ' 95' ' ' TRP . 45.2 tp -70.63 -49.3 49.01 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.078 -1.014 . . . . 0.0 108.813 179.179 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.481 HG23 ' CE1' ' A' ' 64' ' ' TYR . 34.5 mt -59.0 -34.03 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 121.255 -0.903 . . . . 0.0 109.098 178.556 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.12 -46.64 76.84 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.089 -1.007 . . . . 0.0 109.356 178.933 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.512 ' HD3' HD23 ' A' ' 106' ' ' LEU . 10.9 mttp -60.5 -44.36 96.06 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.129 -0.982 . . . . 0.0 109.804 179.32 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.689 ' CH2' HD21 ' A' ' 91' ' ' LEU . 3.3 m0 -58.66 -28.66 65.92 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.086 -1.009 . . . . 0.0 109.966 178.926 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.405 ' CD ' ' OH ' ' A' ' 64' ' ' TYR . 0.0 OUTLIER -99.69 22.53 10.81 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 120.939 -1.101 . . . . 0.0 110.886 178.676 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -109.41 -174.28 2.47 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.732 -1.23 . . . . 0.0 109.851 179.366 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 29.2 m -104.6 137.8 41.9 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.214 -0.929 . . . . 0.0 109.441 179.149 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 102.2 -25.77 26.6 Favored Glycine 0 N--CA 1.493 2.496 0 C-N-CA 119.815 -1.184 . . . . 0.0 110.2 -179.004 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.679 ' HB3' HD23 ' A' ' 103' ' ' LEU . 73.4 m-85 -92.37 58.63 3.25 Favored 'General case' 0 N--CA 1.504 2.258 0 CA-C-N 119.009 1.404 . . . . 0.0 109.994 179.771 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -72.88 -37.64 67.26 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.006 -1.059 . . . . 0.0 110.2 179.909 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.87 82.67 2.1 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.039 -1.038 . . . . 0.0 110.47 179.949 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.679 HD23 ' HB3' ' A' ' 100' ' ' TYR . 0.6 OUTLIER -119.71 148.36 43.48 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.168 -0.958 . . . . 0.0 110.349 179.759 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.44 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.1 p -113.03 -26.66 8.37 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.163 -0.96 . . . . 0.0 113.374 -179.516 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.671 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 11.4 m -143.48 -167.31 2.54 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 120.068 -1.645 . . . . 0.0 109.642 179.065 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.512 HD23 ' HD3' ' A' ' 94' ' ' LYS . 14.4 mt -97.15 -38.28 9.78 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.103 -0.998 . . . . 0.0 110.306 179.224 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 22.7 ttt85 -102.98 31.83 4.02 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 120.893 -1.129 . . . . 0.0 109.678 178.153 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.671 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.308 1.7 t -127.71 16.53 6.93 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.154 -0.966 . . . . 0.0 108.953 -179.257 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.491 HG22 ' HG3' ' A' ' 123' ' ' ARG . 1.1 pt -159.25 38.06 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 120.947 -1.095 . . . . 0.0 110.628 -178.545 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.511 ' C ' HG23 ' A' ' 119' ' ' THR . 1.5 mm-40 -113.52 129.11 56.62 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 120.749 -1.22 . . . . 0.0 111.321 -178.49 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 4.5 ptpt -126.62 161.77 27.28 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.2 -0.937 . . . . 0.0 110.215 179.36 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -149.92 -57.4 0.19 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.161 -0.962 . . . . 0.0 110.713 179.945 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -133.84 -166.82 1.84 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.086 -1.009 . . . . 0.0 110.113 -179.943 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 80.9 p -94.93 -37.29 11.24 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.143 -0.973 . . . . 0.0 110.532 179.825 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -105.69 144.06 32.97 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.012 -1.055 . . . . 0.0 109.975 179.747 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 53.5 49.14 20.18 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 120.996 -1.065 . . . . 0.0 110.613 -179.78 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -92.4 -167.64 39.72 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 -180.0 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 66.1 m -148.2 60.16 1.1 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.202 -1.175 . . . . 0.0 110.506 -179.881 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.511 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.9 OUTLIER -119.65 172.85 7.38 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.078 -1.014 . . . . 0.0 110.26 179.755 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.415 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 48.9 t -106.7 155.02 20.11 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.405 -0.81 . . . . 0.0 109.531 179.231 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.783 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -72.74 -35.72 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.395 0 O-C-N 121.081 -1.012 . . . . 0.0 111.255 -179.172 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.491 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 11.0 p -54.21 -31.86 54.2 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.805 -1.185 . . . . 0.0 111.298 -178.861 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.491 ' HG3' HG22 ' A' ' 109' ' ' ILE . 6.7 ttp85 -58.22 -32.86 68.71 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 120.929 -1.107 . . . . 0.0 109.798 178.375 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 60.8 t -81.87 125.24 78.21 Favored Pre-proline 0 N--CA 1.506 2.328 0 O-C-N 121.124 -0.985 . . . . 0.0 109.923 179.68 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.541 ' HD3' ' HB1' ' A' ' 154' ' ' ALA . 39.0 Cg_endo -66.65 178.99 2.35 Favored 'Trans proline' 0 N--CA 1.488 1.152 0 O-C-N 123.097 1.051 . . . . 0.0 110.551 179.407 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -75.17 -37.77 61.15 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.184 -0.948 . . . . 0.0 110.513 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.06 -41.12 82.64 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.001 -1.062 . . . . 0.0 110.097 -179.732 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -66.91 -41.78 86.5 Favored 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.319 179.494 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.572 HD11 HD11 ' A' ' 121' ' ' ILE . 2.4 mt -63.27 -39.97 96.09 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.226 -0.922 . . . . 0.0 109.693 179.561 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -60.1 -38.31 82.58 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.19 -0.943 . . . . 0.0 109.993 179.782 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -57.79 -36.12 71.75 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.072 -1.018 . . . . 0.0 110.381 179.802 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.36 -49.56 73.39 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.072 -1.017 . . . . 0.0 109.754 179.902 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.704 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -62.11 -38.95 90.85 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.148 -0.97 . . . . 0.0 109.797 179.754 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 43.4 ttp85 -66.78 -35.53 80.31 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.155 -0.966 . . . . 0.0 110.452 179.771 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 25.4 mttm -86.84 -35.04 19.28 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.048 -1.032 . . . . 0.0 110.479 179.86 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 16.8 mttm -80.96 -22.55 39.46 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.086 -1.009 . . . . 0.0 111.472 179.692 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.83 32.91 9.48 Favored Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.673 -1.371 . . . . 0.0 109.673 -179.537 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.704 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.1 t -135.9 -161.22 1.13 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.054 -1.262 . . . . 0.0 109.792 179.946 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -130.85 143.08 50.47 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.07 -1.018 . . . . 0.0 109.959 179.944 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.491 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.1 p -129.85 160.2 41.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.216 -0.927 . . . . 0.0 110.373 -179.981 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 43.6 t -169.94 87.83 0.15 Allowed 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.261 -0.9 . . . . 0.0 111.031 179.96 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.748 ' CG ' HD12 ' A' ' 121' ' ' ILE . 62.3 t80 -99.68 159.81 14.77 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.187 -0.945 . . . . 0.0 110.491 -179.882 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -138.26 -59.76 0.63 Allowed 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 179.015 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -139.47 151.07 45.9 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.341 -0.849 . . . . 0.0 109.05 178.778 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 29.7 p -91.73 154.49 18.93 Favored 'General case' 0 N--CA 1.505 2.282 0 C-N-CA 119.05 -1.06 . . . . 0.0 111.093 -179.502 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.9 p -72.58 -26.26 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 O-C-N 121.379 -0.826 . . . . 0.0 111.57 -179.455 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -51.05 -51.74 50.23 Favored 'General case' 0 N--CA 1.516 2.839 0 O-C-N 120.764 -1.21 . . . . 0.0 110.195 -179.955 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.536 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 31.8 p -135.0 -169.03 2.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.237 -0.914 . . . . 0.0 111.121 179.764 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -98.39 60.97 0.9 Allowed Glycine 0 N--CA 1.491 2.329 0 N-CA-C 107.756 -2.138 . . . . 0.0 107.756 178.366 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 20.8 t -100.98 143.24 31.36 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.39 -1.065 . . . . 0.0 109.971 -179.021 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 50.5 mtm-85 -97.16 51.94 1.12 Allowed 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.237 -0.914 . . . . 0.0 109.308 179.046 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.41 96.72 0.03 OUTLIER Glycine 0 N--CA 1.487 2.095 0 N-CA-C 109.746 -1.342 . . . . 0.0 109.746 -179.726 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.0 p -106.65 125.24 50.76 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.19 -1.182 . . . . 0.0 110.258 179.67 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 154' ' ' ALA . . . . . 0.541 ' HB1' ' HD3' ' A' ' 125' ' ' PRO . . . -149.28 151.3 33.97 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.199 -0.938 . . . . 0.0 110.162 -179.622 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 4.9 m -97.09 -40.68 8.71 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.326 -0.859 . . . . 0.0 110.48 -179.892 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 3.3 m -58.31 -39.43 79.33 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 121.081 -1.012 . . . . 0.0 110.408 -179.961 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 . . . . . 0 N--CA 1.494 1.769 0 CA-C-O 117.962 -1.018 . . . . 0.0 110.147 179.976 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.256 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -110.28 -158.65 16.76 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.944 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.64 154.96 50.98 Favored Pre-proline 0 N--CA 1.493 1.702 0 O-C-N 121.151 -1.205 . . . . 0.0 110.32 179.901 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.71 134.03 21.31 Favored 'Trans proline' 0 C--N 1.318 -1.075 0 O-C-N 123.396 1.208 . . . . 0.0 110.467 179.991 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.4 ttm-85 -120.82 84.47 2.23 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.196 -0.94 . . . . 0.0 110.23 179.995 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 83.8 mt -131.17 139.85 49.95 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.15 -0.969 . . . . 0.0 110.0 -179.925 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.2 tptt -129.46 120.44 25.45 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.287 -0.883 . . . . 0.0 110.216 -179.998 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.7 p -130.43 132.72 45.86 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.227 -0.921 . . . . 0.0 110.265 179.977 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.42 94.28 4.49 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.287 -0.883 . . . . 0.0 110.241 -179.99 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 mmt85 -117.46 140.13 50.0 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.185 -0.947 . . . . 0.0 110.209 179.895 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.6 m -135.85 -175.14 3.86 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.149 -0.969 . . . . 0.0 110.191 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.4 pttt -152.58 61.0 3.66 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.201 -0.937 . . . . 0.0 110.713 -179.941 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -72.14 158.93 51.14 Favored 'Trans proline' 0 C--N 1.317 -1.113 0 O-C-N 123.226 1.119 . . . . 0.0 110.482 179.82 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.66 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -85.53 143.31 38.44 Favored Pre-proline 0 N--CA 1.504 2.273 0 O-C-N 121.284 -0.885 . . . . 0.0 109.781 179.738 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.403 ' HG2' HD13 ' A' ' 77' ' ' LEU . 45.0 Cg_endo -71.49 162.52 42.0 Favored 'Trans proline' 0 C--N 1.317 -1.081 0 O-C-N 123.273 1.144 . . . . 0.0 110.801 -179.611 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -48.96 -31.76 7.95 Favored 'General case' 0 N--CA 1.515 2.803 0 O-C-N 121.433 -0.792 . . . . 0.0 111.318 -179.874 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.0 -35.11 39.96 Favored Glycine 0 N--CA 1.499 2.873 0 O-C-N 120.951 -1.093 . . . . 0.0 110.388 179.801 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -54.88 -32.44 60.86 Favored 'General case' 0 N--CA 1.512 2.664 0 O-C-N 121.013 -1.286 . . . . 0.0 110.617 179.626 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -54.11 -37.86 64.76 Favored 'General case' 0 N--CA 1.512 2.662 0 O-C-N 121.01 -1.056 . . . . 0.0 110.244 179.823 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.6 mmtp -58.86 -37.93 77.61 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.28 -0.887 . . . . 0.0 110.107 179.59 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.887 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.0 pt -114.4 33.51 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 O-C-N 121.237 -0.914 . . . . 0.0 110.544 179.458 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.423 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 5.7 tmtt? -83.6 -43.57 0.81 Allowed Pre-proline 0 N--CA 1.508 2.466 0 O-C-N 121.005 -1.059 . . . . 0.0 113.019 -179.171 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.4 Cg_endo -76.63 -35.6 1.98 Allowed 'Trans proline' 0 N--CA 1.486 1.069 0 O-C-N 122.545 0.76 . . . . 0.0 111.434 -178.485 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.773 HG21 ' CE2' ' A' ' 62' ' ' TYR . 91.5 m -59.22 -42.32 90.71 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 120.98 -1.075 . . . . 0.0 110.042 -179.752 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.887 HD12 ' O ' ' A' ' 19' ' ' ILE . 4.3 mt -65.73 -40.51 92.23 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.225 -0.922 . . . . 0.0 109.574 179.516 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -59.58 -35.87 75.13 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.145 -0.972 . . . . 0.0 110.048 179.287 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -56.49 -36.4 69.1 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 121.019 -1.05 . . . . 0.0 110.315 179.707 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.52 ' CE1' HD12 ' A' ' 55' ' ' LEU . 12.1 m-85 -57.39 -35.76 70.42 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.162 -0.961 . . . . 0.0 110.877 -179.964 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -61.62 -38.56 88.1 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.092 -1.005 . . . . 0.0 111.006 -179.145 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.414 ' H ' HD12 ' A' ' 28' ' ' ILE . 2.9 mp -62.82 -39.36 84.63 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.499 0 C-N-CA 119.038 -1.065 . . . . 0.0 109.35 -179.989 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.5 tp60 -68.82 -54.63 14.69 Favored 'General case' 0 N--CA 1.506 2.366 0 C-N-CA 119.106 -1.037 . . . . 0.0 108.661 178.9 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.833 HD21 HG23 ' A' ' 52' ' ' ILE . 0.1 OUTLIER -58.72 -33.96 70.8 Favored 'General case' 0 N--CA 1.511 2.616 0 O-C-N 121.193 -0.942 . . . . 0.0 109.342 178.407 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -57.8 -41.94 83.17 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.004 -1.06 . . . . 0.0 109.98 179.655 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 -63.18 -49.91 72.41 Favored 'General case' 0 N--CA 1.508 2.453 0 C-N-CA 119.135 -1.026 . . . . 0.0 109.411 -179.982 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.486 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -64.78 -40.22 94.91 Favored 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 119.306 -0.958 . . . . 0.0 109.179 179.051 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -58.38 -34.16 70.41 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.238 -0.914 . . . . 0.0 110.348 179.707 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 17.5 mmtm -93.59 -38.68 11.24 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.048 -1.032 . . . . 0.0 110.45 179.879 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -58.23 -34.64 70.64 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.139 -0.976 . . . . 0.0 110.531 179.992 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.8 ttpp -83.01 -37.13 24.38 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 120.959 -1.088 . . . . 0.0 110.457 179.992 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.8 p -74.53 -37.93 62.91 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.092 -1.005 . . . . 0.0 110.23 179.819 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 43.8 m -71.42 -38.87 71.37 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.104 -0.997 . . . . 0.0 110.042 179.743 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -113.75 128.28 56.36 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.145 -0.972 . . . . 0.0 110.157 179.814 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.6 tp -129.81 58.26 1.65 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.206 -0.934 . . . . 0.0 110.231 -179.9 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -138.8 -65.27 0.5 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.122 -0.987 . . . . 0.0 110.232 179.954 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -126.48 169.73 12.72 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.246 -0.909 . . . . 0.0 110.238 179.996 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.1 ttpt 52.71 55.58 8.82 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.082 -1.012 . . . . 0.0 110.758 179.97 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 43.1 m -111.31 -53.94 2.65 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.244 -0.91 . . . . 0.0 110.364 179.958 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.402 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 85.8 m-20 -56.82 -39.79 74.82 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.169 -0.957 . . . . 0.0 109.951 179.739 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -60.15 -39.29 85.83 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.243 -0.911 . . . . 0.0 109.98 179.633 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 35.5 tp60 -63.76 -46.56 84.74 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.146 -0.971 . . . . 0.0 109.788 179.858 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.522 HD23 HD12 ' A' ' 52' ' ' ILE . 51.0 mt -60.88 -35.08 75.69 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.188 -0.945 . . . . 0.0 110.339 179.94 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.441 ' CE3' ' HA2' ' A' ' 149' ' ' GLY . 41.2 m0 -58.31 -39.64 79.93 Favored 'General case' 0 N--CA 1.511 2.579 0 O-C-N 120.973 -1.079 . . . . 0.0 109.675 179.623 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.813 ' O ' HD22 ' A' ' 55' ' ' LEU . 21.6 tt0 -63.62 -33.15 74.98 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 119.165 -1.014 . . . . 0.0 109.334 178.186 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.833 HG23 HD21 ' A' ' 30' ' ' LEU . 66.9 mt -70.6 -58.52 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.247 0 O-C-N 121.054 -1.029 . . . . 0.0 109.301 179.303 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.01 -25.18 63.44 Favored 'General case' 0 N--CA 1.511 2.616 0 C-N-CA 118.309 -1.356 . . . . 0.0 110.15 178.77 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.4 mm-40 -65.6 -38.84 90.62 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.795 -1.191 . . . . 0.0 109.396 178.495 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.813 HD22 ' O ' ' A' ' 51' ' ' GLU . 0.2 OUTLIER -54.86 -32.56 60.86 Favored 'General case' 0 N--CA 1.512 2.675 0 O-C-N 120.952 -1.093 . . . . 0.0 110.084 179.308 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.437 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 13.7 t60 -57.5 -40.83 79.54 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.013 -1.054 . . . . 0.0 110.052 -179.666 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.55 ' NE2' HD21 ' A' ' 91' ' ' LEU . 4.8 m170 -64.23 -53.17 53.3 Favored 'General case' 0 N--CA 1.508 2.444 0 C-N-CA 119.338 -0.945 . . . . 0.0 109.342 179.33 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 5.2 tp60 -57.24 -35.08 69.26 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.265 -0.897 . . . . 0.0 109.878 179.547 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.449 ' HG2' ' CE1' ' A' ' 26' ' ' PHE . 1.1 mmt85 -66.44 -49.25 67.32 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.179 -0.951 . . . . 0.0 109.28 179.157 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 84.0 p -64.26 -40.3 95.72 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.187 -0.945 . . . . 0.0 109.152 179.216 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.42 ' O ' ' OG1' ' A' ' 65' ' ' THR . 11.8 ttt85 -62.4 -39.65 93.94 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.155 -0.966 . . . . 0.0 109.413 179.076 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.773 ' CE2' HG21 ' A' ' 22' ' ' THR . 34.2 t80 -62.14 -51.2 68.81 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.094 -1.003 . . . . 0.0 109.431 179.403 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.992 HD12 ' HB2' ' A' ' 87' ' ' ALA . 79.5 mt -70.3 -36.98 69.56 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.341 0 O-C-N 121.18 -0.95 . . . . 0.0 109.449 179.342 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.441 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 10.2 t80 -67.09 -42.26 84.91 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.03 -1.044 . . . . 0.0 108.933 178.97 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.42 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 89.4 m -60.72 -41.08 94.56 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.177 -0.952 . . . . 0.0 110.181 179.91 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.617 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.8 pp -83.1 -36.72 24.61 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.997 -1.064 . . . . 0.0 112.407 -179.081 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.608 ' N ' HD12 ' A' ' 66' ' ' LEU . 51.6 t80 -86.7 -35.06 19.5 Favored 'General case' 0 N--CA 1.512 2.641 0 O-C-N 120.519 -1.363 . . . . 0.0 111.817 -179.508 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.441 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 6.9 m-85 -98.3 -3.51 37.07 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 120.851 -1.155 . . . . 0.0 113.2 -178.474 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.91 -58.98 0.61 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.326 -1.484 . . . . 0.0 110.762 179.502 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.412 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 9.5 ttt85 -62.89 -29.54 70.84 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.048 -1.032 . . . . 0.0 110.722 179.987 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.7 mttt 60.16 43.71 13.77 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.801 -1.187 . . . . 0.0 109.966 -179.569 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.16 37.47 3.67 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.322 -0.861 . . . . 0.0 109.806 179.322 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.769 HG13 HD23 ' A' ' 77' ' ' LEU . 14.4 tt -156.95 162.64 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.165 -0.959 . . . . 0.0 110.221 -179.821 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -110.82 147.97 33.38 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.19 -0.944 . . . . 0.0 110.09 179.554 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -45.17 -32.68 1.95 Allowed 'General case' 0 N--CA 1.517 2.878 0 O-C-N 121.361 -0.837 . . . . 0.0 111.7 -179.779 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -62.14 -49.82 74.34 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 120.978 -1.076 . . . . 0.0 109.494 179.685 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.769 HD23 HG13 ' A' ' 73' ' ' ILE . 31.3 tp -66.54 -46.44 76.1 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.14 -1.024 . . . . 0.0 108.688 179.052 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.443 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 18.9 t80 -60.65 -37.26 80.94 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.3 -0.875 . . . . 0.0 109.535 179.143 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -72.78 -42.76 63.62 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.06 -1.025 . . . . 0.0 108.936 178.986 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.66 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 79.8 t90 -58.48 -36.43 73.72 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.312 -0.867 . . . . 0.0 109.757 179.094 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.678 HD22 ' CD2' ' A' ' 86' ' ' TYR . 30.7 mt -69.28 -47.45 64.56 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.079 -1.013 . . . . 0.0 109.037 179.45 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.2 mm -57.68 -32.91 43.67 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.588 0 O-C-N 121.18 -0.95 . . . . 0.0 110.151 179.231 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.33 -22.33 28.54 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 120.951 -1.093 . . . . 0.0 111.747 -179.886 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.439 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 10.5 mm-40 -100.35 20.29 15.08 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 120.752 -1.217 . . . . 0.0 112.046 179.956 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 71.3 tttt 72.7 83.06 0.13 Allowed 'General case' 0 N--CA 1.51 2.536 0 O-C-N 120.974 -1.079 . . . . 0.0 111.29 179.393 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.678 ' CD2' HD22 ' A' ' 81' ' ' LEU . 28.0 m-85 -139.32 -63.69 0.51 Allowed 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.509 -0.745 . . . . 0.0 110.117 -179.385 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.992 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -114.68 -171.77 1.99 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.395 -0.815 . . . . 0.0 110.147 179.877 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.437 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 21.2 t0 -123.17 102.88 8.21 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.158 -0.964 . . . . 0.0 110.263 -179.839 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.11 -40.41 74.92 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.159 -0.963 . . . . 0.0 109.892 179.753 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.695 HD23 HD13 ' A' ' 106' ' ' LEU . 20.7 tp -62.52 -46.6 87.67 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.156 -0.965 . . . . 0.0 109.611 179.71 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.581 ' HA ' HD21 ' A' ' 106' ' ' LEU . 65.9 tp -65.81 -44.88 84.33 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.261 -0.975 . . . . 0.0 108.947 179.216 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 54.1 mt -58.28 -36.5 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.508 0 O-C-N 121.149 -0.969 . . . . 0.0 108.74 178.654 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.65 -40.21 96.29 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.086 -1.009 . . . . 0.0 109.269 178.733 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.441 ' HD2' ' CZ ' ' A' ' 100' ' ' TYR . 5.2 mmtm -59.15 -47.97 83.34 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.085 -1.009 . . . . 0.0 109.393 179.295 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.9 m0 -59.13 -33.19 70.59 Favored 'General case' 0 N--CA 1.508 2.466 0 C-N-CA 119.542 -0.863 . . . . 0.0 110.301 179.591 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.36 -30.68 30.17 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.053 -1.03 . . . . 0.0 110.851 179.547 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.1 mmtt -53.69 -176.95 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.738 0 O-C-N 120.959 -1.088 . . . . 0.0 110.674 -179.972 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -103.36 134.71 46.28 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.126 -0.984 . . . . 0.0 109.699 179.207 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 95.77 11.19 55.64 Favored Glycine 0 N--CA 1.493 2.475 0 C-N-CA 120.172 -1.013 . . . . 0.0 111.094 -179.465 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.603 ' HB3' HD23 ' A' ' 103' ' ' LEU . 47.8 m-85 -117.82 71.22 0.81 Allowed 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 119.405 1.602 . . . . 0.0 109.876 179.738 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -95.21 -36.16 11.56 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.129 -0.982 . . . . 0.0 110.666 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.65 72.88 1.09 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.025 -1.047 . . . . 0.0 110.736 -179.577 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.603 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.0 OUTLIER -122.24 154.73 37.13 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.032 -1.043 . . . . 0.0 109.945 179.449 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.435 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.7 p -116.11 -31.45 5.68 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -179.15 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.614 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.6 m -141.71 -167.87 2.53 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 120.119 -1.613 . . . . 0.0 109.961 179.257 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.695 HD13 HD23 ' A' ' 90' ' ' LEU . 20.1 mt -95.92 -38.99 10.02 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.12 -0.987 . . . . 0.0 109.929 179.139 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -101.86 28.48 5.66 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 120.969 -1.082 . . . . 0.0 109.999 178.055 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.614 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.297 1.8 t -126.96 15.02 7.4 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.086 -1.009 . . . . 0.0 109.351 -179.631 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.474 HG23 ' O ' ' A' ' 108' ' ' CYS . 1.0 OUTLIER -159.48 37.54 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.375 0 O-C-N 120.832 -1.167 . . . . 0.0 111.018 -178.71 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.564 ' O ' HG23 ' A' ' 119' ' ' THR . 0.8 OUTLIER -130.05 142.42 50.62 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.643 -1.285 . . . . 0.0 111.652 -178.987 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.522 ' HA ' ' HG1' ' A' ' 119' ' ' THR . 18.0 ptpt -137.54 -172.26 3.18 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.198 -0.939 . . . . 0.0 110.081 179.811 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -147.97 -58.88 0.25 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.172 -0.955 . . . . 0.0 110.442 179.975 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -141.61 -162.84 1.45 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.203 -0.936 . . . . 0.0 109.918 -179.83 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 12.9 p -84.11 -38.05 21.23 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.044 -1.035 . . . . 0.0 110.14 179.79 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -111.37 155.72 22.68 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.181 -0.95 . . . . 0.0 110.037 179.789 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 53.22 49.65 19.43 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.17 -0.956 . . . . 0.0 110.684 -179.89 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -107.97 177.56 21.1 Favored Glycine 0 N--CA 1.493 2.479 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 -179.964 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 19.3 m -145.58 80.48 1.59 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.193 -1.181 . . . . 0.0 110.475 -179.961 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.564 HG23 ' O ' ' A' ' 110' ' ' GLN . 2.4 m -130.11 170.03 14.55 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.187 -0.946 . . . . 0.0 110.042 179.912 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.438 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 49.5 t -100.67 155.09 18.08 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.2 -0.937 . . . . 0.0 109.526 179.262 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.804 HD12 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -71.4 -37.07 63.47 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.37 0 O-C-N 121.102 -0.999 . . . . 0.0 110.877 -179.444 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.46 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 11.2 p -53.57 -33.36 54.52 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 120.89 -1.131 . . . . 0.0 111.22 -178.824 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.438 ' HG2' HG22 ' A' ' 109' ' ' ILE . 0.0 OUTLIER -60.61 -34.4 74.19 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.051 -1.031 . . . . 0.0 109.539 178.35 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 47.2 t -80.64 125.34 80.78 Favored Pre-proline 0 N--CA 1.504 2.271 0 O-C-N 121.131 -0.98 . . . . 0.0 109.824 179.629 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.507 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.4 Cg_endo -65.41 175.13 4.42 Favored 'Trans proline' 0 N--CA 1.489 1.229 0 O-C-N 123.181 1.095 . . . . 0.0 110.803 179.516 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.12 -36.39 61.64 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.275 -0.891 . . . . 0.0 110.791 -179.721 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.56 -40.69 79.5 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 120.992 -1.067 . . . . 0.0 110.16 -179.657 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -70.07 -41.35 74.24 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.222 179.233 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.579 ' O ' HG11 ' A' ' 140' ' ' VAL . 2.9 mt -65.7 -38.78 90.16 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.579 179.148 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -61.23 -39.35 89.95 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.175 -0.953 . . . . 0.0 109.838 179.645 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -59.75 -38.57 82.11 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.131 -0.981 . . . . 0.0 110.143 179.825 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -60.8 -44.31 97.03 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.127 -0.983 . . . . 0.0 109.917 179.996 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.454 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -61.47 -44.42 97.13 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.168 -0.957 . . . . 0.0 109.833 179.854 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.93 -34.27 71.54 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.258 -0.901 . . . . 0.0 110.288 179.663 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 24.4 mttt -75.9 -31.96 59.42 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.045 -1.035 . . . . 0.0 110.934 179.997 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.14 23.77 8.7 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 120.926 -1.108 . . . . 0.0 111.681 -179.934 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.59 46.62 53.36 Favored Glycine 0 N--CA 1.5 2.945 0 O-C-N 120.663 -1.273 . . . . 0.0 110.722 179.257 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.454 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.9 t -147.61 -164.92 2.12 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.092 -1.24 . . . . 0.0 110.371 179.842 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.6 mp0 -136.27 150.83 49.11 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.227 -0.921 . . . . 0.0 110.285 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.579 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.0 p -130.72 160.93 41.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 121.203 -0.935 . . . . 0.0 110.034 179.79 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 31.9 t -167.98 81.18 0.18 Allowed 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.126 -0.984 . . . . 0.0 111.233 -179.964 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.804 ' CG ' HD12 ' A' ' 121' ' ' ILE . 42.7 t80 -93.86 161.39 14.33 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.197 -0.94 . . . . 0.0 110.099 179.761 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 4.5 m80 -139.47 -60.55 0.56 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.605 -0.684 . . . . 0.0 109.175 179.065 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -132.77 152.21 51.82 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.44 -0.787 . . . . 0.0 109.198 178.967 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 145' ' ' CYS . . . . . 0.401 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 25.7 p -97.08 156.56 16.32 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.13 -0.981 . . . . 0.0 110.803 -179.84 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 21.3 m -76.48 -24.4 15.88 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 O-C-N 121.315 -0.866 . . . . 0.0 111.859 -179.384 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 63.1 m170 -49.83 -53.69 23.9 Favored 'General case' 0 N--CA 1.515 2.822 0 O-C-N 120.728 -1.232 . . . . 0.0 110.42 -179.733 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 25.2 p -133.88 -163.05 1.31 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.308 -0.87 . . . . 0.0 110.387 179.851 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 149' ' ' GLY . . . . . 0.441 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.19 63.46 0.63 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 108.209 -1.956 . . . . 0.0 108.209 178.549 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 38.4 t -104.49 144.77 31.22 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.301 -1.117 . . . . 0.0 110.068 -179.175 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 19.0 mtt85 -101.59 44.63 1.0 Allowed 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.398 -0.813 . . . . 0.0 109.509 179.275 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 76.61 95.93 0.18 Allowed Glycine 0 N--CA 1.488 2.123 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 -179.823 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.3 p -109.02 126.26 52.94 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.093 -1.239 . . . . 0.0 110.435 179.842 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -148.68 150.37 33.09 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.16 -0.962 . . . . 0.0 110.27 -179.543 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -110.97 -52.01 2.82 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.27 -0.894 . . . . 0.0 110.665 -179.747 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 15.5 m -52.74 -39.6 62.3 Favored 'General case' 0 N--CA 1.513 2.694 0 O-C-N 120.972 -1.08 . . . . 0.0 110.722 -179.655 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 N--CA 1.496 1.866 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.492 179.845 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -110.05 156.31 15.65 Favored Glycine 0 N--CA 1.493 2.456 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 179.956 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -126.43 149.31 67.18 Favored Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.123 -1.221 . . . . 0.0 110.221 -179.969 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.64 141.38 34.23 Favored 'Trans proline' 0 C--N 1.316 -1.141 0 O-C-N 123.48 1.253 . . . . 0.0 110.387 179.999 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -116.89 101.67 8.73 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.241 -0.912 . . . . 0.0 110.196 -179.956 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.515 HG23 ' O ' ' A' ' 4' ' ' ILE . 1.2 tp -143.11 64.36 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.175 -0.953 . . . . 0.0 110.14 179.952 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -143.7 65.48 1.31 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.183 -0.948 . . . . 0.0 110.262 -179.915 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 15.6 m -127.87 106.97 9.47 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.142 -0.974 . . . . 0.0 110.207 179.95 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 39.3 mtm-85 -130.67 53.05 1.99 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.138 -0.976 . . . . 0.0 110.231 179.995 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -116.52 73.31 0.85 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.136 -0.978 . . . . 0.0 110.21 179.89 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.91 -58.09 1.84 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.103 -0.998 . . . . 0.0 110.19 179.996 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.414 ' O ' ' CD1' ' A' ' 80' ' ' TRP . 0.2 OUTLIER -121.19 91.77 48.23 Favored Pre-proline 0 N--CA 1.492 1.671 0 O-C-N 121.183 -0.948 . . . . 0.0 110.233 -179.989 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -75.43 160.25 38.95 Favored 'Trans proline' 0 C--N 1.317 -1.094 0 O-C-N 123.379 1.199 . . . . 0.0 110.65 179.982 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.627 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -79.86 138.4 53.79 Favored Pre-proline 0 N--CA 1.507 2.424 0 C-N-CA 119.655 -0.818 . . . . 0.0 109.414 179.395 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -71.8 166.84 28.29 Favored 'Trans proline' 0 C--N 1.317 -1.083 0 O-C-N 123.174 1.091 . . . . 0.0 110.696 -179.617 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -47.53 -32.61 5.48 Favored 'General case' 0 N--CA 1.516 2.838 0 O-C-N 121.549 -0.719 . . . . 0.0 111.404 -179.814 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.07 -32.31 42.35 Favored Glycine 0 N--CA 1.498 2.822 0 O-C-N 121.047 -1.033 . . . . 0.0 110.571 179.636 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.554 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 26.8 t80 -52.01 -33.2 37.3 Favored 'General case' 0 N--CA 1.514 2.741 0 O-C-N 120.935 -1.332 . . . . 0.0 110.44 179.758 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -53.55 -34.99 60.26 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.108 -0.995 . . . . 0.0 110.208 179.457 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.13 -39.77 83.36 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.264 -0.897 . . . . 0.0 110.034 179.574 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.809 HD12 HD11 ' A' ' 23' ' ' LEU . 2.1 pt -113.51 34.61 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.21 -0.931 . . . . 0.0 110.497 179.658 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.426 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 7.4 tmtt? -85.02 -43.31 0.67 Allowed Pre-proline 0 N--CA 1.51 2.539 0 O-C-N 121.07 -1.019 . . . . 0.0 113.441 -178.993 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.426 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.4 Cg_endo -75.73 -36.74 1.99 Allowed 'Trans proline' 0 N--CA 1.486 1.074 0 O-C-N 122.591 0.785 . . . . 0.0 111.699 -178.134 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.606 HG21 ' CE2' ' A' ' 62' ' ' TYR . 89.4 m -60.61 -42.83 97.59 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 120.942 -1.099 . . . . 0.0 109.934 -179.737 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.809 HD11 HD12 ' A' ' 19' ' ' ILE . 84.8 mt -65.35 -39.66 92.63 Favored 'General case' 0 N--CA 1.507 2.401 0 C-N-CA 119.477 -0.889 . . . . 0.0 109.554 179.51 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -58.39 -35.85 72.65 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.138 -0.976 . . . . 0.0 110.127 179.355 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -56.63 -36.0 68.97 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.058 -1.026 . . . . 0.0 110.368 179.647 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.761 ' CD2' HD22 ' A' ' 55' ' ' LEU . 22.2 m-85 -57.72 -38.78 75.89 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.04 -1.037 . . . . 0.0 110.479 -179.965 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -63.07 -23.35 67.4 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.214 -0.929 . . . . 0.0 111.82 -179.483 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.573 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.6 mp -81.21 -33.59 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.412 0 O-C-N 120.759 -1.213 . . . . 0.0 109.827 179.659 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -82.37 -36.31 26.92 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 120.997 -1.064 . . . . 0.0 109.28 178.557 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.772 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -74.29 -31.88 62.67 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.118 -0.989 . . . . 0.0 110.102 178.843 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -68.75 -35.73 77.47 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 120.842 -1.161 . . . . 0.0 110.01 179.479 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -65.87 -41.8 91.14 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.012 -1.055 . . . . 0.0 109.428 179.583 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.612 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -67.37 -41.94 84.22 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.215 -0.928 . . . . 0.0 109.223 179.142 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.0 mm100 -58.72 -34.39 71.29 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.352 -0.843 . . . . 0.0 110.365 179.812 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.2 mtmm -92.91 -38.88 11.47 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.029 -1.045 . . . . 0.0 110.372 179.887 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.6 -39.43 84.17 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.204 -0.935 . . . . 0.0 110.011 179.847 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.631 ' HD2' HD11 ' A' ' 49' ' ' LEU . 18.5 ttpt -57.88 -38.59 76.06 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.201 -0.937 . . . . 0.0 110.284 -179.997 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.7 m -111.53 47.83 1.0 Allowed 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.153 -0.967 . . . . 0.0 110.128 -179.978 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.1 p -96.7 95.64 8.06 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.224 -0.923 . . . . 0.0 109.15 179.147 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.6 ttpt 53.33 29.31 8.46 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.018 -1.051 . . . . 0.0 110.826 -179.002 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 34.5 tp 50.28 87.05 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.868 -1.145 . . . . 0.0 110.985 179.879 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -114.24 -163.71 0.88 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.309 -0.869 . . . . 0.0 109.983 179.956 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -102.6 177.6 4.81 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.054 -1.029 . . . . 0.0 110.0 179.822 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.1 mttp 52.94 50.87 17.03 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 120.977 -1.077 . . . . 0.0 110.607 -179.75 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -98.38 -40.01 8.51 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.221 -0.924 . . . . 0.0 110.747 -179.857 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -58.71 -39.36 80.6 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.181 -0.949 . . . . 0.0 110.132 -179.889 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -60.39 -39.67 88.12 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.15 -0.969 . . . . 0.0 110.086 179.898 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 39.3 tp60 -60.85 -42.23 97.41 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.098 -1.001 . . . . 0.0 110.02 -179.948 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.661 HD23 HD12 ' A' ' 52' ' ' ILE . 12.4 mt -60.08 -38.1 81.9 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.162 -0.961 . . . . 0.0 110.436 179.988 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.51 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 52.6 m0 -57.05 -40.47 76.88 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.094 -1.003 . . . . 0.0 109.574 179.794 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -60.88 -35.47 76.7 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.321 -0.862 . . . . 0.0 109.799 179.007 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.772 HG23 ' CG ' ' A' ' 30' ' ' LEU . 73.8 mt -65.23 -51.45 65.08 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 121.109 -0.994 . . . . 0.0 109.394 179.585 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.443 ' HG3' ' N ' ' A' ' 54' ' ' GLN . 0.0 OUTLIER -64.8 -30.78 71.79 Favored 'General case' 0 N--CA 1.501 2.123 0 C-N-CA 118.65 -1.22 . . . . 0.0 109.692 179.307 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.443 ' N ' ' HG3' ' A' ' 53' ' ' MET . 5.0 mm100 -64.95 -36.79 85.52 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.089 -1.007 . . . . 0.0 109.358 178.733 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.761 HD22 ' CD2' ' A' ' 26' ' ' PHE . 13.9 mt -52.78 -33.71 50.0 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.081 -1.012 . . . . 0.0 109.928 179.217 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.43 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 19.6 t60 -56.71 -38.02 71.73 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.086 -1.009 . . . . 0.0 109.771 179.235 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.553 ' CD2' HD21 ' A' ' 91' ' ' LEU . 5.9 m170 -60.0 -49.64 76.88 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.027 -1.046 . . . . 0.0 109.048 178.999 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 26.2 tp60 -59.69 -38.17 80.82 Favored 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 119.634 -0.826 . . . . 0.0 109.427 179.134 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.441 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.86 -48.83 75.16 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.233 -0.987 . . . . 0.0 108.879 179.03 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.454 ' HA ' ' HB1' ' A' ' 87' ' ' ALA . 92.1 p -64.58 -42.14 95.81 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.148 -0.97 . . . . 0.0 108.763 178.834 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 46.8 ttt85 -62.54 -39.83 94.86 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.185 -0.947 . . . . 0.0 109.303 178.803 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.606 ' CE2' HG21 ' A' ' 22' ' ' THR . 44.2 t80 -61.96 -49.55 75.66 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.261 -0.9 . . . . 0.0 109.386 179.494 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.83 HD12 ' HB2' ' A' ' 87' ' ' ALA . 90.2 mt -71.76 -39.16 68.14 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.36 0 O-C-N 121.26 -0.9 . . . . 0.0 109.022 179.153 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.507 ' CE1' HG23 ' A' ' 92' ' ' ILE . 40.3 t80 -62.77 -41.17 99.11 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.136 -0.977 . . . . 0.0 109.005 178.901 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 51.8 m -67.1 -38.19 85.25 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.202 -0.936 . . . . 0.0 110.793 -179.825 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.661 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.17 -36.35 24.78 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 120.949 -1.094 . . . . 0.0 112.489 -178.875 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.611 ' N ' HD12 ' A' ' 66' ' ' LEU . 66.1 t80 -86.55 -35.4 19.53 Favored 'General case' 0 N--CA 1.512 2.652 0 O-C-N 120.54 -1.35 . . . . 0.0 111.907 -179.299 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.401 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 17.2 m-85 -98.35 -3.39 37.16 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 120.873 -1.142 . . . . 0.0 113.077 -178.649 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -139.25 -60.27 0.57 Allowed 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.383 -1.448 . . . . 0.0 111.04 179.698 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.423 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 6.9 tpt85 -59.66 -29.59 68.16 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.081 -1.012 . . . . 0.0 110.754 -179.749 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.8 tttt 59.68 43.44 15.58 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.866 -1.146 . . . . 0.0 109.947 -179.609 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -117.99 37.34 4.0 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.425 -0.797 . . . . 0.0 109.925 179.401 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.661 HG21 ' CD1' ' A' ' 66' ' ' LEU . 14.2 tt -157.19 162.27 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.19 -0.944 . . . . 0.0 110.345 -179.88 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.5 t -110.7 149.46 30.45 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.184 -0.948 . . . . 0.0 109.788 179.356 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.0 ttmt -45.31 -33.11 2.28 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.273 -0.892 . . . . 0.0 111.587 -179.78 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -62.36 -49.31 76.06 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 120.928 -1.108 . . . . 0.0 109.479 179.379 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.18 -47.62 76.32 Favored 'General case' 0 N--CA 1.507 2.395 0 C-N-CA 119.149 -1.02 . . . . 0.0 108.6 178.917 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.701 ' HA ' HD12 ' A' ' 81' ' ' LEU . 18.1 t80 -60.21 -38.72 84.18 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 119.661 -0.815 . . . . 0.0 109.692 179.436 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -69.59 -42.05 74.97 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.065 -1.022 . . . . 0.0 108.825 178.766 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.627 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 67.9 t90 -58.27 -38.88 77.83 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.243 -0.911 . . . . 0.0 109.595 179.116 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.701 HD12 ' HA ' ' A' ' 78' ' ' TYR . 9.5 mt -65.65 -52.11 54.28 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.234 -0.916 . . . . 0.0 109.282 179.425 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.401 HG21 ' HG3' ' A' ' 89' ' ' LYS . 35.6 mm -59.12 -32.73 48.58 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.521 0 O-C-N 121.23 -0.919 . . . . 0.0 110.098 179.466 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 20.0 tttp -85.84 -14.3 45.43 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 120.938 -1.101 . . . . 0.0 112.032 -179.913 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.433 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 22.3 mm-40 -108.53 21.39 17.35 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 120.554 -1.341 . . . . 0.0 112.076 -179.97 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 73.25 78.4 0.14 Allowed 'General case' 0 N--CA 1.511 2.576 0 O-C-N 120.981 -1.074 . . . . 0.0 111.418 179.278 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.671 ' HE2' HD13 ' A' ' 23' ' ' LEU . 25.9 m-85 -134.04 -65.0 0.68 Allowed 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.493 -0.755 . . . . 0.0 109.808 -179.869 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.83 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -121.16 -175.61 3.1 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.304 -0.873 . . . . 0.0 109.937 179.68 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.43 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 7.9 t0 -117.3 122.08 42.92 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.145 -0.972 . . . . 0.0 110.134 179.906 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.401 ' HG3' HG21 ' A' ' 82' ' ' ILE . 12.3 mtmt -74.71 -40.57 61.25 Favored 'General case' 0 N--CA 1.506 2.37 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.725 179.742 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.578 HD12 ' CD2' ' A' ' 106' ' ' LEU . 0.1 OUTLIER -62.16 -42.96 99.76 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.157 -0.964 . . . . 0.0 109.341 179.514 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.553 HD21 ' CD2' ' A' ' 57' ' ' HIS . 22.1 tp -63.73 -48.4 77.2 Favored 'General case' 0 N--CA 1.507 2.381 0 C-N-CA 119.289 -0.964 . . . . 0.0 109.14 179.737 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.507 HG23 ' CE1' ' A' ' 64' ' ' TYR . 49.0 mt -60.95 -37.14 76.37 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.447 0 O-C-N 121.081 -1.012 . . . . 0.0 108.336 178.198 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.79 -39.55 76.53 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.125 -0.984 . . . . 0.0 108.694 177.907 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.439 ' HD2' ' CZ ' ' A' ' 100' ' ' TYR . 5.7 mmtm -58.72 -45.32 89.86 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.175 -0.953 . . . . 0.0 109.295 178.933 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.0 m0 -64.12 -35.37 80.55 Favored 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 119.485 -0.886 . . . . 0.0 110.079 179.356 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.23 -29.66 34.41 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.064 -1.023 . . . . 0.0 110.71 179.369 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.8 mmtt -53.72 -176.85 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.681 0 O-C-N 121.0 -1.062 . . . . 0.0 110.607 179.802 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 36.8 m -103.66 131.83 50.46 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.137 -0.977 . . . . 0.0 109.687 179.175 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.27 9.55 50.82 Favored Glycine 0 N--CA 1.493 2.47 0 C-N-CA 120.242 -0.98 . . . . 0.0 111.053 -179.458 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.598 ' HB3' HD23 ' A' ' 103' ' ' LEU . 51.4 m-85 -118.22 71.13 0.82 Allowed 'General case' 0 N--CA 1.493 1.724 0 CA-C-N 119.459 1.629 . . . . 0.0 109.921 179.697 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -95.17 -32.41 13.07 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.087 -1.008 . . . . 0.0 110.872 179.979 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -126.55 68.42 1.23 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.923 -1.11 . . . . 0.0 110.883 -179.516 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.598 HD23 ' HB3' ' A' ' 100' ' ' TYR . 0.9 OUTLIER -116.53 155.12 29.22 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.907 -1.121 . . . . 0.0 109.85 179.225 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.432 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.8 p -115.96 -34.8 4.63 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.156 -0.965 . . . . 0.0 113.473 -178.852 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.64 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.0 m -139.59 -167.6 2.3 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 120.18 -1.575 . . . . 0.0 110.088 179.501 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.578 ' CD2' HD12 ' A' ' 90' ' ' LEU . 14.8 mt -96.65 -39.51 9.46 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.204 -0.935 . . . . 0.0 110.048 179.338 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -100.86 28.03 5.53 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 120.967 -1.083 . . . . 0.0 109.98 177.903 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.64 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.301 1.8 t -125.68 14.81 8.12 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.107 -0.995 . . . . 0.0 109.017 -179.707 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.472 HG22 ' HG3' ' A' ' 123' ' ' ARG . 1.1 pt -158.11 36.06 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.263 0 O-C-N 120.832 -1.168 . . . . 0.0 110.955 -178.492 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.579 ' O ' HG23 ' A' ' 119' ' ' THR . 60.7 tp60 -130.81 151.47 51.21 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 120.707 -1.246 . . . . 0.0 111.45 -178.671 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.431 ' CB ' ' OG1' ' A' ' 119' ' ' THR . 0.0 OUTLIER -133.93 156.61 47.81 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.235 -0.915 . . . . 0.0 110.377 179.634 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -131.09 162.31 30.14 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.265 -0.897 . . . . 0.0 110.328 -179.849 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -122.08 39.69 3.83 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.284 -0.885 . . . . 0.0 110.122 179.711 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -149.55 41.24 0.86 Allowed 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.208 -0.932 . . . . 0.0 110.403 -179.912 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 10.6 m120 53.8 178.02 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.151 -0.968 . . . . 0.0 110.725 -179.956 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 57.3 m-80 52.55 75.67 0.22 Allowed 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.016 -1.052 . . . . 0.0 110.821 -179.962 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 133.91 137.22 3.79 Favored Glycine 0 N--CA 1.493 2.451 0 N-CA-C 109.584 -1.407 . . . . 0.0 109.584 179.968 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 44.1 m -143.57 -173.85 4.07 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.244 -1.15 . . . . 0.0 110.316 179.958 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.579 HG23 ' O ' ' A' ' 110' ' ' GLN . 6.6 m -115.93 166.12 12.33 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.22 -0.925 . . . . 0.0 110.114 -179.982 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.427 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 37.5 t -86.19 154.7 21.13 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.273 -0.892 . . . . 0.0 109.73 179.482 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.949 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -76.68 -29.85 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.383 0 O-C-N 121.139 -0.976 . . . . 0.0 111.593 -179.201 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.444 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.7 p -58.01 -35.38 71.17 Favored 'General case' 0 N--CA 1.511 2.607 0 O-C-N 120.655 -1.278 . . . . 0.0 110.659 -179.163 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.472 ' HG3' HG22 ' A' ' 109' ' ' ILE . 1.2 ttt-85 -55.84 -32.92 64.04 Favored 'General case' 0 N--CA 1.513 2.686 0 O-C-N 121.023 -1.048 . . . . 0.0 110.071 178.904 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.629 HG13 ' CD ' ' A' ' 128' ' ' GLN . 60.8 t -79.44 124.6 83.93 Favored Pre-proline 0 N--CA 1.504 2.243 0 O-C-N 121.119 -0.988 . . . . 0.0 109.936 179.729 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.21 178.76 2.3 Favored 'Trans proline' 0 N--CA 1.488 1.203 0 O-C-N 123.11 1.058 . . . . 0.0 110.81 179.71 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -75.21 -36.93 61.33 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.255 -0.903 . . . . 0.0 110.574 179.979 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.17 -40.54 77.52 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 120.981 -1.074 . . . . 0.0 110.066 -179.761 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 128' ' ' GLN . . . . . 0.629 ' CD ' HG13 ' A' ' 124' ' ' VAL . 53.6 tt0 -69.48 -42.32 74.98 Favored 'General case' 0 N--CA 1.505 2.301 0 C-N-CA 119.402 -0.919 . . . . 0.0 109.075 179.247 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.685 HD11 HD11 ' A' ' 121' ' ' ILE . 2.9 mt -64.41 -38.79 92.25 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.52 -0.872 . . . . 0.0 109.476 179.184 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -60.13 -39.39 86.12 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.16 -0.962 . . . . 0.0 109.929 179.728 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -58.89 -38.55 79.11 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.187 -0.946 . . . . 0.0 110.263 179.903 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -63.48 -39.76 95.3 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.144 -0.973 . . . . 0.0 109.993 179.783 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.84 -41.95 97.71 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 121.211 -0.931 . . . . 0.0 109.82 179.891 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -60.21 -38.1 82.33 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.158 -0.964 . . . . 0.0 109.823 179.515 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -58.0 -35.37 71.13 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.132 -0.98 . . . . 0.0 110.555 179.859 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -105.08 16.63 25.51 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 120.963 -1.085 . . . . 0.0 112.061 -179.993 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 58.01 44.44 94.59 Favored Glycine 0 N--CA 1.497 2.731 0 O-C-N 120.635 -1.291 . . . . 0.0 110.174 179.448 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 7.4 t -137.83 -162.7 1.33 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.136 -1.214 . . . . 0.0 110.028 179.957 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -136.97 147.11 46.12 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.104 -0.997 . . . . 0.0 110.29 179.963 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.599 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.5 p -133.67 161.62 40.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.165 -0.959 . . . . 0.0 110.288 -179.858 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 45.6 t -164.06 111.16 1.1 Allowed 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.302 -0.874 . . . . 0.0 110.926 179.948 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.949 ' CD1' HD12 ' A' ' 121' ' ' ILE . 81.7 t80 -104.83 137.24 42.92 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.226 -0.921 . . . . 0.0 110.869 -179.783 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 11.3 m-70 -111.93 -56.76 2.35 Favored 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 178.122 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -151.71 156.03 39.5 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.5 -0.75 . . . . 0.0 109.574 179.115 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 145' ' ' CYS . . . . . 0.438 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 27.3 p -95.0 155.24 16.81 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.07 -1.019 . . . . 0.0 111.036 -179.553 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.9 p -72.38 -24.09 21.8 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.461 0 O-C-N 121.391 -0.818 . . . . 0.0 111.696 -179.528 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 60.3 m170 -51.79 -53.08 43.9 Favored 'General case' 0 N--CA 1.513 2.714 0 O-C-N 120.749 -1.219 . . . . 0.0 110.182 -179.918 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.51 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 28.3 p -135.41 -164.94 1.61 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.208 -0.932 . . . . 0.0 111.026 -179.997 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.39 59.42 0.71 Allowed Glycine 0 N--CA 1.491 2.315 0 N-CA-C 107.9 -2.08 . . . . 0.0 107.9 178.539 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 21.0 t -100.59 138.34 37.78 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.401 -1.058 . . . . 0.0 109.809 -179.228 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -96.44 51.58 1.19 Allowed 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.233 -0.917 . . . . 0.0 109.623 179.108 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 72.0 99.37 0.06 OUTLIER Glycine 0 N--CA 1.487 2.071 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 179.761 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 p -110.73 127.16 55.23 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.261 -1.14 . . . . 0.0 110.099 179.38 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -152.03 148.9 28.25 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.061 -1.024 . . . . 0.0 110.479 -179.391 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -112.77 -57.84 2.23 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.135 -0.978 . . . . 0.0 110.261 -179.891 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 7.8 t -165.87 43.21 0.07 Allowed 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.181 -0.949 . . . . 0.0 110.927 -179.876 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 . . . . . 0 N--CA 1.494 1.734 0 CA-C-O 118.001 -1.0 . . . . 0.0 110.21 179.983 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.234 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 75.97 78.19 0.69 Allowed Glycine 0 N--CA 1.493 2.453 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.931 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 70.9 p -135.56 55.59 13.2 Favored Pre-proline 0 N--CA 1.494 1.746 0 O-C-N 121.15 -1.206 . . . . 0.0 110.176 179.987 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.37 143.98 40.13 Favored 'Trans proline' 0 C--N 1.317 -1.115 0 O-C-N 123.323 1.17 . . . . 0.0 110.377 179.973 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.8 ptt85 -144.38 50.15 1.31 Allowed 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.237 -0.914 . . . . 0.0 110.259 -179.952 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 82.4 mt -117.58 -58.1 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.277 -0.89 . . . . 0.0 109.945 179.968 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -119.57 154.55 33.73 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.285 -0.884 . . . . 0.0 110.25 179.998 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.3 m -129.45 67.35 1.44 Allowed 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.229 -0.919 . . . . 0.0 110.193 -179.951 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.2 ttt-85 -135.89 128.45 30.62 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.181 -0.949 . . . . 0.0 110.17 179.968 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -121.66 173.98 7.1 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.178 -0.951 . . . . 0.0 110.255 -179.98 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.5 p -142.64 -164.71 1.89 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.17 -0.956 . . . . 0.0 110.263 -179.964 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.6 tmtt? 53.42 68.6 2.79 Favored Pre-proline 0 N--CA 1.501 2.108 0 O-C-N 120.972 -1.08 . . . . 0.0 110.707 -179.952 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.48 157.88 52.11 Favored 'Trans proline' 0 C--N 1.316 -1.154 0 O-C-N 123.389 1.205 . . . . 0.0 110.622 179.998 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.743 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -63.59 148.98 93.26 Favored Pre-proline 0 N--CA 1.509 2.5 0 C-N-CA 119.622 -0.831 . . . . 0.0 109.595 179.776 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -70.91 161.79 44.89 Favored 'Trans proline' 0 C--N 1.316 -1.175 0 O-C-N 123.374 1.197 . . . . 0.0 110.63 -179.928 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -48.51 -31.93 7.16 Favored 'General case' 0 N--CA 1.515 2.799 0 O-C-N 121.366 -0.833 . . . . 0.0 111.441 -179.761 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.21 -34.13 46.92 Favored Glycine 0 N--CA 1.499 2.845 0 O-C-N 120.95 -1.094 . . . . 0.0 110.588 179.939 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -54.57 -31.03 55.96 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 120.913 -1.346 . . . . 0.0 110.879 179.818 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -54.09 -37.61 64.45 Favored 'General case' 0 N--CA 1.512 2.664 0 O-C-N 120.984 -1.073 . . . . 0.0 110.169 179.756 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.2 mptt -59.11 -36.4 75.12 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.154 -0.966 . . . . 0.0 110.224 179.492 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.666 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.7 pt -116.9 36.04 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.973 0 O-C-N 121.089 -1.007 . . . . 0.0 110.527 179.705 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.434 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.6 OUTLIER -83.97 -42.71 0.77 Allowed Pre-proline 0 N--CA 1.509 2.499 0 O-C-N 121.095 -1.003 . . . . 0.0 113.264 -179.092 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.434 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.7 Cg_endo -75.95 -38.57 1.17 Allowed 'Trans proline' 0 N--CA 1.487 1.126 0 O-C-N 122.596 0.787 . . . . 0.0 111.631 -178.292 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.735 HG21 ' CE2' ' A' ' 62' ' ' TYR . 68.2 m -60.27 -43.86 95.81 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 120.991 -1.068 . . . . 0.0 109.99 -179.768 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.666 HD12 ' O ' ' A' ' 19' ' ' ILE . 2.2 mt -62.88 -37.92 88.8 Favored 'General case' 0 N--CA 1.507 2.387 0 C-N-CA 119.331 -0.947 . . . . 0.0 109.689 179.435 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 4.1 m -57.5 -37.51 73.1 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.101 -0.999 . . . . 0.0 110.24 179.627 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -58.01 -38.64 76.55 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.075 -1.015 . . . . 0.0 109.997 179.699 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.763 ' CD2' HD22 ' A' ' 55' ' ' LEU . 13.9 m-85 -57.76 -39.32 77.14 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.178 -0.951 . . . . 0.0 110.26 179.821 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.64 -22.53 65.35 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.199 -0.938 . . . . 0.0 111.668 -179.554 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.54 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.7 mp -80.22 -34.12 14.69 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.469 0 O-C-N 120.842 -1.161 . . . . 0.0 109.978 179.931 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 40.4 tt0 -81.29 -34.11 32.19 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.908 -1.12 . . . . 0.0 109.514 178.786 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.748 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -76.64 -32.7 58.17 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.062 -1.024 . . . . 0.0 109.841 178.769 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -68.76 -34.94 76.44 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 120.969 -1.082 . . . . 0.0 109.878 179.307 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.74 -41.07 79.47 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.047 -1.033 . . . . 0.0 109.647 179.564 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.468 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -65.57 -40.98 93.37 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.181 -0.95 . . . . 0.0 109.499 179.342 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 -58.33 -34.64 70.84 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.212 -0.93 . . . . 0.0 110.507 -179.996 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.37 -39.17 10.16 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 120.939 -1.101 . . . . 0.0 110.678 -179.904 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -59.44 -40.1 85.7 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 121.128 -0.982 . . . . 0.0 110.139 -179.963 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.417 ' HE2' HD11 ' A' ' 49' ' ' LEU . 0.4 OUTLIER -58.86 -40.59 84.75 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.068 -1.02 . . . . 0.0 110.085 -179.929 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 51.42 -171.48 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.046 -1.034 . . . . 0.0 110.943 179.774 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.3 m -118.09 -57.66 2.07 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.237 -0.914 . . . . 0.0 110.269 -179.898 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.3 mttt -120.02 78.73 1.37 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.182 -0.948 . . . . 0.0 110.224 -179.956 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.5 tt -116.2 -57.85 2.16 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.047 -1.033 . . . . 0.0 110.213 179.848 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -169.2 -66.75 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.114 -0.991 . . . . 0.0 111.044 179.902 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -168.6 -165.45 0.58 Allowed 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.105 -0.997 . . . . 0.0 110.99 -179.905 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.2 tttt 53.49 67.47 1.0 Allowed 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.041 -1.037 . . . . 0.0 110.805 179.909 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 67.1 m -111.97 -53.95 2.66 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.171 -0.955 . . . . 0.0 110.393 179.808 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -55.1 -36.87 66.15 Favored 'General case' 0 N--CA 1.512 2.652 0 O-C-N 121.19 -0.944 . . . . 0.0 110.069 179.628 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -58.98 -39.99 83.46 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.124 -0.985 . . . . 0.0 109.985 179.651 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.2 tp60 -61.49 -40.27 93.97 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.121 -0.987 . . . . 0.0 109.82 179.695 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.43 HD23 HD12 ' A' ' 52' ' ' ILE . 94.3 mt -66.51 -34.63 78.35 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.213 -0.929 . . . . 0.0 110.371 179.783 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.488 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 37.3 m0 -58.52 -36.83 74.45 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.037 -1.039 . . . . 0.0 109.449 179.703 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -66.66 -33.7 76.23 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.757 -1.214 . . . . 0.0 109.227 177.96 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.748 HG23 ' CG ' ' A' ' 30' ' ' LEU . 75.5 mt -70.33 -54.61 17.77 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 O-C-N 120.986 -1.071 . . . . 0.0 109.323 179.285 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.501 ' CE ' ' HB2' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -60.71 -32.64 71.87 Favored 'General case' 0 N--CA 1.508 2.465 0 C-N-CA 118.61 -1.236 . . . . 0.0 109.54 178.868 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.38 -39.59 87.82 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 120.875 -1.14 . . . . 0.0 109.398 179.022 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.763 HD22 ' CD2' ' A' ' 26' ' ' PHE . 21.2 mt -54.59 -34.31 61.77 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.097 -1.002 . . . . 0.0 110.012 179.242 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.453 ' CE1' ' HB2' ' A' ' 88' ' ' ASP . 82.2 t60 -56.46 -40.23 74.49 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 120.991 -1.068 . . . . 0.0 109.626 179.184 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.43 ' CD2' HD21 ' A' ' 91' ' ' LEU . 7.5 m170 -61.23 -49.1 78.49 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.206 -0.934 . . . . 0.0 108.991 178.966 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -62.72 -41.01 98.95 Favored 'General case' 0 N--CA 1.504 2.249 0 C-N-CA 119.417 -0.913 . . . . 0.0 108.87 178.747 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.456 ' HD2' ' CD2' ' A' ' 26' ' ' PHE . 2.5 mtp85 -61.18 -45.9 92.7 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.247 -0.908 . . . . 0.0 109.302 179.087 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 93.2 p -65.9 -40.02 91.13 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.231 -0.918 . . . . 0.0 109.194 179.226 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 24.0 ttt85 -65.17 -38.73 91.48 Favored 'General case' 0 N--CA 1.508 2.452 0 C-N-CA 119.212 -0.995 . . . . 0.0 109.453 179.082 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.735 ' CE2' HG21 ' A' ' 22' ' ' THR . 43.0 t80 -61.21 -48.3 82.14 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.124 -0.985 . . . . 0.0 109.52 179.507 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.707 HD12 ' HB2' ' A' ' 87' ' ' ALA . 86.9 mt -76.77 -41.66 33.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.3 0 O-C-N 121.217 -0.927 . . . . 0.0 109.216 179.399 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.443 ' OH ' ' NH1' ' A' ' 96' ' ' ARG . 46.8 t80 -59.54 -31.14 69.13 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.253 -0.904 . . . . 0.0 109.831 178.71 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 59.7 m -80.67 -37.52 30.7 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 120.917 -1.115 . . . . 0.0 110.364 179.837 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.608 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -82.96 -32.44 27.1 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 120.942 -1.099 . . . . 0.0 112.512 -179.061 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.487 ' N ' HD12 ' A' ' 66' ' ' LEU . 62.1 t80 -86.52 -35.31 19.64 Favored 'General case' 0 N--CA 1.512 2.654 0 O-C-N 120.696 -1.253 . . . . 0.0 111.916 -179.207 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -98.37 -23.83 15.44 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.851 -1.156 . . . . 0.0 112.8 -178.29 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.421 ' HE2' ' CD2' ' A' ' 64' ' ' TYR . 0.7 OUTLIER -114.8 -56.45 2.38 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.617 -1.302 . . . . 0.0 111.26 -179.311 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.424 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 6.6 ttt85 -67.67 -30.65 70.24 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.067 -1.02 . . . . 0.0 110.63 -179.906 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 tttm 59.08 44.72 15.67 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 120.829 -1.169 . . . . 0.0 110.164 -179.817 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -114.24 37.05 3.47 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.307 -0.871 . . . . 0.0 109.716 179.181 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.809 HG13 HD23 ' A' ' 77' ' ' LEU . 14.6 tt -157.83 162.65 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.253 -0.904 . . . . 0.0 110.14 -179.694 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -108.74 148.89 29.81 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.098 -1.001 . . . . 0.0 110.226 179.759 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.7 tttm -46.6 -32.26 3.36 Favored 'General case' 0 N--CA 1.516 2.864 0 O-C-N 121.392 -0.818 . . . . 0.0 111.495 -179.859 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.29 -51.76 66.38 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.869 -1.145 . . . . 0.0 109.253 179.478 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.809 HD23 HG13 ' A' ' 73' ' ' ILE . 44.8 tp -65.34 -44.16 88.6 Favored 'General case' 0 N--CA 1.505 2.292 0 C-N-CA 119.19 -1.004 . . . . 0.0 108.504 178.812 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.686 ' HA ' HD12 ' A' ' 81' ' ' LEU . 18.0 t80 -59.57 -40.61 87.91 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.397 -0.814 . . . . 0.0 109.36 178.979 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -72.68 -42.95 63.7 Favored 'General case' 0 N--CA 1.504 2.249 0 C-N-CA 119.369 -0.932 . . . . 0.0 108.687 178.603 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.743 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 85.9 t90 -56.86 -35.76 69.25 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.228 -0.92 . . . . 0.0 109.432 178.462 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.686 HD12 ' HA ' ' A' ' 78' ' ' TYR . 13.9 mt -66.89 -59.43 3.53 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.159 -0.963 . . . . 0.0 108.963 178.898 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mt -56.83 -27.02 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.614 0 O-C-N 120.938 -1.101 . . . . 0.0 109.99 179.577 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 6.3 mmtm -82.53 -18.54 41.12 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.793 -1.192 . . . . 0.0 111.105 178.669 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.444 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 72.4 mm-40 -108.72 23.32 14.7 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.731 -1.23 . . . . 0.0 111.968 179.983 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.413 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 2.6 tptp 76.51 71.2 0.07 Allowed 'General case' 0 N--CA 1.514 2.76 0 O-C-N 121.198 -0.939 . . . . 0.0 111.827 179.326 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.625 ' HE2' HD13 ' A' ' 23' ' ' LEU . 26.4 m-85 -133.13 -62.43 0.8 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.45 -0.781 . . . . 0.0 109.202 179.354 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.707 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -131.09 162.38 29.99 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.495 -0.753 . . . . 0.0 109.738 179.736 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.453 ' HB2' ' CE1' ' A' ' 56' ' ' HIS . 9.8 t70 -115.12 112.93 23.31 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.109 -0.995 . . . . 0.0 110.093 179.7 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 11.2 mttt -58.07 -37.17 73.94 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.212 -0.93 . . . . 0.0 110.286 -179.975 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.621 HD23 HD22 ' A' ' 106' ' ' LEU . 11.2 tp -60.61 -37.12 80.37 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.122 -0.986 . . . . 0.0 110.385 -179.734 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.43 HD21 ' CD2' ' A' ' 57' ' ' HIS . 55.2 tp -71.42 -49.11 45.07 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.998 -1.064 . . . . 0.0 108.835 179.343 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.415 ' CG2' ' CE1' ' A' ' 64' ' ' TYR . 51.7 mt -62.02 -38.93 81.99 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.307 0 O-C-N 121.124 -0.985 . . . . 0.0 108.347 178.245 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.32 -37.74 83.8 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.179 -0.95 . . . . 0.0 109.157 178.333 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.415 ' HB3' ' CD2' ' A' ' 103' ' ' LEU . 7.2 mmtm -57.89 -42.42 84.58 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.062 -1.024 . . . . 0.0 109.754 179.469 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.9 m0 -67.01 -31.65 72.35 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.231 -0.918 . . . . 0.0 110.869 -179.778 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.443 ' NH1' ' OH ' ' A' ' 64' ' ' TYR . 0.0 OUTLIER -77.39 -32.62 54.96 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.926 -1.109 . . . . 0.0 110.426 178.89 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 15.6 mmtt -54.98 -176.57 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.677 0 O-C-N 120.935 -1.103 . . . . 0.0 110.367 179.575 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 68.1 m -106.56 139.71 40.58 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.238 -0.914 . . . . 0.0 109.658 179.37 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.99 -22.05 41.98 Favored Glycine 0 N--CA 1.494 2.507 0 C-N-CA 119.83 -1.176 . . . . 0.0 110.735 -179.365 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -92.35 58.17 3.16 Favored 'General case' 0 N--CA 1.504 2.248 0 CA-C-N 119.254 1.527 . . . . 0.0 110.193 179.909 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -78.39 -38.61 41.31 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.076 -1.015 . . . . 0.0 109.865 179.39 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -113.99 79.66 1.28 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.095 -1.003 . . . . 0.0 109.753 179.664 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.953 HD13 HD13 ' A' ' 109' ' ' ILE . 14.3 tp -115.9 137.1 52.41 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.217 -0.927 . . . . 0.0 109.991 -179.49 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.423 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.9 p -108.39 -38.76 5.63 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.262 -0.899 . . . . 0.0 112.025 179.81 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.859 ' O ' HD11 ' A' ' 103' ' ' LEU . 5.4 m -139.29 -170.31 2.86 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 120.36 -1.463 . . . . 0.0 109.718 178.881 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.621 HD22 HD23 ' A' ' 90' ' ' LEU . 12.4 mt -97.88 -35.58 10.45 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 120.896 -1.128 . . . . 0.0 110.84 179.32 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 -102.49 33.69 3.06 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.819 -1.176 . . . . 0.0 109.264 177.819 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.665 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.313 1.7 t -128.48 16.42 6.52 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.186 -0.946 . . . . 0.0 108.988 -179.017 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.953 HD13 HD13 ' A' ' 103' ' ' LEU . 1.3 pt -157.91 35.94 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 120.68 -1.263 . . . . 0.0 111.114 -178.732 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.728 ' C ' HG23 ' A' ' 119' ' ' THR . 6.1 mt-30 -138.19 132.02 31.22 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 120.637 -1.29 . . . . 0.0 111.558 -178.743 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -96.68 -48.22 5.59 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.146 -0.971 . . . . 0.0 110.437 179.614 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 53.7 -167.72 0.07 Allowed 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.033 -1.042 . . . . 0.0 110.619 -179.968 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -118.04 93.91 4.31 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.213 -0.93 . . . . 0.0 110.248 -179.897 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 5.8 p -147.13 -175.52 4.86 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.142 -0.974 . . . . 0.0 110.404 -179.971 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 15.2 p-10 -130.04 37.97 3.85 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.171 -0.956 . . . . 0.0 110.406 179.805 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -153.16 93.45 1.72 Allowed 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.134 -0.979 . . . . 0.0 110.424 179.886 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 63.26 103.9 0.01 OUTLIER Glycine 0 N--CA 1.494 2.524 0 N-CA-C 109.152 -1.579 . . . . 0.0 109.152 -179.573 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 44.3 m -116.67 125.69 52.1 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.166 -1.197 . . . . 0.0 110.523 -179.581 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.728 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.2 OUTLIER 55.28 173.95 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.24 -0.913 . . . . 0.0 110.938 179.76 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.427 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 46.0 t -113.71 156.53 23.61 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.509 -0.744 . . . . 0.0 109.251 179.466 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.721 HG23 ' CE1' ' A' ' 142' ' ' PHE . 15.4 tt -75.0 -29.88 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.338 0 C-N-CA 119.097 -1.041 . . . . 0.0 111.708 -179.517 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.505 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 12.3 p -55.14 -33.56 63.02 Favored 'General case' 0 N--CA 1.514 2.746 0 O-C-N 120.444 -1.41 . . . . 0.0 109.875 -179.902 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 7.5 tpt180 -59.49 -34.01 72.05 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.042 -1.036 . . . . 0.0 108.698 176.885 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.3 t -68.7 116.55 41.9 Favored Pre-proline 0 N--CA 1.507 2.389 0 O-C-N 121.147 -0.971 . . . . 0.0 109.801 179.271 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -66.11 179.48 1.89 Allowed 'Trans proline' 0 N--CA 1.488 1.189 0 O-C-N 123.015 1.008 . . . . 0.0 110.597 179.1 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.9 tpt180 -75.1 -40.26 60.08 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.259 -0.901 . . . . 0.0 110.154 179.979 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.96 -41.4 91.85 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.141 -0.975 . . . . 0.0 109.945 -179.929 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -63.72 -40.82 97.7 Favored 'General case' 0 N--CA 1.507 2.394 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.724 179.761 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.449 HD22 HG21 ' A' ' 140' ' ' VAL . 12.3 mt -62.19 -40.92 97.67 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.174 -0.954 . . . . 0.0 109.696 179.665 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -57.71 -37.52 73.67 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.132 -0.98 . . . . 0.0 110.219 179.853 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -58.21 -37.49 74.92 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.045 -1.034 . . . . 0.0 110.42 179.86 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -68.37 -40.08 81.55 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.204 -0.935 . . . . 0.0 109.848 179.798 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.59 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -68.09 -38.24 82.12 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.112 -0.993 . . . . 0.0 109.968 179.59 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 29.9 mtp85 -68.07 -32.03 72.07 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.107 -0.996 . . . . 0.0 110.586 179.59 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 4.3 mtmp? -79.62 -31.19 41.63 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 120.99 -1.069 . . . . 0.0 110.992 -179.934 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 2.6 mmtt -100.57 22.94 11.04 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 120.884 -1.135 . . . . 0.0 111.761 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.08 46.92 42.03 Favored Glycine 0 N--CA 1.501 2.969 0 O-C-N 120.745 -1.222 . . . . 0.0 110.998 179.201 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.59 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.7 t -146.46 -167.65 2.8 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.095 -1.239 . . . . 0.0 110.5 179.855 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -123.61 171.11 9.79 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.304 -0.872 . . . . 0.0 110.357 -179.913 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.449 HG21 HD22 ' A' ' 129' ' ' LEU . 9.1 p -157.99 161.0 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 O-C-N 121.359 -0.838 . . . . 0.0 110.672 -179.926 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 29.4 t -169.9 100.99 0.3 Allowed 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.137 -0.977 . . . . 0.0 111.074 179.859 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.721 ' CE1' HG23 ' A' ' 121' ' ' ILE . 87.8 t80 -97.85 156.72 16.46 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.231 -0.918 . . . . 0.0 110.203 179.643 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 20.3 m80 -136.23 -61.74 0.69 Allowed 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.782 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -145.84 147.67 32.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.563 -0.711 . . . . 0.0 109.373 178.896 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 145' ' ' CYS . . . . . 0.436 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 29.5 p -88.33 157.04 18.85 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.074 -1.016 . . . . 0.0 111.152 -179.344 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.2 p -74.91 -24.1 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.403 0 O-C-N 121.319 -0.863 . . . . 0.0 111.753 -179.488 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -52.73 -44.89 66.7 Favored 'General case' 0 N--CA 1.516 2.836 0 O-C-N 120.715 -1.241 . . . . 0.0 109.274 179.559 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.501 ' HB2' ' CE ' ' A' ' 53' ' ' MET . 29.4 p -142.66 -178.89 6.0 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 121.451 -0.78 . . . . 0.0 110.564 179.619 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 149' ' ' GLY . . . . . 0.413 ' CA ' ' CE3' ' A' ' 50' ' ' TRP . . . -92.43 61.71 2.45 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 107.526 -2.23 . . . . 0.0 107.526 178.035 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 15.9 t -100.66 138.49 37.65 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.366 -1.079 . . . . 0.0 109.336 -179.053 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -93.27 56.43 2.48 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.163 -0.961 . . . . 0.0 109.648 179.468 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 63.17 96.71 0.01 OUTLIER Glycine 0 N--CA 1.487 2.041 0 N-CA-C 110.055 -1.218 . . . . 0.0 110.055 179.71 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 28.7 p -104.82 118.55 36.84 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.282 -1.128 . . . . 0.0 110.128 179.291 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -118.97 136.16 54.24 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.758 -1.214 . . . . 0.0 110.099 -179.433 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 1.2 m -117.12 -56.71 2.23 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.269 -0.894 . . . . 0.0 110.285 -179.969 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 156' ' ' THR . . . . . 0.561 HG22 ' O ' ' A' ' 156' ' ' THR . 60.1 m -144.61 48.46 1.34 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.158 -0.964 . . . . 0.0 110.358 -179.916 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 . . . . . 0 N--CA 1.494 1.756 0 CA-C-O 117.987 -1.006 . . . . 0.0 110.194 -179.937 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.32 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -112.32 -114.02 3.31 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 -179.97 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.2 m -126.91 93.93 40.84 Favored Pre-proline 0 N--CA 1.494 1.768 0 O-C-N 121.204 -1.174 . . . . 0.0 110.221 179.978 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.67 110.14 2.94 Favored 'Trans proline' 0 C--N 1.317 -1.101 0 O-C-N 123.441 1.232 . . . . 0.0 110.453 179.996 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -116.82 162.69 17.32 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.204 -0.935 . . . . 0.0 110.184 179.986 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 6.5 tt -132.37 155.05 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.189 -0.944 . . . . 0.0 110.158 -179.928 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.47 124.63 27.38 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.253 -0.904 . . . . 0.0 110.169 179.978 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.1 t -142.88 49.32 1.48 Allowed 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.229 -0.919 . . . . 0.0 110.326 179.943 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.2 ttt-85 -141.45 119.04 11.63 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.197 -0.939 . . . . 0.0 110.128 -179.965 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -143.18 133.75 25.0 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.195 -0.941 . . . . 0.0 110.351 -179.962 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.8 p -143.03 -64.21 0.4 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.214 -0.929 . . . . 0.0 110.203 179.93 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.2 mttt -141.28 70.03 27.36 Favored Pre-proline 0 N--CA 1.494 1.744 0 O-C-N 121.209 -0.932 . . . . 0.0 110.06 179.965 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -73.12 158.67 48.88 Favored 'Trans proline' 0 C--N 1.318 -1.055 0 O-C-N 123.307 1.162 . . . . 0.0 110.815 -179.898 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.692 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -101.91 149.68 36.73 Favored Pre-proline 0 N--CA 1.5 2.036 0 O-C-N 121.486 -0.759 . . . . 0.0 109.777 179.583 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.4 ' HG2' HD13 ' A' ' 77' ' ' LEU . 44.5 Cg_endo -69.97 160.0 51.24 Favored 'Trans proline' 0 C--N 1.316 -1.166 0 O-C-N 123.353 1.186 . . . . 0.0 110.95 -179.727 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -48.96 -31.92 8.23 Favored 'General case' 0 N--CA 1.515 2.804 0 O-C-N 121.411 -0.805 . . . . 0.0 111.254 -179.821 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.94 -32.81 35.04 Favored Glycine 0 N--CA 1.498 2.819 0 O-C-N 120.997 -1.064 . . . . 0.0 110.711 179.782 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -55.24 -33.64 63.31 Favored 'General case' 0 N--CA 1.511 2.596 0 O-C-N 120.876 -1.367 . . . . 0.0 110.709 179.861 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -54.09 -37.17 63.97 Favored 'General case' 0 N--CA 1.512 2.639 0 O-C-N 121.048 -1.033 . . . . 0.0 110.313 179.772 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.5 mttt -58.58 -36.44 73.97 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.234 -0.917 . . . . 0.0 110.279 179.592 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.875 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.3 pt -116.5 36.73 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.066 -1.022 . . . . 0.0 110.524 179.747 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.427 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -83.75 -44.3 0.8 Allowed Pre-proline 0 N--CA 1.509 2.507 0 O-C-N 121.119 -0.988 . . . . 0.0 113.161 -179.087 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.0 Cg_endo -75.97 -36.36 2.05 Favored 'Trans proline' 0 N--CA 1.486 1.069 0 O-C-N 122.606 0.792 . . . . 0.0 111.872 -178.016 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.809 HG21 ' CE2' ' A' ' 62' ' ' TYR . 89.9 m -59.51 -41.35 89.71 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 120.926 -1.109 . . . . 0.0 110.044 -179.691 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.875 HD12 ' O ' ' A' ' 19' ' ' ILE . 4.9 mt -66.34 -40.85 90.11 Favored 'General case' 0 N--CA 1.508 2.428 0 C-N-CA 119.351 -0.94 . . . . 0.0 109.364 179.318 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.08 -34.9 70.64 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.214 -0.929 . . . . 0.0 110.221 179.4 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -56.84 -36.53 70.12 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 121.069 -1.019 . . . . 0.0 110.327 179.691 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.598 ' CD1' HD22 ' A' ' 55' ' ' LEU . 11.3 m-85 -57.84 -38.35 75.48 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.117 -0.989 . . . . 0.0 110.527 179.882 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -58.54 -34.7 71.3 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.156 -0.965 . . . . 0.0 110.648 -179.875 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.2 mp -70.14 -40.73 78.59 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.117 -0.989 . . . . 0.0 108.823 179.409 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 26.1 tp60 -69.06 -47.14 66.06 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.306 -0.958 . . . . 0.0 108.769 178.794 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.018 HD11 HG23 ' A' ' 52' ' ' ILE . 2.3 tp -60.52 -36.84 79.37 Favored 'General case' 0 N--CA 1.509 2.501 0 C-N-CA 119.401 -0.92 . . . . 0.0 109.525 178.759 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.1 -37.46 71.96 Favored 'General case' 0 N--CA 1.51 2.525 0 O-C-N 121.093 -1.004 . . . . 0.0 110.326 179.788 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -63.36 -50.36 70.23 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.194 -1.002 . . . . 0.0 109.662 -179.777 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.482 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -68.69 -40.36 80.11 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 119.058 -1.057 . . . . 0.0 109.057 178.944 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -60.94 -33.2 72.81 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.285 -0.884 . . . . 0.0 110.223 179.396 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.2 mmmt -93.83 -36.84 12.05 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.063 -1.023 . . . . 0.0 110.709 179.924 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -57.48 -35.43 70.17 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 121.097 -1.002 . . . . 0.0 110.451 -179.945 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.501 ' NZ ' HD11 ' A' ' 49' ' ' LEU . 0.5 OUTLIER -94.2 -38.86 10.84 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.1 -1.0 . . . . 0.0 110.37 179.835 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.9 m -54.32 -36.03 63.31 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 121.007 -1.058 . . . . 0.0 110.672 179.983 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.5 p -94.65 -37.33 11.37 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.124 -0.985 . . . . 0.0 110.426 179.817 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.1 tptt -107.77 106.15 16.32 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.133 -0.979 . . . . 0.0 110.069 179.745 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.405 HD12 ' CE ' ' A' ' 37' ' ' LYS . 4.1 tp -116.16 43.13 2.22 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.224 -0.922 . . . . 0.0 110.277 -179.944 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -124.2 -58.72 1.53 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.274 -0.891 . . . . 0.0 110.267 -179.966 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -117.14 149.76 39.81 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.19 -0.944 . . . . 0.0 110.282 -179.891 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.5 mptt 52.76 61.7 3.06 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.07 -1.019 . . . . 0.0 110.747 179.973 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.2 m -114.31 -57.07 2.32 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.139 -0.976 . . . . 0.0 110.088 179.865 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.3 m-80 -57.6 -40.0 78.11 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.239 -0.913 . . . . 0.0 109.752 179.611 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -60.81 -37.61 82.58 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.273 -0.892 . . . . 0.0 109.906 179.421 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.4 ' CG ' ' HA ' ' A' ' 33' ' ' ALA . 38.0 tp60 -60.15 -44.05 95.27 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 121.137 -0.977 . . . . 0.0 109.912 179.881 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.501 HD11 ' NZ ' ' A' ' 37' ' ' LYS . 83.3 mt -60.19 -38.04 82.07 Favored 'General case' 0 N--CA 1.509 2.505 0 C-N-CA 119.368 -0.933 . . . . 0.0 109.98 179.731 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.505 ' O ' ' HE3' ' A' ' 53' ' ' MET . 39.6 m0 -58.98 -34.03 71.35 Favored 'General case' 0 N--CA 1.509 2.505 0 C-N-CA 119.338 -0.945 . . . . 0.0 109.469 179.548 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -66.6 -33.47 75.73 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 120.628 -1.295 . . . . 0.0 109.443 178.073 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 1.018 HG23 HD11 ' A' ' 30' ' ' LEU . 16.5 mt -70.47 -55.37 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.234 0 O-C-N 120.971 -1.081 . . . . 0.0 109.49 179.336 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.505 ' HE3' ' O ' ' A' ' 50' ' ' TRP . 0.0 OUTLIER -58.97 -32.2 69.43 Favored 'General case' 0 N--CA 1.509 2.475 0 C-N-CA 118.763 -1.175 . . . . 0.0 109.78 179.212 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -61.09 -40.39 93.55 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.886 -1.134 . . . . 0.0 109.267 178.96 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.598 HD22 ' CD1' ' A' ' 26' ' ' PHE . 30.4 mt -55.0 -31.95 61.41 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.206 -0.934 . . . . 0.0 110.117 179.084 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.446 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 23.6 t60 -58.04 -39.64 78.93 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 120.984 -1.073 . . . . 0.0 110.038 179.645 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.442 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 8.7 m170 -59.58 -47.12 86.8 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.066 -1.022 . . . . 0.0 109.224 179.329 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -62.77 -38.54 91.0 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.299 -0.876 . . . . 0.0 109.176 178.789 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.443 ' HG2' ' CE1' ' A' ' 26' ' ' PHE . 0.7 OUTLIER -62.07 -47.07 86.33 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.193 -0.942 . . . . 0.0 109.555 179.441 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 82.9 p -66.64 -40.31 88.65 Favored 'General case' 0 N--CA 1.501 2.125 0 C-N-CA 119.253 -0.979 . . . . 0.0 109.032 179.142 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -63.74 -37.65 88.16 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.261 -0.976 . . . . 0.0 109.427 178.883 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.809 ' CE2' HG21 ' A' ' 22' ' ' THR . 41.6 t80 -62.18 -52.37 64.07 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.093 -1.004 . . . . 0.0 109.372 179.522 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.841 HD12 ' HB2' ' A' ' 87' ' ' ALA . 81.1 mt -72.27 -38.64 62.41 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.38 0 C-N-CA 119.371 -0.932 . . . . 0.0 109.298 179.274 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.497 ' CD1' ' CD2' ' A' ' 68' ' ' TYR . 68.2 t80 -63.94 -37.49 87.6 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.257 -0.902 . . . . 0.0 109.645 179.001 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 80.0 m -72.06 -37.04 69.74 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 120.949 -1.094 . . . . 0.0 110.811 -179.74 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.573 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.6 pp -82.87 -31.03 28.17 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 120.894 -1.128 . . . . 0.0 112.144 -179.109 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.447 ' HD2' HG23 ' A' ' 73' ' ' ILE . 60.5 t80 -85.95 -33.97 21.0 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 120.674 -1.266 . . . . 0.0 111.663 -179.35 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.497 ' CD2' ' CD1' ' A' ' 64' ' ' TYR . 21.7 m-85 -95.97 -27.07 15.31 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.859 -1.151 . . . . 0.0 112.355 -178.77 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.2 mttt -111.92 -61.2 1.75 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.676 -1.265 . . . . 0.0 111.269 -179.626 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.407 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 0.3 OUTLIER -60.11 -31.79 70.38 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 121.037 -1.04 . . . . 0.0 110.708 -179.532 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.5 mttt 56.63 41.6 28.2 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.803 -1.186 . . . . 0.0 110.177 -179.61 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.25 36.12 3.68 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.411 -0.806 . . . . 0.0 109.882 179.123 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.703 HG13 HD23 ' A' ' 77' ' ' LEU . 14.2 tt -153.77 162.74 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.932 0 O-C-N 121.254 -0.904 . . . . 0.0 109.889 -179.825 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 4.3 m -108.15 146.96 31.96 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.064 -1.022 . . . . 0.0 110.273 179.941 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -46.7 -32.37 3.52 Favored 'General case' 0 N--CA 1.515 2.798 0 O-C-N 121.34 -0.85 . . . . 0.0 111.457 -179.938 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -61.69 -50.19 73.45 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.034 -1.041 . . . . 0.0 109.285 179.488 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.703 HD23 HG13 ' A' ' 73' ' ' ILE . 31.7 tp -67.51 -43.64 80.37 Favored 'General case' 0 N--CA 1.504 2.253 0 C-N-CA 119.091 -1.044 . . . . 0.0 108.505 178.774 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.44 ' CE1' HG22 ' A' ' 63' ' ' ILE . 13.3 t80 -60.58 -38.24 83.96 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.3 -0.875 . . . . 0.0 109.501 179.201 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.468 ' O ' HG22 ' A' ' 82' ' ' ILE . 13.6 t0 -76.17 -41.72 48.79 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.08 -1.013 . . . . 0.0 108.829 178.813 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.692 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 84.9 t90 -59.2 -38.99 81.23 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.202 -0.937 . . . . 0.0 109.226 178.795 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.509 HD11 ' HG ' ' A' ' 77' ' ' LEU . 16.5 mt -66.33 -55.56 15.37 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.198 -0.939 . . . . 0.0 109.147 179.04 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.62 HD12 ' HB3' ' A' ' 87' ' ' ALA . 0.9 OUTLIER -56.2 -27.24 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.517 0 O-C-N 121.115 -0.99 . . . . 0.0 110.644 -179.788 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.9 mttt -89.08 -20.33 24.47 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 120.917 -1.115 . . . . 0.0 111.54 179.259 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.452 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 10.5 mm-40 -101.53 23.46 11.1 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 120.764 -1.21 . . . . 0.0 111.928 179.985 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.406 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 7.3 ttmm 76.05 70.79 0.08 Allowed 'General case' 0 N--CA 1.512 2.638 0 O-C-N 121.12 -0.987 . . . . 0.0 111.872 179.347 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.503 ' HE2' HD13 ' A' ' 23' ' ' LEU . 30.3 m-85 -133.33 -62.86 0.78 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.454 -0.779 . . . . 0.0 109.075 179.214 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.841 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -128.98 -177.0 4.03 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.496 -0.752 . . . . 0.0 109.216 179.356 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.446 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 5.5 t0 -130.91 108.61 9.95 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.055 -1.028 . . . . 0.0 110.608 -179.849 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.505 ' N ' HD11 ' A' ' 82' ' ' ILE . 3.6 mtpm? -62.97 -38.09 89.72 Favored 'General case' 0 N--CA 1.508 2.425 0 C-N-CA 119.417 -0.913 . . . . 0.0 109.78 179.506 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.858 HD23 HD22 ' A' ' 106' ' ' LEU . 7.1 tp -58.57 -37.95 76.84 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.106 -0.996 . . . . 0.0 110.131 179.936 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.491 ' HA ' HD21 ' A' ' 106' ' ' LEU . 65.4 tp -71.66 -49.08 43.15 Favored 'General case' 0 N--CA 1.506 2.349 0 C-N-CA 119.148 -1.021 . . . . 0.0 108.651 179.043 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.439 HD13 ' CD1' ' A' ' 64' ' ' TYR . 61.5 mt -60.33 -36.15 67.06 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.435 0 C-N-CA 119.389 -0.924 . . . . 0.0 108.764 178.323 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.12 -38.89 75.71 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.084 -1.01 . . . . 0.0 109.01 178.283 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.427 ' HB3' ' CD2' ' A' ' 103' ' ' LEU . 6.0 mmtt -57.44 -41.75 81.07 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.079 -1.013 . . . . 0.0 109.535 179.272 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.5 m0 -68.63 -32.55 72.49 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.248 -0.907 . . . . 0.0 110.54 179.853 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.457 ' NE ' ' OH ' ' A' ' 64' ' ' TYR . 0.1 OUTLIER -82.62 -30.31 29.54 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.952 -1.092 . . . . 0.0 110.611 179.226 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.7 mmtp -54.16 -176.55 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.613 0 O-C-N 120.991 -1.068 . . . . 0.0 110.552 179.798 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -105.44 134.0 49.26 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.203 -0.935 . . . . 0.0 109.736 179.314 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.12 5.5 56.17 Favored Glycine 0 N--CA 1.493 2.456 0 C-N-CA 120.113 -1.041 . . . . 0.0 111.28 -179.54 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.412 ' CZ ' ' HD2' ' A' ' 94' ' ' LYS . 48.4 m-85 -112.83 49.86 0.91 Allowed 'General case' 0 N--CA 1.497 1.922 0 CA-C-N 119.594 1.697 . . . . 0.0 110.036 179.752 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -65.15 -39.85 93.56 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.062 -1.023 . . . . 0.0 110.027 -179.962 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.56 108.44 15.98 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.172 -0.955 . . . . 0.0 110.131 179.942 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.923 HD13 HD13 ' A' ' 109' ' ' ILE . 14.1 tp -143.65 136.09 27.05 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.187 -0.946 . . . . 0.0 110.037 -179.699 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.442 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.6 p -110.53 -38.61 5.15 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.322 -0.861 . . . . 0.0 112.093 179.876 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.853 ' O ' HD11 ' A' ' 103' ' ' LEU . 4.6 m -138.72 -171.6 3.11 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 120.333 -1.479 . . . . 0.0 109.405 178.817 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.858 HD22 HD23 ' A' ' 90' ' ' LEU . 12.5 mt -96.59 -35.51 11.04 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.982 -1.074 . . . . 0.0 110.586 179.401 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 12.0 ttt85 -102.51 33.59 3.1 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 120.899 -1.125 . . . . 0.0 109.19 177.919 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.678 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.303 1.7 t -128.98 17.74 6.15 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.283 -0.886 . . . . 0.0 109.256 -179.109 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.923 HD13 HD13 ' A' ' 103' ' ' LEU . 1.2 pt -158.57 38.39 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 O-C-N 120.897 -1.127 . . . . 0.0 110.369 -178.905 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.632 ' C ' HG23 ' A' ' 119' ' ' THR . 19.9 mt-30 -80.55 66.45 6.06 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 120.835 -1.165 . . . . 0.0 110.718 -179.14 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.53 -44.74 5.76 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.087 -1.008 . . . . 0.0 110.435 179.632 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -56.58 -39.18 73.05 Favored 'General case' 0 N--CA 1.511 2.575 0 O-C-N 121.052 -1.03 . . . . 0.0 110.295 -179.976 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -118.52 142.7 47.34 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.188 -0.945 . . . . 0.0 110.276 179.998 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 9.8 m -136.25 71.28 1.42 Allowed 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.179 -0.951 . . . . 0.0 110.159 179.956 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -117.67 -56.51 2.2 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.127 -0.983 . . . . 0.0 110.396 -179.885 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -113.28 116.36 29.62 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.128 -0.982 . . . . 0.0 110.263 -179.988 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 91.77 -167.69 31.05 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 179.967 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 9.9 m -129.33 -165.03 1.46 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.237 -1.155 . . . . 0.0 110.082 179.99 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.632 HG23 ' C ' ' A' ' 110' ' ' GLN . 2.9 m -112.37 168.14 9.87 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.242 -0.911 . . . . 0.0 110.184 179.881 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.45 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 46.7 t -100.8 155.16 18.08 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.301 -0.875 . . . . 0.0 109.365 179.151 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.798 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -73.03 -36.26 50.5 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.324 0 O-C-N 121.105 -0.997 . . . . 0.0 110.853 -179.539 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.426 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 5.1 p -54.72 -33.03 60.5 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 120.773 -1.204 . . . . 0.0 110.989 -178.928 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -60.13 -36.64 77.93 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 120.858 -1.151 . . . . 0.0 109.414 178.368 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 57.1 t -78.53 124.9 85.28 Favored Pre-proline 0 N--CA 1.504 2.233 0 O-C-N 121.213 -0.929 . . . . 0.0 109.702 179.612 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.515 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.1 Cg_endo -64.98 175.06 4.08 Favored 'Trans proline' 0 N--CA 1.488 1.18 0 O-C-N 123.154 1.081 . . . . 0.0 110.712 179.623 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 11.1 tpp85 -75.07 -37.34 61.65 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.249 -0.907 . . . . 0.0 110.615 -179.679 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.05 -40.97 82.29 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 120.93 -1.106 . . . . 0.0 109.997 -179.704 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -68.79 -41.48 78.66 Favored 'General case' 0 N--CA 1.506 2.368 0 C-N-CA 119.325 -0.95 . . . . 0.0 109.259 179.252 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.596 HD11 HD11 ' A' ' 121' ' ' ILE . 2.8 mt -64.02 -39.18 93.53 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.295 -0.878 . . . . 0.0 109.633 179.233 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -60.98 -40.04 91.93 Favored 'General case' 0 N--CA 1.508 2.454 0 C-N-CA 119.408 -0.917 . . . . 0.0 109.929 179.765 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.93 -38.38 82.21 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.16 -0.962 . . . . 0.0 110.316 179.958 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -63.99 -43.39 95.84 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.123 -0.985 . . . . 0.0 109.981 179.937 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -64.03 -39.17 93.49 Favored 'General case' 0 N--CA 1.508 2.442 0 C-N-CA 119.373 -0.931 . . . . 0.0 109.943 179.846 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 3.8 ttt85 -68.03 -38.87 83.05 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.128 -0.982 . . . . 0.0 109.975 179.648 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 50.1 mmtt -70.9 -35.34 72.25 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.165 -0.959 . . . . 0.0 110.346 179.655 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 8.6 tttt -82.57 -17.2 45.72 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 120.994 -1.066 . . . . 0.0 111.726 179.714 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 91.5 31.22 9.71 Favored Glycine 0 N--CA 1.494 2.526 0 O-C-N 120.702 -1.249 . . . . 0.0 110.121 -179.744 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.6 t -140.94 -161.48 1.22 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.023 -1.28 . . . . 0.0 109.79 179.677 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -133.73 148.72 51.45 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.123 -0.985 . . . . 0.0 110.179 179.993 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.447 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.9 p -132.64 161.37 41.64 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.211 -0.931 . . . . 0.0 110.326 -179.879 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 31.2 t -166.62 87.87 0.33 Allowed 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.227 -0.921 . . . . 0.0 110.904 179.988 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.788 ' CG ' HD12 ' A' ' 121' ' ' ILE . 53.5 t80 -97.29 160.87 14.08 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.299 -0.875 . . . . 0.0 110.499 -179.823 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 4.5 m80 -137.61 -60.47 0.65 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.553 -0.717 . . . . 0.0 109.075 179.061 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -137.27 149.84 47.39 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.359 -0.838 . . . . 0.0 109.324 178.803 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 26.3 p -92.11 155.31 18.14 Favored 'General case' 0 N--CA 1.505 2.276 0 C-N-CA 119.219 -0.992 . . . . 0.0 110.929 -179.581 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.5 p -73.31 -26.01 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 O-C-N 121.368 -0.833 . . . . 0.0 111.539 -179.489 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -51.0 -45.84 61.31 Favored 'General case' 0 N--CA 1.516 2.849 0 O-C-N 120.784 -1.198 . . . . 0.0 109.736 179.895 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.496 ' HB2' ' CE ' ' A' ' 53' ' ' MET . 29.5 p -142.44 -179.52 6.33 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.341 -0.849 . . . . 0.0 110.766 179.733 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 149' ' ' GLY . . . . . 0.456 ' CA ' ' CE3' ' A' ' 50' ' ' TRP . . . -90.43 63.1 3.05 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 107.836 -2.106 . . . . 0.0 107.836 178.161 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 27.0 t -105.69 139.37 40.38 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.389 -1.065 . . . . 0.0 109.79 -178.986 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 20.4 mmt85 -92.37 56.9 2.87 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 121.165 -0.959 . . . . 0.0 109.556 179.344 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 60.51 95.22 0.01 OUTLIER Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 -179.852 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 p -103.27 126.88 50.67 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.305 -1.114 . . . . 0.0 110.33 179.693 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -142.19 141.67 32.6 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.153 -0.967 . . . . 0.0 109.919 -179.691 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -98.68 -42.17 7.36 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.189 -0.944 . . . . 0.0 110.574 -179.952 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 26.7 p -54.84 -38.11 67.01 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 120.968 -1.082 . . . . 0.0 110.582 -179.85 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 . . . . . 0 N--CA 1.494 1.757 0 CA-C-O 117.955 -1.021 . . . . 0.0 110.278 179.982 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.278 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 78.15 -137.19 19.5 Favored Glycine 0 N--CA 1.492 2.413 0 N-CA-C 109.619 -1.392 . . . . 0.0 109.619 -179.976 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 97.8 p -124.5 88.94 52.8 Favored Pre-proline 0 N--CA 1.493 1.717 0 O-C-N 121.186 -1.185 . . . . 0.0 110.235 179.962 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.6 -174.46 1.48 Allowed 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.429 1.226 . . . . 0.0 110.43 -179.998 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -140.14 111.11 6.93 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.224 -0.922 . . . . 0.0 110.189 -179.959 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 45.6 pt -136.3 150.74 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.205 -0.934 . . . . 0.0 110.255 179.976 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 8.5 mptt 52.86 -178.41 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.122 0 O-C-N 120.987 -1.071 . . . . 0.0 110.595 -179.971 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -138.76 103.05 4.73 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.208 -0.933 . . . . 0.0 110.268 179.983 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -116.71 158.14 24.31 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.206 -0.934 . . . . 0.0 110.128 179.968 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 36.6 mtt-85 -122.04 143.0 49.77 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.249 -0.907 . . . . 0.0 110.263 179.983 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -129.97 151.75 50.19 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.317 -0.864 . . . . 0.0 110.147 179.957 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.2 ttmt -130.78 82.53 64.22 Favored Pre-proline 0 N--CA 1.494 1.742 0 O-C-N 121.141 -0.974 . . . . 0.0 110.326 -179.992 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.471 ' O ' ' HB3' ' A' ' 12' ' ' ALA . 47.2 Cg_endo -73.25 157.79 49.61 Favored 'Trans proline' 0 C--N 1.318 -1.058 0 O-C-N 123.395 1.208 . . . . 0.0 110.366 179.98 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.728 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . 61.43 151.5 0.1 Allowed Pre-proline 0 N--CA 1.503 2.188 0 O-C-N 121.334 -0.854 . . . . 0.0 110.475 179.93 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.28 162.5 42.25 Favored 'Trans proline' 0 C--N 1.317 -1.109 0 O-C-N 123.225 1.118 . . . . 0.0 110.794 -179.794 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -48.87 -32.05 8.23 Favored 'General case' 0 N--CA 1.514 2.729 0 O-C-N 121.391 -0.818 . . . . 0.0 111.307 -179.784 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.83 -34.33 44.79 Favored Glycine 0 N--CA 1.499 2.88 0 O-C-N 120.994 -1.066 . . . . 0.0 110.53 179.84 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.441 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 18.0 t80 -55.06 -32.69 62.12 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 120.938 -1.33 . . . . 0.0 110.78 179.873 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -54.65 -37.84 66.19 Favored 'General case' 0 N--CA 1.513 2.69 0 O-C-N 120.933 -1.104 . . . . 0.0 110.21 179.71 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.19 -35.65 71.93 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.29 -0.882 . . . . 0.0 110.252 179.49 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.686 HD12 ' CD1' ' A' ' 23' ' ' LEU . 2.8 pt -115.7 36.05 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 121.068 -1.02 . . . . 0.0 110.563 179.65 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.441 ' HD2' ' CE2' ' A' ' 16' ' ' PHE . 3.5 tptm -82.64 -43.35 0.93 Allowed Pre-proline 0 N--CA 1.508 2.474 0 O-C-N 121.028 -1.045 . . . . 0.0 112.802 -179.506 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.435 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.4 Cg_endo -75.76 -37.66 1.59 Allowed 'Trans proline' 0 N--CA 1.486 1.039 0 O-C-N 122.479 0.726 . . . . 0.0 111.345 -178.393 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.865 HG21 ' CE2' ' A' ' 62' ' ' TYR . 72.4 m -61.39 -42.92 99.5 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.071 -1.018 . . . . 0.0 110.125 -179.788 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.686 ' CD1' HD12 ' A' ' 19' ' ' ILE . 3.1 mt -64.48 -41.2 96.62 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.192 -0.943 . . . . 0.0 109.747 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.11 -34.99 72.66 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.088 -1.008 . . . . 0.0 110.149 179.512 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -58.04 -35.46 71.35 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.067 -1.021 . . . . 0.0 110.22 179.505 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.755 ' CD2' HD12 ' A' ' 55' ' ' LEU . 6.7 m-85 -56.73 -44.17 81.39 Favored 'General case' 0 N--CA 1.513 2.687 0 O-C-N 120.972 -1.08 . . . . 0.0 109.999 179.297 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -57.56 -26.52 61.55 Favored 'General case' 0 N--CA 1.506 2.333 0 C-N-CA 119.317 -0.953 . . . . 0.0 110.527 179.419 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 16.6 mm -65.53 -48.61 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.314 0 O-C-N 120.954 -1.091 . . . . 0.0 109.119 179.426 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -67.39 -51.8 47.64 Favored 'General case' 0 N--CA 1.506 2.336 0 C-N-CA 119.251 -0.98 . . . . 0.0 108.72 179.027 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.807 HD21 HG23 ' A' ' 52' ' ' ILE . 0.1 OUTLIER -58.57 -32.37 68.86 Favored 'General case' 0 N--CA 1.508 2.432 0 C-N-CA 119.439 -0.905 . . . . 0.0 109.608 178.65 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.0 mtt-85 -59.82 -43.25 94.62 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 120.967 -1.083 . . . . 0.0 110.077 179.791 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -61.14 -46.04 92.2 Favored 'General case' 0 N--CA 1.508 2.443 0 C-N-CA 119.281 -0.968 . . . . 0.0 109.735 -179.69 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.504 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -70.26 -42.37 72.23 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 119.311 -0.956 . . . . 0.0 108.994 178.984 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.435 ' HG3' HD23 ' A' ' 30' ' ' LEU . 70.2 mt-30 -61.05 -32.22 71.85 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.28 -0.888 . . . . 0.0 110.158 179.341 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.1 mmmt -91.8 -33.94 14.78 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 120.98 -1.075 . . . . 0.0 110.745 179.894 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -56.43 -37.95 70.93 Favored 'General case' 0 N--CA 1.512 2.645 0 O-C-N 121.032 -1.042 . . . . 0.0 110.278 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 36.2 tttt -58.88 -51.67 69.02 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.069 -1.019 . . . . 0.0 110.002 179.916 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 51.74 -168.7 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.058 -1.026 . . . . 0.0 111.018 179.911 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.5 p -113.62 155.41 25.53 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.308 -0.87 . . . . 0.0 109.933 179.833 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 52.58 39.61 28.42 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.021 -1.049 . . . . 0.0 110.455 -179.658 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 tt -149.15 86.17 1.48 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.288 -0.882 . . . . 0.0 110.267 -179.801 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.06 106.08 18.27 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.22 -0.925 . . . . 0.0 110.286 -179.912 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -166.74 116.99 0.91 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.273 -0.892 . . . . 0.0 110.602 -179.977 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 20.0 mmtt 52.94 49.37 20.36 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.04 -1.038 . . . . 0.0 110.36 -179.562 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.8 m -94.92 -36.9 11.42 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.266 -0.896 . . . . 0.0 110.632 -179.907 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -58.17 -40.53 81.7 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.041 -1.037 . . . . 0.0 109.961 179.926 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.412 ' HA ' ' CE3' ' A' ' 50' ' ' TRP . 23.0 mt-10 -67.39 -43.81 80.42 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.166 -0.959 . . . . 0.0 109.268 179.368 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 46.6 tp60 -67.43 -41.17 85.25 Favored 'General case' 0 N--CA 1.505 2.285 0 C-N-CA 119.328 -0.949 . . . . 0.0 109.113 179.095 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.424 HD23 HD12 ' A' ' 52' ' ' ILE . 12.5 mt -60.22 -37.18 79.52 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.236 -0.915 . . . . 0.0 109.713 179.222 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.504 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 51.5 m0 -59.91 -36.03 76.14 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.116 -0.99 . . . . 0.0 109.898 179.474 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.489 ' O ' HD22 ' A' ' 55' ' ' LEU . 5.2 tp10 -62.25 -30.09 70.87 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.037 -1.04 . . . . 0.0 109.986 178.501 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.807 HG23 HD21 ' A' ' 30' ' ' LEU . 63.9 mt -72.25 -58.73 4.42 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.233 0 O-C-N 120.979 -1.076 . . . . 0.0 109.373 179.519 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.6 ptm -57.34 -26.67 61.32 Favored 'General case' 0 N--CA 1.512 2.662 0 C-N-CA 118.298 -1.361 . . . . 0.0 109.814 178.77 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.4 mm-40 -60.6 -36.82 79.51 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 120.753 -1.217 . . . . 0.0 109.314 177.915 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.755 HD12 ' CD2' ' A' ' 26' ' ' PHE . 0.6 OUTLIER -53.0 -34.5 56.53 Favored 'General case' 0 N--CA 1.514 2.771 0 O-C-N 120.981 -1.074 . . . . 0.0 109.522 178.84 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.474 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 33.2 t60 -51.23 -39.04 55.76 Favored 'General case' 0 N--CA 1.511 2.582 0 O-C-N 121.062 -1.024 . . . . 0.0 110.42 179.954 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.529 ' CD2' HD21 ' A' ' 91' ' ' LEU . 6.0 m170 -70.24 -53.21 17.95 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.114 -1.034 . . . . 0.0 109.181 178.945 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.437 ' HB3' ' CE2' ' A' ' 26' ' ' PHE . 35.1 tp60 -60.64 -29.92 69.56 Favored 'General case' 0 N--CA 1.504 2.24 0 C-N-CA 119.395 -0.922 . . . . 0.0 110.119 178.893 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.405 ' HD2' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -74.39 -46.65 38.99 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 120.99 -1.069 . . . . 0.0 109.009 179.163 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 86.8 p -67.05 -37.8 84.7 Favored 'General case' 0 N--CA 1.5 2.046 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.124 178.793 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 7.8 ttm-85 -64.27 -37.96 89.34 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 120.985 -1.072 . . . . 0.0 109.653 179.141 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.865 ' CE2' HG21 ' A' ' 22' ' ' THR . 60.9 t80 -63.4 -50.2 70.8 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.21 -0.931 . . . . 0.0 109.497 179.451 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.901 HD12 ' HB2' ' A' ' 87' ' ' ALA . 80.8 mt -72.82 -40.12 60.21 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.366 0 O-C-N 121.181 -0.949 . . . . 0.0 109.198 179.202 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.471 ' CE1' HG23 ' A' ' 92' ' ' ILE . 46.5 t80 -60.64 -31.19 70.41 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.233 -0.917 . . . . 0.0 109.989 178.878 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 48.6 m -80.87 -36.17 31.68 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.879 -1.138 . . . . 0.0 110.694 -179.904 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.638 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -82.92 -32.71 27.11 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 120.873 -1.142 . . . . 0.0 112.314 -179.078 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.501 ' N ' HD12 ' A' ' 66' ' ' LEU . 77.4 t80 -86.5 -35.75 19.41 Favored 'General case' 0 N--CA 1.511 2.61 0 O-C-N 120.624 -1.297 . . . . 0.0 111.901 -179.281 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -98.36 -21.5 16.58 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.859 -1.15 . . . . 0.0 112.882 -178.324 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.411 ' HE2' ' CD2' ' A' ' 64' ' ' TYR . 0.7 OUTLIER -117.7 -57.99 2.07 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.571 -1.331 . . . . 0.0 111.408 -179.262 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.42 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 1.0 OUTLIER -64.45 -30.81 71.84 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 121.005 -1.059 . . . . 0.0 110.71 -179.83 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp 58.45 43.6 19.34 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.769 -1.207 . . . . 0.0 110.127 -179.708 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.04 38.02 3.48 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.383 -0.823 . . . . 0.0 109.744 179.331 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.771 HG13 HD23 ' A' ' 77' ' ' LEU . 13.9 tt -156.47 162.7 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 O-C-N 121.22 -0.925 . . . . 0.0 110.227 -179.644 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 19.5 p -108.11 146.36 32.76 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.076 -1.015 . . . . 0.0 110.078 179.541 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.8 tttt -45.6 -32.82 2.5 Favored 'General case' 0 N--CA 1.516 2.831 0 O-C-N 121.33 -0.856 . . . . 0.0 111.661 -179.78 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -61.54 -49.98 74.49 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.002 -1.061 . . . . 0.0 109.31 179.535 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.771 HD23 HG13 ' A' ' 73' ' ' ILE . 36.6 tp -67.48 -43.09 81.83 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.19 -1.004 . . . . 0.0 108.538 178.765 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.442 ' HB2' ' CD1' ' A' ' 67' ' ' TYR . 17.8 t80 -60.98 -38.14 84.93 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.343 -0.848 . . . . 0.0 109.333 179.008 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.491 ' O ' HG22 ' A' ' 82' ' ' ILE . 9.9 t70 -75.48 -41.05 56.45 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.076 -1.015 . . . . 0.0 108.963 178.75 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.728 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 88.2 t90 -60.21 -38.37 83.1 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.073 -1.017 . . . . 0.0 109.178 178.758 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.468 HD11 ' HG ' ' A' ' 77' ' ' LEU . 16.1 mt -66.37 -54.8 20.27 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.236 -0.915 . . . . 0.0 109.328 179.072 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.491 HG22 ' O ' ' A' ' 79' ' ' ASP . 0.9 OUTLIER -56.03 -27.21 22.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.47 0 O-C-N 121.114 -0.991 . . . . 0.0 110.71 -179.724 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.75 -20.64 24.51 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.96 -1.088 . . . . 0.0 111.533 179.447 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.437 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 68.0 mm-40 -101.48 23.73 10.68 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 120.678 -1.264 . . . . 0.0 111.886 179.936 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.41 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 3.9 ttmm 75.85 71.76 0.08 Allowed 'General case' 0 N--CA 1.511 2.621 0 O-C-N 121.134 -0.979 . . . . 0.0 111.843 179.324 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.658 ' HE2' HD13 ' A' ' 23' ' ' LEU . 31.9 m-85 -134.42 -62.78 0.74 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.418 -0.801 . . . . 0.0 109.2 179.305 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.901 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -131.42 173.54 10.98 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.427 -0.796 . . . . 0.0 109.46 179.478 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.474 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.0 t70 -127.6 127.55 44.03 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.028 -1.045 . . . . 0.0 110.711 -179.872 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -73.65 -35.73 65.3 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 121.338 -0.851 . . . . 0.0 110.018 179.43 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.771 HD23 HD13 ' A' ' 106' ' ' LEU . 12.9 tp -60.3 -39.32 86.51 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.09 -1.006 . . . . 0.0 110.157 179.981 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.529 HD21 ' CD2' ' A' ' 57' ' ' HIS . 56.3 tp -72.81 -49.78 28.3 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.018 -1.051 . . . . 0.0 108.526 179.039 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.471 HG23 ' CE1' ' A' ' 64' ' ' TYR . 52.2 mt -59.12 -34.91 54.81 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.425 0 C-N-CA 119.189 -1.004 . . . . 0.0 108.783 178.16 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.81 -37.95 76.44 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.01 -1.057 . . . . 0.0 108.885 177.951 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.439 ' HD2' ' CZ ' ' A' ' 100' ' ' TYR . 5.2 mmtt -56.74 -42.49 79.36 Favored 'General case' 0 N--CA 1.51 2.561 0 O-C-N 121.001 -1.062 . . . . 0.0 109.41 179.17 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.3 m0 -66.7 -37.47 84.78 Favored 'General case' 0 N--CA 1.507 2.383 0 C-N-CA 119.404 -0.918 . . . . 0.0 109.824 179.441 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.37 -35.52 71.14 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.167 -0.958 . . . . 0.0 110.233 179.266 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.1 mmtp -54.21 -176.44 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.693 0 O-C-N 121.117 -0.989 . . . . 0.0 110.536 179.919 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.45 139.34 39.53 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.206 -0.934 . . . . 0.0 109.715 179.158 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 93.68 8.8 60.52 Favored Glycine 0 N--CA 1.495 2.574 0 C-N-CA 120.172 -1.013 . . . . 0.0 111.138 -179.436 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.55 ' HB3' HD23 ' A' ' 103' ' ' LEU . 45.0 m-85 -116.7 70.03 0.76 Allowed 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 119.486 1.643 . . . . 0.0 109.839 179.694 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -98.34 -35.83 10.19 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.163 -0.961 . . . . 0.0 111.091 -179.614 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.66 59.49 0.98 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.931 -1.106 . . . . 0.0 111.032 -179.448 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.55 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.2 pp -107.88 152.57 24.24 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.027 -1.046 . . . . 0.0 109.616 179.057 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.44 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.4 p -113.18 -27.04 8.14 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.113 -0.992 . . . . 0.0 113.628 -178.929 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.639 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 10.3 m -144.62 -167.71 2.72 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 120.137 -1.602 . . . . 0.0 109.877 179.18 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.771 HD13 HD23 ' A' ' 90' ' ' LEU . 12.5 mt -95.87 -39.87 9.6 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.091 -1.006 . . . . 0.0 109.915 178.88 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.9 ttm-85 -101.68 29.11 5.09 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.06 -1.025 . . . . 0.0 110.054 178.392 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.639 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.299 1.8 t -126.79 16.33 7.45 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.037 -1.039 . . . . 0.0 109.065 -179.661 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.479 HG23 ' O ' ' A' ' 108' ' ' CYS . 1.0 OUTLIER -159.31 39.31 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 O-C-N 120.969 -1.082 . . . . 0.0 110.184 -178.903 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.736 ' C ' HG23 ' A' ' 119' ' ' THR . 5.9 tt0 -101.57 97.3 7.75 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 120.918 -1.114 . . . . 0.0 111.19 -178.784 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 12.7 ttmt -112.33 -55.74 2.48 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.378 -0.826 . . . . 0.0 109.942 179.391 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 27.8 m-20 52.55 -178.7 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.08 -1.012 . . . . 0.0 110.924 179.874 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -137.77 155.15 49.36 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.234 -0.916 . . . . 0.0 110.134 179.897 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 5.3 m 52.38 38.33 24.86 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.098 -1.002 . . . . 0.0 110.851 -179.934 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -146.61 -178.32 6.11 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.133 -0.979 . . . . 0.0 110.405 -179.947 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -118.05 162.88 17.46 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.157 -0.965 . . . . 0.0 110.124 179.944 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 140.56 -157.78 25.83 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 109.673 -1.371 . . . . 0.0 109.673 -179.97 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 63.6 m -143.5 145.55 32.66 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.242 -1.152 . . . . 0.0 110.355 -179.972 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.736 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.4 m -119.8 171.44 8.41 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.241 -0.912 . . . . 0.0 110.279 179.945 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.431 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 47.2 t -100.73 155.44 17.9 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.348 -0.845 . . . . 0.0 108.988 178.635 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.72 HG23 ' CE1' ' A' ' 142' ' ' PHE . 14.4 tt -77.8 -29.56 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.441 0 O-C-N 121.078 -1.014 . . . . 0.0 112.099 -179.063 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.487 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 14.1 p -55.05 -34.87 63.92 Favored 'General case' 0 N--CA 1.513 2.688 0 O-C-N 120.586 -1.321 . . . . 0.0 110.382 -179.136 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -27.7 64.01 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.066 -1.021 . . . . 0.0 109.586 177.53 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 49.5 t -73.03 118.75 71.13 Favored Pre-proline 0 N--CA 1.508 2.431 0 O-C-N 120.975 -1.078 . . . . 0.0 110.397 179.845 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.411 ' HB3' ' HB1' ' A' ' 154' ' ' ALA . 37.4 Cg_endo -64.57 171.88 7.59 Favored 'Trans proline' 0 N--CA 1.489 1.234 0 O-C-N 123.053 1.028 . . . . 0.0 110.591 178.646 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.11 -38.44 61.14 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.201 -0.937 . . . . 0.0 110.505 -179.85 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.41 -42.73 92.46 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.115 -0.99 . . . . 0.0 110.082 -179.789 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -64.15 -41.55 97.12 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.214 -0.929 . . . . 0.0 109.551 179.703 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.716 ' O ' HG11 ' A' ' 140' ' ' VAL . 9.4 mt -61.0 -39.76 90.94 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.273 -0.892 . . . . 0.0 109.827 179.662 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -59.32 -39.43 83.08 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.174 -0.954 . . . . 0.0 110.144 -179.929 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.97 -39.02 84.22 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.216 -0.927 . . . . 0.0 110.293 -179.975 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -64.51 -40.41 95.59 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.295 -0.878 . . . . 0.0 110.015 -179.935 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.454 ' HB1' ' HA ' ' A' ' 139' ' ' GLN . . . -67.12 -40.25 86.79 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.128 -0.982 . . . . 0.0 109.914 179.762 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 13.0 ttp85 -67.27 -33.56 75.57 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.166 -0.959 . . . . 0.0 110.403 179.526 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 18.6 mmtp -75.35 -31.6 60.61 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.025 -1.047 . . . . 0.0 111.04 -179.986 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -101.79 23.07 11.87 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 120.896 -1.127 . . . . 0.0 111.845 -179.917 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.84 47.0 48.47 Favored Glycine 0 N--CA 1.5 2.911 0 O-C-N 120.72 -1.238 . . . . 0.0 110.913 179.238 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.445 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 10.1 t -146.07 -162.31 1.49 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.137 -1.214 . . . . 0.0 110.254 179.884 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 139' ' ' GLN . . . . . 0.454 ' HA ' ' HB1' ' A' ' 133' ' ' ALA . 77.7 mt-30 -132.79 160.61 36.36 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.039 -1.038 . . . . 0.0 110.177 -179.925 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.716 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.8 p -147.56 161.21 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 O-C-N 121.16 -0.962 . . . . 0.0 110.473 -179.794 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 36.1 t -171.62 108.38 0.25 Allowed 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.126 -0.983 . . . . 0.0 111.039 179.727 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.72 ' CE1' HG23 ' A' ' 121' ' ' ILE . 87.0 t80 -104.15 157.07 17.37 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.106 -0.996 . . . . 0.0 110.649 179.906 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.09 -61.9 0.65 Allowed 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 178.662 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -146.43 148.68 32.54 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.54 -0.725 . . . . 0.0 109.164 178.676 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 145' ' ' CYS . . . . . 0.45 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.4 p -91.68 154.89 18.7 Favored 'General case' 0 N--CA 1.508 2.435 0 C-N-CA 119.011 -1.076 . . . . 0.0 110.983 -179.405 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.4 m -72.6 -25.28 22.48 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.5 0 O-C-N 121.367 -0.833 . . . . 0.0 111.735 -179.362 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -49.74 -59.0 4.22 Favored 'General case' 0 N--CA 1.517 2.88 0 O-C-N 120.879 -1.138 . . . . 0.0 110.219 -179.756 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.504 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.3 p -128.0 -163.91 1.32 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.218 -0.926 . . . . 0.0 110.319 179.356 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 149' ' ' GLY . . . . . 0.426 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -101.87 64.26 0.48 Allowed Glycine 0 N--CA 1.491 2.307 0 N-CA-C 107.784 -2.126 . . . . 0.0 107.784 178.278 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 27.6 t -98.95 143.9 28.73 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.36 -1.083 . . . . 0.0 109.724 -179.099 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -100.77 44.3 1.02 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.2 -0.937 . . . . 0.0 109.775 179.41 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 77.69 93.93 0.25 Allowed Glycine 0 N--CA 1.485 1.966 0 N-CA-C 109.872 -1.291 . . . . 0.0 109.872 179.897 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.1 p -108.18 129.01 55.2 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.191 -1.182 . . . . 0.0 110.069 179.67 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 154' ' ' ALA . . . . . 0.411 ' HB1' ' HB3' ' A' ' 125' ' ' PRO . . . -148.36 148.1 29.99 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.187 -0.946 . . . . 0.0 110.245 -179.316 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -112.86 -58.11 2.2 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.199 -0.938 . . . . 0.0 110.37 179.994 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -156.12 50.26 0.52 Allowed 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.135 -0.978 . . . . 0.0 110.635 -179.889 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 . . . . . 0 N--CA 1.495 1.79 0 CA-C-O 117.893 -1.051 . . . . 0.0 110.134 -179.959 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 N-CA-C 109.491 -1.443 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 118.47 100.29 1.98 Allowed Glycine 0 N--CA 1.492 2.413 0 N-CA-C 109.509 -1.437 . . . . 0.0 109.509 -179.966 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -133.7 92.79 22.34 Favored Pre-proline 0 N--CA 1.494 1.726 0 O-C-N 121.215 -1.168 . . . . 0.0 110.218 179.956 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.55 132.32 18.77 Favored 'Trans proline' 0 C--N 1.317 -1.131 0 O-C-N 123.425 1.224 . . . . 0.0 110.366 179.971 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 13.4 tpp85 -133.39 62.36 1.66 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.136 -0.978 . . . . 0.0 110.161 179.904 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.4 tp -137.15 145.51 29.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.19 -0.944 . . . . 0.0 110.113 -179.964 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.0 mtpt -141.32 137.11 32.18 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.205 -0.934 . . . . 0.0 110.218 179.952 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -124.22 40.16 3.8 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.223 -0.923 . . . . 0.0 110.207 -179.941 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -144.57 -174.6 4.37 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.222 -0.924 . . . . 0.0 110.242 179.949 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 31.9 mtt85 -140.06 73.82 1.44 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.184 -0.947 . . . . 0.0 110.263 -179.953 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 46.7 t -142.92 118.02 10.09 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.267 -0.896 . . . . 0.0 110.157 -179.978 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.5 mttp -144.65 153.17 54.39 Favored Pre-proline 0 N--CA 1.494 1.767 0 O-C-N 121.152 -0.967 . . . . 0.0 110.441 -179.911 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -72.66 158.92 49.84 Favored 'Trans proline' 0 C--N 1.318 -1.044 0 O-C-N 123.407 1.214 . . . . 0.0 110.63 179.877 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.784 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -55.84 145.0 54.72 Favored Pre-proline 0 N--CA 1.513 2.721 0 O-C-N 121.305 -0.872 . . . . 0.0 110.035 -179.945 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -71.91 163.25 39.42 Favored 'Trans proline' 0 C--N 1.318 -1.073 0 O-C-N 123.331 1.174 . . . . 0.0 110.719 -179.889 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -48.36 -32.13 7.09 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.465 -0.772 . . . . 0.0 111.399 -179.784 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.75 -33.35 42.17 Favored Glycine 0 N--CA 1.498 2.802 0 O-C-N 120.994 -1.067 . . . . 0.0 110.59 179.73 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -54.04 -32.43 54.43 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 120.884 -1.363 . . . . 0.0 110.723 179.783 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -54.03 -36.39 62.97 Favored 'General case' 0 N--CA 1.512 2.645 0 O-C-N 121.052 -1.03 . . . . 0.0 110.325 179.682 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.9 mtmt -57.12 -35.14 69.11 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.091 -1.005 . . . . 0.0 110.328 179.507 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.688 ' O ' HD12 ' A' ' 23' ' ' LEU . 3.5 pt -118.21 37.16 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 O-C-N 121.072 -1.018 . . . . 0.0 110.57 179.606 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -82.63 -43.58 0.93 Allowed Pre-proline 0 N--CA 1.508 2.46 0 O-C-N 121.063 -1.023 . . . . 0.0 112.989 -179.545 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.8 Cg_endo -75.44 -38.68 1.32 Allowed 'Trans proline' 0 N--CA 1.486 1.048 0 O-C-N 122.577 0.777 . . . . 0.0 111.529 -178.266 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.864 HG21 ' CE2' ' A' ' 62' ' ' TYR . 89.9 m -58.83 -41.77 87.7 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.025 -1.047 . . . . 0.0 109.808 179.898 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.688 HD12 ' O ' ' A' ' 19' ' ' ILE . 1.5 mt -65.24 -38.72 91.25 Favored 'General case' 0 N--CA 1.506 2.366 0 C-N-CA 119.466 -0.894 . . . . 0.0 109.508 179.216 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.2 m -58.3 -35.71 72.26 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.046 -1.034 . . . . 0.0 110.082 179.314 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -56.55 -34.57 67.22 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.098 -1.001 . . . . 0.0 110.427 179.563 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.726 ' CD2' HD12 ' A' ' 55' ' ' LEU . 8.8 m-85 -57.71 -36.18 71.64 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.088 -1.007 . . . . 0.0 110.432 179.829 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -56.64 -35.61 68.55 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.163 -0.961 . . . . 0.0 110.656 -179.638 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.418 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.1 mp -63.84 -42.17 94.98 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.423 0 O-C-N 120.969 -1.082 . . . . 0.0 108.716 179.372 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -67.69 -57.19 6.81 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 119.133 -1.027 . . . . 0.0 108.298 178.521 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.722 HD12 HD23 ' A' ' 55' ' ' LEU . 1.2 tp -54.74 -33.0 60.58 Favored 'General case' 0 N--CA 1.512 2.632 0 C-N-CA 119.363 -0.935 . . . . 0.0 109.75 178.318 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.05 -36.12 70.13 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.09 -1.006 . . . . 0.0 110.404 179.657 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.68 -52.77 61.99 Favored 'General case' 0 N--CA 1.507 2.381 0 C-N-CA 119.075 -1.05 . . . . 0.0 109.427 179.98 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.612 ' HB1' ' HG2' ' A' ' 48' ' ' GLN . . . -69.39 -42.13 75.54 Favored 'General case' 0 N--CA 1.504 2.236 0 C-N-CA 119.048 -1.061 . . . . 0.0 108.609 178.638 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -61.34 -33.65 73.97 Favored 'General case' 0 N--CA 1.503 2.22 0 C-N-CA 119.525 -0.87 . . . . 0.0 110.069 179.266 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 6.4 mtmt -87.79 -34.48 18.28 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.064 -1.022 . . . . 0.0 110.612 179.754 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -55.16 -35.95 65.32 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.938 -1.101 . . . . 0.0 110.262 179.692 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 14.6 tttp -54.19 -37.73 64.84 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 121.048 -1.032 . . . . 0.0 110.485 179.767 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.3 t -107.51 39.99 1.79 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.135 -0.978 . . . . 0.0 110.063 179.691 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -163.15 101.57 0.97 Allowed 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.195 -0.941 . . . . 0.0 110.634 -179.9 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.5 ttmt 53.29 95.26 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.037 -1.039 . . . . 0.0 110.585 -179.891 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.565 HD21 ' OG ' ' A' ' 45' ' ' SER . 4.5 tp -147.08 83.87 1.58 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.128 -0.983 . . . . 0.0 110.448 -179.947 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -108.92 -53.16 2.68 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.258 -0.901 . . . . 0.0 110.146 179.854 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -120.97 42.4 3.06 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.09 -1.006 . . . . 0.0 110.194 179.935 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -159.24 77.77 0.72 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.337 -0.852 . . . . 0.0 110.752 -179.887 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.565 ' OG ' HD21 ' A' ' 41' ' ' LEU . 1.1 m -115.92 -55.51 2.41 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.113 -0.992 . . . . 0.0 110.616 -179.881 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.446 ' HB3' ' CZ2' ' A' ' 50' ' ' TRP . 74.1 m-80 -56.41 -39.38 72.92 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.124 -0.985 . . . . 0.0 110.014 179.853 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -60.81 -38.55 85.78 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.213 -0.929 . . . . 0.0 109.771 179.482 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.612 ' HG2' ' HB1' ' A' ' 33' ' ' ALA . 4.4 tt0 -57.87 -40.98 81.5 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.077 -1.014 . . . . 0.0 109.894 179.827 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.413 ' HA ' HD23 ' A' ' 49' ' ' LEU . 54.0 mt -75.04 -33.11 61.7 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.256 -0.902 . . . . 0.0 110.502 179.844 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.504 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 45.9 m0 -58.66 -38.85 79.05 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 120.905 -1.122 . . . . 0.0 109.738 179.566 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.45 ' O ' HD22 ' A' ' 55' ' ' LEU . 13.5 mt-10 -66.02 -32.39 73.83 Favored 'General case' 0 N--CA 1.502 2.136 0 C-N-CA 119.035 -1.066 . . . . 0.0 109.371 178.271 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.691 HG23 HD11 ' A' ' 30' ' ' LEU . 4.4 mt -72.44 -55.56 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.214 0 O-C-N 120.981 -1.075 . . . . 0.0 109.7 179.585 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.3 ptm -60.08 -24.36 64.53 Favored 'General case' 0 N--CA 1.509 2.492 0 C-N-CA 118.259 -1.376 . . . . 0.0 110.003 178.883 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -64.98 -35.41 81.08 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 120.756 -1.215 . . . . 0.0 109.76 178.369 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.726 HD12 ' CD2' ' A' ' 26' ' ' PHE . 0.8 OUTLIER -54.62 -35.8 63.8 Favored 'General case' 0 N--CA 1.514 2.73 0 O-C-N 120.846 -1.159 . . . . 0.0 109.834 179.387 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.458 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 26.2 t60 -52.22 -37.15 54.22 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 120.949 -1.095 . . . . 0.0 110.483 -179.746 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.451 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.4 m170 -67.95 -48.53 65.63 Favored 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 119.143 -1.023 . . . . 0.0 109.463 179.494 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -61.81 -37.04 82.93 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 119.286 -0.966 . . . . 0.0 109.594 179.154 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.408 ' HG3' ' CE2' ' A' ' 26' ' ' PHE . 3.0 mtt180 -66.27 -46.48 76.88 Favored 'General case' 0 N--CA 1.508 2.451 0 C-N-CA 119.29 -0.964 . . . . 0.0 109.641 179.364 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.5 p -62.25 -39.53 93.18 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.13 -0.981 . . . . 0.0 109.503 179.526 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 10.7 tpp85 -64.31 -42.61 96.26 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.103 -0.998 . . . . 0.0 109.101 179.307 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.864 ' CE2' HG21 ' A' ' 22' ' ' THR . 59.6 t80 -63.19 -49.04 75.81 Favored 'General case' 0 N--CA 1.507 2.389 0 C-N-CA 119.491 -0.884 . . . . 0.0 109.464 179.422 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.61 HD12 ' HB2' ' A' ' 87' ' ' ALA . 85.2 mt -69.31 -38.74 78.01 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.331 0 C-N-CA 119.305 -0.958 . . . . 0.0 109.238 179.538 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.43 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 9.0 t80 -66.57 -41.7 88.2 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.169 -0.957 . . . . 0.0 108.943 178.978 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.405 ' HA ' ' HD3' ' A' ' 69' ' ' LYS . 86.9 m -60.49 -41.28 93.92 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.126 -0.984 . . . . 0.0 110.366 -179.735 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.593 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.2 -34.8 25.83 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 118.825 -1.15 . . . . 0.0 112.528 -178.978 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.535 ' N ' HD12 ' A' ' 66' ' ' LEU . 32.9 t80 -86.49 -32.59 20.7 Favored 'General case' 0 N--CA 1.513 2.706 0 O-C-N 120.628 -1.295 . . . . 0.0 112.066 -179.184 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.43 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 7.5 m-85 -98.43 -8.84 26.11 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 120.787 -1.196 . . . . 0.0 113.178 -178.524 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.405 ' HD3' ' HA ' ' A' ' 65' ' ' THR . 5.1 mtpm? -127.8 -58.4 1.23 Allowed 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.373 -1.454 . . . . 0.0 110.69 179.693 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.41 ' HB2' ' HA ' ' A' ' 66' ' ' LEU . 67.7 mtp180 -69.84 -28.82 66.01 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.119 -0.988 . . . . 0.0 110.741 -179.802 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.0 ttmt 58.92 43.5 17.91 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.768 -1.207 . . . . 0.0 109.932 -179.451 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.71 34.47 3.96 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.366 -0.834 . . . . 0.0 109.897 179.288 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.708 HG13 HD23 ' A' ' 77' ' ' LEU . 13.9 tt -153.21 162.34 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.144 -0.973 . . . . 0.0 109.856 -179.962 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.6 p -108.61 147.48 31.77 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.103 -0.998 . . . . 0.0 110.128 179.844 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 24.8 ttmt -46.36 -31.7 2.76 Favored 'General case' 0 N--CA 1.514 2.733 0 O-C-N 121.333 -0.854 . . . . 0.0 111.653 -179.978 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -62.2 -51.3 68.33 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.944 -1.097 . . . . 0.0 109.412 179.566 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.708 HD23 HG13 ' A' ' 73' ' ' ILE . 32.4 tp -65.97 -44.36 85.17 Favored 'General case' 0 N--CA 1.504 2.273 0 C-N-CA 119.168 -1.013 . . . . 0.0 108.538 178.902 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 17.0 t80 -60.77 -39.2 87.91 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.369 -0.832 . . . . 0.0 109.344 179.169 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -72.47 -42.04 65.38 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.141 -0.975 . . . . 0.0 108.876 178.771 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.784 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 88.8 t90 -56.28 -36.65 68.86 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 121.195 -0.941 . . . . 0.0 109.734 178.926 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.782 HD22 ' CD2' ' A' ' 86' ' ' TYR . 62.8 mt -70.14 -46.77 64.07 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.177 -0.952 . . . . 0.0 108.897 178.954 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.427 HD13 ' O ' ' A' ' 87' ' ' ALA . 33.3 mm -55.68 -33.02 32.57 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.669 0 O-C-N 121.24 -0.913 . . . . 0.0 109.83 179.261 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.34 -15.11 34.14 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 120.99 -1.069 . . . . 0.0 112.261 -179.909 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.453 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 64.3 mm-40 -104.94 23.15 14.01 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 120.475 -1.391 . . . . 0.0 112.165 -179.609 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.4 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 7.5 tttt 75.99 68.42 0.07 Allowed 'General case' 0 N--CA 1.511 2.62 0 O-C-N 121.051 -1.031 . . . . 0.0 112.028 179.277 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.782 ' CD2' HD22 ' A' ' 81' ' ' LEU . 31.4 m-85 -131.87 -63.35 0.82 Allowed 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 178.784 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.61 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -137.41 162.07 34.62 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.482 -0.761 . . . . 0.0 109.07 178.914 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.458 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 21.8 t0 -113.71 117.07 30.5 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.084 -1.01 . . . . 0.0 110.403 -179.804 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 6.1 mtpt -58.51 -38.76 78.37 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.206 -0.934 . . . . 0.0 109.86 179.742 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 47.4 tp -59.65 -40.22 87.01 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.101 -0.999 . . . . 0.0 109.756 179.629 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.747 ' HA ' HD21 ' A' ' 106' ' ' LEU . 66.1 tp -67.09 -52.45 41.88 Favored 'General case' 0 N--CA 1.508 2.426 0 C-N-CA 119.271 -0.972 . . . . 0.0 108.643 179.227 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 54.6 mt -58.6 -32.53 46.29 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.396 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.103 178.409 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.48 -42.86 78.06 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.046 -1.034 . . . . 0.0 109.521 178.833 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.458 ' HD3' HD23 ' A' ' 106' ' ' LEU . 7.5 mttp -59.6 -41.22 89.82 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.119 -0.988 . . . . 0.0 110.14 179.465 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.3 m0 -65.1 -39.49 93.22 Favored 'General case' 0 N--CA 1.508 2.469 0 C-N-CA 119.125 -1.03 . . . . 0.0 109.836 179.569 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 3.2 mtp85 -75.95 -29.93 58.47 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.268 -0.895 . . . . 0.0 110.566 179.304 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.5 mmtm -54.18 -176.49 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.652 0 O-C-N 120.86 -1.15 . . . . 0.0 110.589 179.771 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 53.7 m -105.07 131.57 52.4 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.166 -0.959 . . . . 0.0 109.772 179.296 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.35 8.33 50.11 Favored Glycine 0 N--CA 1.493 2.489 0 C-N-CA 120.196 -1.002 . . . . 0.0 111.109 -179.449 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -114.75 68.17 0.7 Allowed 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 119.499 1.65 . . . . 0.0 109.946 179.672 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -84.54 -38.53 19.89 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.079 -1.013 . . . . 0.0 109.983 179.787 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.82 90.34 3.31 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.126 -0.984 . . . . 0.0 109.969 179.842 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.927 HD13 HD13 ' A' ' 109' ' ' ILE . 9.9 tp -126.99 134.68 50.31 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.279 -0.888 . . . . 0.0 109.664 -179.647 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.451 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.3 p -108.76 -37.93 5.76 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.201 -0.937 . . . . 0.0 112.356 -179.791 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.828 ' O ' HD11 ' A' ' 103' ' ' LEU . 7.5 m -139.92 -167.93 2.4 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.22 -1.55 . . . . 0.0 109.877 178.905 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.747 HD21 ' HA ' ' A' ' 91' ' ' LEU . 17.3 mt -98.22 -37.76 9.56 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.132 -0.98 . . . . 0.0 110.674 179.493 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 30.8 ttm-85 -102.52 33.33 3.2 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.949 -1.095 . . . . 0.0 109.311 178.055 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.66 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.312 1.7 t -128.61 17.12 6.41 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.322 -0.861 . . . . 0.0 108.838 -179.06 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.927 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -159.1 38.54 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 120.814 -1.179 . . . . 0.0 110.434 -178.904 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.779 ' C ' HG23 ' A' ' 119' ' ' THR . 12.7 mm-40 -103.96 106.83 17.46 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 120.74 -1.225 . . . . 0.0 110.913 -178.769 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.422 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 14.3 ttmt -105.38 -50.51 3.21 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.332 -0.855 . . . . 0.0 110.445 179.688 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -113.69 118.79 35.32 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.129 -0.982 . . . . 0.0 110.309 179.901 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -150.82 -164.87 2.12 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.26 -0.9 . . . . 0.0 110.379 -179.88 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 8.1 p -115.95 163.84 15.3 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.179 -0.951 . . . . 0.0 110.215 179.957 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 64.48 -70.93 0.08 Allowed 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.137 -0.977 . . . . 0.0 110.809 179.917 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -116.21 163.94 15.22 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.95 -1.094 . . . . 0.0 110.299 -179.894 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -141.19 96.48 0.2 Allowed Glycine 0 N--CA 1.493 2.44 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 179.997 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 4.5 m -137.01 132.02 33.69 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.192 -1.181 . . . . 0.0 110.138 179.952 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.779 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.2 OUTLIER -126.88 173.18 9.79 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.137 -0.977 . . . . 0.0 110.527 -179.865 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.439 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 43.3 t -108.02 155.31 20.5 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.436 -0.79 . . . . 0.0 108.922 178.727 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.794 HD12 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -70.62 -37.15 68.48 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.425 0 O-C-N 121.027 -1.045 . . . . 0.0 110.633 -179.404 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.449 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 6.7 p -55.36 -33.6 63.56 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 120.818 -1.176 . . . . 0.0 110.752 -179.29 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.505 ' HG2' HG22 ' A' ' 109' ' ' ILE . 0.0 OUTLIER -58.92 -33.46 70.59 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 120.924 -1.11 . . . . 0.0 109.71 178.325 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 62.0 t -81.17 125.22 79.96 Favored Pre-proline 0 N--CA 1.504 2.269 0 O-C-N 121.163 -0.961 . . . . 0.0 109.725 179.688 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -65.73 170.26 11.63 Favored 'Trans proline' 0 N--CA 1.487 1.111 0 O-C-N 123.119 1.062 . . . . 0.0 110.659 179.582 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 5.9 tpt180 -75.12 -36.42 61.64 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.303 -0.873 . . . . 0.0 110.721 -179.753 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.76 -41.4 81.87 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 120.963 -1.085 . . . . 0.0 110.093 -179.8 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -68.33 -41.34 80.94 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.215 -0.928 . . . . 0.0 109.232 179.275 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.408 HD22 HG21 ' A' ' 140' ' ' VAL . 2.7 mt -63.63 -39.28 93.95 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.249 -0.907 . . . . 0.0 109.676 179.308 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -59.31 -39.66 83.76 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.13 -0.981 . . . . 0.0 109.924 179.716 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -59.88 -37.9 80.68 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.1 -1.0 . . . . 0.0 110.127 179.724 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -61.81 -46.43 89.55 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.178 -0.952 . . . . 0.0 109.869 179.904 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.544 ' HB1' ' HA ' ' A' ' 139' ' ' GLN . . . -61.07 -40.98 95.73 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.218 -0.926 . . . . 0.0 109.906 -179.998 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 19.9 ttt85 -64.98 -30.96 71.99 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.185 -0.947 . . . . 0.0 110.689 179.798 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.43 -29.03 23.16 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 120.95 -1.094 . . . . 0.0 111.361 -179.811 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 23.6 mttt -98.6 24.12 7.84 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 120.783 -1.198 . . . . 0.0 111.724 -179.909 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.16 46.74 42.73 Favored Glycine 0 N--CA 1.5 2.952 0 O-C-N 120.771 -1.205 . . . . 0.0 111.077 179.26 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.483 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 9.7 t -148.93 -164.18 1.96 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.069 -1.253 . . . . 0.0 110.533 179.846 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 139' ' ' GLN . . . . . 0.544 ' HA ' ' HB1' ' A' ' 133' ' ' ALA . 53.5 mt-30 -139.52 149.7 44.24 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.224 -0.923 . . . . 0.0 110.302 -179.867 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.408 HG21 HD22 ' A' ' 129' ' ' LEU . 7.4 p -132.66 161.0 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 O-C-N 121.221 -0.924 . . . . 0.0 110.2 -179.979 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 41.0 t -168.19 85.6 0.2 Allowed 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.167 -0.958 . . . . 0.0 111.099 -179.963 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.794 ' CG ' HD12 ' A' ' 121' ' ' ILE . 50.5 t80 -99.38 160.48 14.25 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.261 -0.899 . . . . 0.0 110.486 -179.926 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 -137.06 -61.29 0.66 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.509 -0.744 . . . . 0.0 109.02 178.967 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -134.69 152.04 51.47 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.428 -0.795 . . . . 0.0 108.95 178.669 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 31.5 p -92.85 152.77 19.23 Favored 'General case' 0 N--CA 1.504 2.267 0 C-N-CA 119.028 -1.069 . . . . 0.0 111.085 -179.552 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.9 m -70.61 -26.38 28.35 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.407 0 O-C-N 121.427 -0.795 . . . . 0.0 111.307 -179.522 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -50.49 -58.49 5.65 Favored 'General case' 0 N--CA 1.516 2.841 0 O-C-N 120.855 -1.153 . . . . 0.0 110.213 -179.993 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.504 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 26.0 p -127.59 -166.71 1.64 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.261 -0.899 . . . . 0.0 110.566 179.656 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 149' ' ' GLY . . . . . 0.44 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.06 57.66 0.8 Allowed Glycine 0 N--CA 1.493 2.442 0 N-CA-C 107.958 -2.057 . . . . 0.0 107.958 178.405 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 19.3 t -101.67 142.61 32.75 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.318 -1.107 . . . . 0.0 109.784 -179.305 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 57.5 mtp85 -95.9 52.45 1.32 Allowed 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.273 -0.892 . . . . 0.0 109.736 179.353 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.89 98.41 0.03 OUTLIER Glycine 0 N--CA 1.488 2.123 0 N-CA-C 109.866 -1.293 . . . . 0.0 109.866 179.956 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 22.6 p -110.44 131.08 55.36 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.266 -1.138 . . . . 0.0 110.356 179.552 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -142.32 141.38 32.37 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.096 -1.003 . . . . 0.0 110.038 -179.802 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 155' ' ' SER . . . . . 0.402 ' O ' ' OG1' ' A' ' 156' ' ' THR . 0.7 OUTLIER -108.05 69.38 0.73 Allowed 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.258 -0.901 . . . . 0.0 110.223 179.972 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 156' ' ' THR . . . . . 0.402 ' OG1' ' O ' ' A' ' 155' ' ' SER . 80.0 p 46.42 52.61 10.57 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.346 -0.846 . . . . 0.0 111.452 179.896 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.229 179.917 . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.344 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 62.69 76.57 0.25 Allowed Glycine 0 N--CA 1.493 2.435 0 N-CA-C 109.534 -1.427 . . . . 0.0 109.534 179.938 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.44 ' OG ' ' HD2' ' A' ' 2' ' ' PRO . 0.1 OUTLIER -135.43 173.03 6.18 Favored Pre-proline 0 N--CA 1.494 1.742 0 O-C-N 121.24 -1.153 . . . . 0.0 110.162 179.977 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.44 ' HD2' ' OG ' ' A' ' 1' ' ' SER . 46.0 Cg_endo -72.68 -38.54 3.14 Favored 'Trans proline' 0 C--N 1.317 -1.117 0 O-C-N 123.443 1.233 . . . . 0.0 110.613 -179.973 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 52.1 mtm-85 -114.28 -172.66 2.14 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.199 -0.938 . . . . 0.0 110.146 -179.995 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 79.6 mt -110.25 -54.82 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.192 -0.943 . . . . 0.0 110.145 179.901 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.5 pttt -157.66 157.0 32.74 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.346 -0.847 . . . . 0.0 110.831 179.869 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.8 t -132.58 157.43 44.76 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.216 -0.927 . . . . 0.0 110.241 -179.972 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.7 mtt85 -143.63 -177.5 5.43 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.288 -0.882 . . . . 0.0 110.359 -179.982 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.21 132.05 56.77 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.234 -0.916 . . . . 0.0 110.106 179.902 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.5 p -134.13 -175.39 3.84 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.165 -0.96 . . . . 0.0 110.288 -179.865 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 24.2 tptt -138.88 107.0 7.49 Favored Pre-proline 0 N--CA 1.494 1.759 0 O-C-N 121.272 -0.893 . . . . 0.0 110.193 -179.96 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.38 157.98 52.28 Favored 'Trans proline' 0 C--N 1.319 -1.016 0 O-C-N 123.186 1.098 . . . . 0.0 110.746 179.969 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.801 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -108.47 153.46 42.07 Favored Pre-proline 0 N--CA 1.498 1.966 0 O-C-N 121.484 -0.76 . . . . 0.0 109.906 179.754 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -69.67 164.79 33.12 Favored 'Trans proline' 0 C--N 1.316 -1.134 0 O-C-N 123.377 1.199 . . . . 0.0 110.869 -179.682 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -47.66 -32.48 5.71 Favored 'General case' 0 N--CA 1.516 2.844 0 O-C-N 121.435 -0.791 . . . . 0.0 111.493 -179.743 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.61 -35.39 51.78 Favored Glycine 0 N--CA 1.498 2.812 0 N-CA-C 110.373 -1.091 . . . . 0.0 110.373 179.771 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.46 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 24.3 t80 -55.75 -33.58 64.42 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 120.948 -1.324 . . . . 0.0 110.681 179.713 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -54.99 -38.45 67.87 Favored 'General case' 0 N--CA 1.513 2.676 0 O-C-N 120.993 -1.067 . . . . 0.0 110.106 179.807 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.2 mmtm -58.81 -35.52 73.0 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.359 -0.838 . . . . 0.0 110.192 179.44 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.662 ' O ' HD12 ' A' ' 23' ' ' LEU . 3.2 pt -116.73 36.13 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.135 -0.978 . . . . 0.0 110.616 179.732 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 3.5 tmtt? -82.53 -43.38 0.95 Allowed Pre-proline 0 N--CA 1.509 2.484 0 O-C-N 121.003 -1.06 . . . . 0.0 112.941 -179.43 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 48.8 Cg_endo -76.95 -36.58 1.4 Allowed 'Trans proline' 0 N--CA 1.486 1.08 0 O-C-N 122.639 0.81 . . . . 0.0 111.527 -178.561 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.978 HG21 ' CE2' ' A' ' 62' ' ' TYR . 91.1 m -59.37 -43.45 92.87 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 120.932 -1.105 . . . . 0.0 110.083 -179.664 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.662 HD12 ' O ' ' A' ' 19' ' ' ILE . 1.0 OUTLIER -61.26 -36.33 79.7 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.263 -0.898 . . . . 0.0 110.021 179.642 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.45 -36.52 73.81 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 120.92 -1.112 . . . . 0.0 110.176 179.472 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -58.1 -34.31 70.06 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.049 -1.032 . . . . 0.0 110.379 179.601 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.769 ' CD2' HD12 ' A' ' 55' ' ' LEU . 8.8 m-85 -56.65 -42.49 79.01 Favored 'General case' 0 N--CA 1.512 2.65 0 O-C-N 120.911 -1.118 . . . . 0.0 110.008 179.54 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -57.81 -26.53 62.11 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.367 -0.933 . . . . 0.0 110.453 179.274 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 13.1 mm -67.12 -51.08 57.62 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.291 0 O-C-N 120.945 -1.097 . . . . 0.0 108.485 179.225 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.4 tp60 -64.23 -52.02 60.8 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.227 -0.92 . . . . 0.0 108.546 178.852 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.729 HD12 HD23 ' A' ' 55' ' ' LEU . 1.1 tp -57.03 -36.89 71.0 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.24 -0.913 . . . . 0.0 109.64 178.905 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -57.38 -37.62 72.95 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.084 -1.01 . . . . 0.0 110.123 179.784 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.61 -50.14 72.45 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.11 -0.993 . . . . 0.0 109.517 179.803 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.484 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -68.14 -42.86 79.49 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 119.016 -1.074 . . . . 0.0 108.89 178.96 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -61.3 -32.11 71.96 Favored 'General case' 0 N--CA 1.504 2.266 0 C-N-CA 119.576 -0.849 . . . . 0.0 110.213 179.374 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.5 mmpt? -96.28 -20.46 18.51 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 120.975 -1.078 . . . . 0.0 111.71 -179.96 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.556 ' O ' HD22 ' A' ' 41' ' ' LEU . 20.4 t0 -53.48 -35.13 60.24 Favored 'General case' 0 N--CA 1.513 2.681 0 O-C-N 120.672 -1.268 . . . . 0.0 110.534 -179.966 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.8 tttp -53.71 -47.31 70.64 Favored 'General case' 0 N--CA 1.512 2.661 0 O-C-N 121.091 -1.005 . . . . 0.0 110.378 -179.997 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 52.31 -165.59 0.06 Allowed 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.097 -1.002 . . . . 0.0 110.895 179.908 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.51 -47.73 4.18 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.177 -0.952 . . . . 0.0 110.389 179.965 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.81 83.7 1.84 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.177 -0.952 . . . . 0.0 109.902 179.83 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.556 HD22 ' O ' ' A' ' 36' ' ' ASP . 2.4 tp -148.41 -57.37 0.22 Allowed 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.215 -0.928 . . . . 0.0 110.731 -179.9 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.421 ' O ' ' HB3' ' A' ' 43' ' ' ALA . . . 54.91 176.87 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.014 -1.053 . . . . 0.0 110.593 -179.93 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.421 ' HB3' ' O ' ' A' ' 42' ' ' ALA . . . 58.9 162.25 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.15 -0.968 . . . . 0.0 110.355 -179.879 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.2 mttp 51.28 66.07 1.3 Allowed 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.886 -1.134 . . . . 0.0 110.709 -179.8 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 63.2 m -110.9 -53.24 2.72 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.199 -0.938 . . . . 0.0 110.482 -179.92 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.408 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 18.0 m120 -57.29 -40.96 78.87 Favored 'General case' 0 N--CA 1.51 2.561 0 O-C-N 121.205 -0.934 . . . . 0.0 109.844 179.838 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -59.94 -38.67 83.09 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.219 -0.926 . . . . 0.0 109.941 179.62 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.437 ' HG2' ' HB1' ' A' ' 33' ' ' ALA . 0.5 OUTLIER -59.47 -40.23 86.25 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.17 -0.956 . . . . 0.0 110.265 179.985 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 91.4 mt -74.8 -31.69 61.79 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.227 -0.921 . . . . 0.0 110.716 -179.929 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.486 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 40.2 m0 -57.98 -39.69 78.81 Favored 'General case' 0 N--CA 1.512 2.67 0 O-C-N 120.842 -1.161 . . . . 0.0 109.245 179.134 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.0 -34.74 78.4 Favored 'General case' 0 N--CA 1.499 1.985 0 C-N-CA 119.046 -1.062 . . . . 0.0 108.807 177.626 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.693 HG23 HD11 ' A' ' 30' ' ' LEU . 5.1 mt -71.74 -56.75 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.175 0 O-C-N 121.114 -0.991 . . . . 0.0 109.358 179.106 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.554 ' HE1' ' O ' ' A' ' 147' ' ' HIS . 0.3 OUTLIER -58.22 -25.88 62.18 Favored 'General case' 0 N--CA 1.512 2.633 0 C-N-CA 118.208 -1.397 . . . . 0.0 109.884 178.72 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.5 mt-30 -62.17 -37.14 84.11 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.874 -1.141 . . . . 0.0 109.376 178.165 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.769 HD12 ' CD2' ' A' ' 26' ' ' PHE . 1.0 OUTLIER -53.76 -35.67 61.52 Favored 'General case' 0 N--CA 1.513 2.683 0 O-C-N 120.933 -1.105 . . . . 0.0 109.73 179.099 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.466 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 33.5 t60 -51.51 -36.86 46.49 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.039 -1.038 . . . . 0.0 110.449 179.975 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.453 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 15.3 m170 -71.2 -46.77 60.54 Favored 'General case' 0 N--CA 1.505 2.29 0 C-N-CA 119.225 -0.99 . . . . 0.0 109.088 179.222 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.428 ' HB3' ' CE2' ' A' ' 26' ' ' PHE . 5.6 tt0 -63.2 -35.4 80.18 Favored 'General case' 0 N--CA 1.505 2.284 0 C-N-CA 119.249 -0.98 . . . . 0.0 109.41 178.696 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.46 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -68.26 -48.91 63.79 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.138 -0.976 . . . . 0.0 109.292 179.259 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.4 p -63.86 -38.53 91.43 Favored 'General case' 0 N--CA 1.503 2.198 0 C-N-CA 119.356 -0.938 . . . . 0.0 109.231 179.161 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.407 ' O ' ' OG1' ' A' ' 65' ' ' THR . 5.1 ttt-85 -65.73 -42.04 91.52 Favored 'General case' 0 N--CA 1.504 2.275 0 C-N-CA 119.246 -0.982 . . . . 0.0 109.106 179.125 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.978 ' CE2' HG21 ' A' ' 22' ' ' THR . 54.4 t80 -62.8 -48.75 77.75 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.189 -0.944 . . . . 0.0 109.357 179.377 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.677 HD12 ' HB2' ' A' ' 87' ' ' ALA . 89.6 mt -71.02 -39.94 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.328 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.245 179.574 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.424 ' HD2' HD13 ' A' ' 92' ' ' ILE . 10.3 t80 -65.3 -42.12 93.37 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.245 -0.91 . . . . 0.0 108.839 179.027 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.419 HG23 ' HD2' ' A' ' 69' ' ' LYS . 92.0 m -61.27 -41.83 97.6 Favored 'General case' 0 N--CA 1.502 2.135 0 C-N-CA 119.283 -0.967 . . . . 0.0 110.54 -179.614 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.537 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.6 pp -83.09 -32.35 26.82 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 118.811 -1.156 . . . . 0.0 112.323 -178.944 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.426 ' CD2' HG23 ' A' ' 73' ' ' ILE . 31.1 t80 -86.44 -32.53 20.81 Favored 'General case' 0 N--CA 1.511 2.591 0 O-C-N 120.708 -1.245 . . . . 0.0 111.781 -179.454 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.402 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 8.3 m-85 -98.42 -25.38 14.82 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 120.716 -1.24 . . . . 0.0 112.525 -178.661 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.419 ' HD2' HG23 ' A' ' 65' ' ' THR . 63.3 mttt -108.55 -57.52 2.12 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.596 -1.315 . . . . 0.0 110.717 179.968 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.467 HH11 ' HB2' ' A' ' 72' ' ' ALA . 28.4 ttt-85 -72.92 -30.22 63.73 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.242 -0.911 . . . . 0.0 111.009 -179.388 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.5 mttp 56.62 42.39 27.14 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.743 -1.223 . . . . 0.0 110.041 -179.468 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.467 ' HB2' HH11 ' A' ' 70' ' ' ARG . . . -108.84 34.18 3.83 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.423 -0.798 . . . . 0.0 109.845 179.119 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.737 HG13 HD23 ' A' ' 77' ' ' LEU . 13.9 tt -149.21 162.84 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.17 -0.956 . . . . 0.0 109.58 -179.938 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 62.0 m -107.44 144.24 34.64 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.013 -1.054 . . . . 0.0 110.378 179.972 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -45.24 -32.71 2.03 Favored 'General case' 0 N--CA 1.515 2.805 0 O-C-N 121.353 -0.842 . . . . 0.0 111.562 179.988 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -61.82 -51.09 69.66 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 120.908 -1.12 . . . . 0.0 109.19 179.329 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.737 HD23 HG13 ' A' ' 73' ' ' ILE . 37.2 tp -66.13 -43.85 85.91 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.186 -1.006 . . . . 0.0 108.322 178.637 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.683 ' HA ' HD12 ' A' ' 81' ' ' LEU . 15.5 t80 -58.98 -41.45 87.58 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.359 -0.838 . . . . 0.0 109.173 178.956 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -72.32 -42.3 65.59 Favored 'General case' 0 N--CA 1.504 2.271 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 178.222 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.801 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 86.5 t90 -56.12 -36.78 68.6 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.231 -0.918 . . . . 0.0 109.359 178.464 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.683 HD12 ' HA ' ' A' ' 78' ' ' TYR . 11.1 mt -66.59 -59.56 3.51 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.232 -0.917 . . . . 0.0 108.769 178.927 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.46 HG13 ' HB3' ' A' ' 87' ' ' ALA . 2.5 mt -56.27 -27.73 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.584 0 O-C-N 120.907 -1.12 . . . . 0.0 109.927 179.352 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 56.1 tttt -81.5 -21.02 38.91 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.896 -1.127 . . . . 0.0 110.971 178.579 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.442 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 20.3 mm-40 -105.44 22.72 14.96 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.809 -1.182 . . . . 0.0 111.979 179.91 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.416 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 4.2 tmtt? 77.3 67.73 0.05 OUTLIER 'General case' 0 N--CA 1.515 2.811 0 O-C-N 121.207 -0.933 . . . . 0.0 112.075 179.167 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.487 ' HE2' HD13 ' A' ' 23' ' ' LEU . 20.8 m-85 -130.28 -62.59 0.93 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.409 -0.807 . . . . 0.0 108.938 178.839 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.677 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -131.26 167.62 18.9 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.406 -0.809 . . . . 0.0 109.581 179.463 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.466 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 13.3 t0 -120.13 114.6 22.2 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.187 -0.945 . . . . 0.0 110.338 179.897 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -58.1 -38.16 75.93 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.24 -0.912 . . . . 0.0 110.028 179.803 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.637 HD23 HD22 ' A' ' 106' ' ' LEU . 13.5 tp -58.69 -38.19 77.72 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.211 -0.931 . . . . 0.0 110.144 179.842 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.584 ' HA ' HD21 ' A' ' 106' ' ' LEU . 62.8 tp -69.42 -52.34 27.83 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.007 -1.058 . . . . 0.0 108.854 179.41 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.424 HD13 ' HD2' ' A' ' 64' ' ' TYR . 69.0 mt -60.33 -32.7 51.57 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 C-N-CA 119.249 -0.98 . . . . 0.0 108.978 178.33 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.42 -49.27 67.32 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 120.989 -1.069 . . . . 0.0 109.267 178.826 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.491 ' HD3' HD23 ' A' ' 106' ' ' LEU . 11.2 mttp -56.55 -42.11 77.97 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.004 -1.06 . . . . 0.0 109.618 179.243 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.419 ' CZ3' ' HG ' ' A' ' 91' ' ' LEU . 3.8 m0 -62.17 -30.99 71.44 Favored 'General case' 0 N--CA 1.504 2.273 0 C-N-CA 119.142 -1.023 . . . . 0.0 109.634 178.682 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.15 22.58 10.23 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 120.953 -1.092 . . . . 0.0 111.117 179.048 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.458 ' HB2' ' CD2' ' A' ' 100' ' ' TYR . 8.0 mmtp -102.17 -174.06 2.49 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 120.686 -1.259 . . . . 0.0 109.628 179.052 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 56.5 m -102.57 127.43 49.65 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.112 -0.992 . . . . 0.0 109.678 179.244 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.69 9.22 50.37 Favored Glycine 0 N--CA 1.493 2.454 0 C-N-CA 120.187 -1.006 . . . . 0.0 111.038 -179.218 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.458 ' CD2' ' HB2' ' A' ' 97' ' ' LYS . 44.6 m-85 -111.15 48.87 0.91 Allowed 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 119.598 1.699 . . . . 0.0 110.219 179.744 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -59.52 -38.48 81.1 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.112 -0.992 . . . . 0.0 109.988 179.862 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -122.06 121.25 36.56 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.18 -0.95 . . . . 0.0 110.202 -179.966 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.88 HD13 HD13 ' A' ' 109' ' ' ILE . 9.7 tp -153.74 131.3 11.42 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.185 -0.947 . . . . 0.0 110.259 -179.674 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.453 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.4 p -108.98 -37.06 5.93 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.228 -0.92 . . . . 0.0 112.227 179.988 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.79 ' O ' HD11 ' A' ' 103' ' ' LEU . 7.3 m -140.97 -168.62 2.64 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.216 -1.552 . . . . 0.0 110.118 178.943 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.637 HD22 HD23 ' A' ' 90' ' ' LEU . 15.8 mt -97.18 -38.44 9.71 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.97 -1.082 . . . . 0.0 110.368 179.298 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 1.1 ttt85 -101.71 31.57 3.77 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.954 -1.091 . . . . 0.0 109.612 178.195 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.667 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.305 1.7 t -127.72 16.13 6.94 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.123 -0.986 . . . . 0.0 109.021 -179.344 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.88 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -158.88 38.41 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.369 0 O-C-N 120.937 -1.102 . . . . 0.0 110.423 -178.953 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.746 ' C ' HG23 ' A' ' 119' ' ' THR . 4.2 tt0 -107.49 109.14 20.75 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 120.838 -1.164 . . . . 0.0 111.314 -178.625 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.422 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 14.3 ttmt -111.75 -55.14 2.54 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.332 -0.855 . . . . 0.0 110.114 179.473 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 9.1 t30 53.04 -170.05 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.028 -1.045 . . . . 0.0 110.85 179.951 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -116.48 93.35 4.18 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.226 -0.921 . . . . 0.0 110.071 179.895 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -142.4 -174.04 4.02 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.3 -0.875 . . . . 0.0 110.094 -179.867 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.44 -43.21 7.74 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.213 -0.929 . . . . 0.0 109.915 179.648 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -127.46 49.44 2.11 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.19 -0.944 . . . . 0.0 110.009 179.728 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -65.32 -164.01 1.06 Allowed Glycine 0 N--CA 1.493 2.494 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.927 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 47.2 m -144.15 101.27 3.69 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.233 -1.157 . . . . 0.0 110.366 -179.933 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.746 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.1 m -119.27 172.9 7.27 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.251 -0.906 . . . . 0.0 110.123 179.749 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.428 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 47.2 t -103.93 155.05 18.95 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.361 -0.837 . . . . 0.0 109.113 178.889 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.807 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -71.72 -36.19 58.16 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.372 0 O-C-N 121.056 -1.027 . . . . 0.0 110.77 -179.344 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.451 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.4 p -54.58 -32.55 58.79 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 120.772 -1.205 . . . . 0.0 110.9 -179.108 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.455 ' HG3' HG22 ' A' ' 109' ' ' ILE . 6.7 ttt-85 -58.75 -35.02 72.07 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 120.974 -1.079 . . . . 0.0 109.409 178.123 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 47.3 t -81.39 125.5 78.71 Favored Pre-proline 0 N--CA 1.504 2.253 0 O-C-N 121.282 -0.886 . . . . 0.0 109.669 179.539 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.635 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.3 Cg_endo -66.01 177.93 2.71 Favored 'Trans proline' 0 N--CA 1.489 1.242 0 O-C-N 123.126 1.067 . . . . 0.0 110.698 179.807 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -75.18 -37.78 61.09 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.23 -0.919 . . . . 0.0 110.548 -179.766 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.51 -41.72 86.06 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.062 -1.024 . . . . 0.0 109.967 -179.804 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -68.6 -41.36 79.71 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.22 -0.925 . . . . 0.0 109.209 179.307 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.635 HD12 ' O ' ' A' ' 125' ' ' PRO . 3.5 mt -64.29 -38.78 92.24 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.265 -0.897 . . . . 0.0 109.651 179.278 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -61.65 -40.56 95.35 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.123 -0.986 . . . . 0.0 109.721 179.802 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -60.42 -39.13 86.33 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.214 -0.929 . . . . 0.0 110.099 179.848 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -59.9 -41.07 90.84 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.232 -0.917 . . . . 0.0 110.038 -179.985 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.0 -45.17 94.8 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.186 -0.946 . . . . 0.0 109.91 179.911 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 3.5 ttt85 -59.33 -38.49 80.46 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.131 -0.98 . . . . 0.0 109.867 179.46 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -58.54 -35.62 72.6 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.223 -0.923 . . . . 0.0 110.509 179.859 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 13.9 mttp -105.37 18.24 22.6 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 120.98 -1.075 . . . . 0.0 111.908 -179.959 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 56.17 44.95 88.77 Favored Glycine 0 N--CA 1.498 2.775 0 O-C-N 120.601 -1.312 . . . . 0.0 110.312 179.374 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.2 t -136.89 -163.0 1.35 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.131 -1.217 . . . . 0.0 109.967 179.848 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -137.12 146.09 44.64 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.075 -1.015 . . . . 0.0 110.276 -179.957 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.556 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.7 p -132.79 161.38 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.226 -0.921 . . . . 0.0 110.117 -179.954 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 42.2 t -167.36 82.1 0.21 Allowed 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.212 -0.93 . . . . 0.0 111.041 179.943 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.794 ' CG ' HD12 ' A' ' 121' ' ' ILE . 44.7 t80 -94.42 161.45 14.23 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.253 -0.904 . . . . 0.0 110.337 179.997 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 -140.67 -60.71 0.51 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.534 -0.728 . . . . 0.0 109.098 179.124 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -131.15 151.56 51.32 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.427 -0.796 . . . . 0.0 109.055 178.871 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 28.1 p -96.73 154.79 17.08 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 121.052 -1.03 . . . . 0.0 110.957 -179.698 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.1 m -73.89 -25.68 20.61 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.464 0 O-C-N 121.382 -0.824 . . . . 0.0 111.813 -179.218 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 147' ' ' HIS . . . . . 0.554 ' O ' ' HE1' ' A' ' 53' ' ' MET . 4.0 m-70 -49.99 -51.66 39.97 Favored 'General case' 0 N--CA 1.516 2.829 0 O-C-N 120.839 -1.163 . . . . 0.0 110.268 -179.768 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.486 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 28.1 p -134.87 -165.53 1.68 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.198 -0.938 . . . . 0.0 110.606 179.832 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -99.17 58.08 0.87 Allowed Glycine 0 N--CA 1.493 2.441 0 N-CA-C 108.013 -2.035 . . . . 0.0 108.013 178.492 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 27.8 t -103.06 144.05 31.79 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.339 -1.095 . . . . 0.0 109.988 -179.196 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 74.7 mtt85 -99.06 49.02 0.95 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.331 -0.855 . . . . 0.0 109.629 179.298 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.94 98.58 0.05 OUTLIER Glycine 0 N--CA 1.488 2.133 0 N-CA-C 109.866 -1.294 . . . . 0.0 109.866 179.938 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.5 p -111.98 128.01 56.04 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.302 -1.116 . . . . 0.0 110.237 179.652 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 154' ' ' ALA . . . . . 0.526 ' HB1' ' HD3' ' A' ' 125' ' ' PRO . . . -141.87 146.12 35.41 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.014 -1.054 . . . . 0.0 110.005 -179.626 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -109.21 -57.76 2.12 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.269 -0.894 . . . . 0.0 110.203 -179.901 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 7.5 t -147.28 49.91 1.09 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.286 -0.884 . . . . 0.0 110.439 -179.911 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 . . . . . 0 N--CA 1.494 1.756 0 CA-C-O 117.98 -1.01 . . . . 0.0 110.231 -179.935 . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.249 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 69.89 50.85 27.18 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 109.45 -1.46 . . . . 0.0 109.45 179.968 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.2 m -139.03 93.45 10.37 Favored Pre-proline 0 N--CA 1.494 1.756 0 O-C-N 121.201 -1.176 . . . . 0.0 110.243 -179.991 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.42 154.22 55.69 Favored 'Trans proline' 0 C--N 1.317 -1.096 0 O-C-N 123.469 1.247 . . . . 0.0 110.502 -179.946 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -120.37 78.72 1.39 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.146 -0.971 . . . . 0.0 110.212 -179.978 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 55.0 mt -124.71 96.23 3.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.164 -0.96 . . . . 0.0 110.064 -179.964 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.0 mtmt 52.13 -177.14 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.982 -1.074 . . . . 0.0 110.866 179.897 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.8 p -119.53 160.75 21.8 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.232 -0.917 . . . . 0.0 110.18 179.964 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.4 mtt-85 -135.55 152.39 51.24 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.219 -0.925 . . . . 0.0 110.245 -179.983 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 31.0 mtt-85 -119.26 171.17 8.49 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.244 -0.91 . . . . 0.0 110.138 179.941 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -144.77 164.96 29.45 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.246 -0.909 . . . . 0.0 110.314 -179.941 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.5 mmmm -118.08 80.88 15.59 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.142 -0.974 . . . . 0.0 110.205 179.908 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.89 161.3 44.03 Favored 'Trans proline' 0 C--N 1.317 -1.12 0 O-C-N 123.456 1.24 . . . . 0.0 110.741 -179.922 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.865 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -76.95 135.34 67.35 Favored Pre-proline 0 N--CA 1.507 2.4 0 C-N-CA 119.662 -0.815 . . . . 0.0 109.229 179.492 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -76.22 79.14 3.02 Favored 'Trans proline' 0 N--CA 1.487 1.089 0 O-C-N 123.251 1.132 . . . . 0.0 112.168 -178.299 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.9 t70 48.04 90.05 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.332 -0.855 . . . . 0.0 111.826 178.397 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 164.23 -42.19 0.31 Allowed Glycine 0 N--CA 1.501 2.969 0 C-N-CA 119.782 -1.199 . . . . 0.0 110.641 179.58 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.564 ' HE1' HD13 ' A' ' 23' ' ' LEU . 18.7 t80 -55.07 -29.4 57.45 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.183 -1.186 . . . . 0.0 110.801 179.872 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -54.52 -37.81 65.79 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 120.92 -1.113 . . . . 0.0 110.18 179.596 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.08 -35.04 70.82 Favored 'General case' 0 N--CA 1.511 2.585 0 O-C-N 121.231 -0.918 . . . . 0.0 110.376 179.425 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.1 pt -124.4 36.82 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 121.173 -0.954 . . . . 0.0 110.325 179.835 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -83.81 -42.69 0.79 Allowed Pre-proline 0 N--CA 1.509 2.507 0 O-C-N 121.128 -0.982 . . . . 0.0 113.474 -179.168 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.0 Cg_endo -74.41 -33.8 5.14 Favored 'Trans proline' 0 N--CA 1.488 1.166 0 O-C-N 122.623 0.802 . . . . 0.0 112.04 -177.978 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.884 HG21 ' CE2' ' A' ' 62' ' ' TYR . 93.2 m -58.73 -41.46 86.45 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.791 -1.193 . . . . 0.0 110.044 -179.814 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.564 HD13 ' HE1' ' A' ' 16' ' ' PHE . 0.3 OUTLIER -62.22 -37.27 84.7 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.26 -0.9 . . . . 0.0 110.109 179.636 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -57.43 -37.06 72.18 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 120.964 -1.085 . . . . 0.0 110.22 179.809 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -59.91 -35.38 74.74 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.105 -0.997 . . . . 0.0 110.198 179.592 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.712 ' CD2' HD12 ' A' ' 55' ' ' LEU . 6.9 m-85 -57.37 -43.53 83.64 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 120.987 -1.07 . . . . 0.0 110.071 179.355 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -57.49 -26.55 61.46 Favored 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 119.264 -0.974 . . . . 0.0 110.45 179.259 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.6 mm -65.15 -49.63 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.325 0 O-C-N 120.987 -1.07 . . . . 0.0 109.05 179.402 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -66.96 -52.01 48.12 Favored 'General case' 0 N--CA 1.505 2.323 0 C-N-CA 119.201 -1.0 . . . . 0.0 108.61 179.042 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.819 HD21 HG23 ' A' ' 52' ' ' ILE . 0.1 OUTLIER -57.84 -33.25 68.44 Favored 'General case' 0 N--CA 1.51 2.552 0 C-N-CA 119.331 -0.948 . . . . 0.0 109.738 178.802 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.27 -44.9 96.47 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 120.877 -1.139 . . . . 0.0 110.0 179.875 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.34 -43.33 96.56 Favored 'General case' 0 N--CA 1.508 2.468 0 C-N-CA 119.218 -0.993 . . . . 0.0 109.884 -179.629 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.519 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -71.79 -41.69 68.0 Favored 'General case' 0 N--CA 1.503 2.218 0 C-N-CA 119.247 -0.981 . . . . 0.0 109.093 178.954 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -62.48 -32.72 73.66 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.288 -0.883 . . . . 0.0 110.28 179.474 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.4 mmtt -94.96 -38.37 10.72 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 120.896 -1.128 . . . . 0.0 110.723 179.906 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -58.21 -39.64 79.55 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.055 -1.028 . . . . 0.0 109.984 179.836 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.52 -50.34 73.94 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.195 -0.941 . . . . 0.0 109.789 179.736 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.3 t 50.83 -169.22 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.109 0 O-C-N 120.975 -1.078 . . . . 0.0 111.051 179.832 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.2 p -114.77 152.92 31.27 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.244 -0.91 . . . . 0.0 109.837 179.825 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.1 ttpt 53.28 48.69 21.49 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.019 -1.051 . . . . 0.0 110.545 -179.831 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.8 tp -132.29 77.13 1.74 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.18 -0.95 . . . . 0.0 110.068 -179.925 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.75 104.99 0.17 Allowed 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.151 -0.968 . . . . 0.0 110.361 -179.707 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -169.91 -165.95 0.53 Allowed 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.234 -0.916 . . . . 0.0 110.823 -179.987 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.0 mttt -59.86 89.82 0.02 OUTLIER 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.144 -0.972 . . . . 0.0 109.871 179.791 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.1 m -102.63 -50.24 3.62 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.25 -0.906 . . . . 0.0 110.005 179.788 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.403 ' O ' ' CG ' ' A' ' 50' ' ' TRP . 68.5 m-20 -58.51 -39.02 78.93 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.206 -0.934 . . . . 0.0 109.856 179.483 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -66.32 -45.64 79.57 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.164 -0.96 . . . . 0.0 109.333 179.344 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 49.2 tp60 -66.78 -41.66 87.29 Favored 'General case' 0 N--CA 1.505 2.296 0 C-N-CA 119.341 -0.943 . . . . 0.0 109.015 179.048 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.54 HD23 HD12 ' A' ' 52' ' ' ILE . 12.5 mt -61.0 -37.33 82.15 Favored 'General case' 0 N--CA 1.506 2.332 0 C-N-CA 119.506 -0.878 . . . . 0.0 109.78 179.318 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.5 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.4 m0 -58.6 -35.95 73.24 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.947 -1.096 . . . . 0.0 110.259 179.712 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.6 ' O ' HD22 ' A' ' 55' ' ' LEU . 4.3 tt0 -63.92 -29.49 70.66 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.022 -1.049 . . . . 0.0 109.87 178.513 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.819 HG23 HD21 ' A' ' 30' ' ' LEU . 68.1 mt -71.88 -57.9 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.279 0 O-C-N 120.92 -1.112 . . . . 0.0 109.564 179.542 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 ptm -57.93 -26.65 62.52 Favored 'General case' 0 N--CA 1.511 2.602 0 C-N-CA 118.284 -1.366 . . . . 0.0 109.796 178.769 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -62.39 -35.97 80.85 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 120.812 -1.18 . . . . 0.0 109.503 178.19 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.712 HD12 ' CD2' ' A' ' 26' ' ' PHE . 0.5 OUTLIER -53.64 -36.51 62.15 Favored 'General case' 0 N--CA 1.513 2.695 0 O-C-N 120.868 -1.145 . . . . 0.0 109.869 179.378 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.457 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 22.4 t60 -53.14 -38.42 62.69 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.917 -1.114 . . . . 0.0 110.427 -179.684 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.448 ' CD2' HD21 ' A' ' 91' ' ' LEU . 5.5 m170 -67.48 -54.79 17.14 Favored 'General case' 0 N--CA 1.506 2.338 0 C-N-CA 119.207 -0.997 . . . . 0.0 109.318 179.369 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.439 ' HB3' ' CE2' ' A' ' 26' ' ' PHE . 13.7 tt0 -56.76 -32.93 66.1 Favored 'General case' 0 N--CA 1.507 2.381 0 C-N-CA 119.404 -0.918 . . . . 0.0 109.726 178.975 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.407 ' HG3' ' CE2' ' A' ' 26' ' ' PHE . 0.4 OUTLIER -67.18 -52.42 41.54 Favored 'General case' 0 N--CA 1.509 2.475 0 O-C-N 120.965 -1.084 . . . . 0.0 109.184 178.834 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.8 p -63.31 -37.63 88.0 Favored 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 119.253 -0.979 . . . . 0.0 109.318 178.997 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 48.6 ttt85 -65.06 -39.33 93.12 Favored 'General case' 0 N--CA 1.505 2.289 0 C-N-CA 119.251 -0.98 . . . . 0.0 109.355 179.053 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.884 ' CE2' HG21 ' A' ' 22' ' ' THR . 35.7 t80 -62.27 -50.51 71.41 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.013 -1.054 . . . . 0.0 109.375 179.441 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.571 HD12 ' HB2' ' A' ' 87' ' ' ALA . 86.8 mt -71.8 -40.33 69.2 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.34 0 O-C-N 121.188 -0.945 . . . . 0.0 109.232 179.28 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -64.08 -42.59 96.9 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.157 -0.964 . . . . 0.0 109.123 179.272 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.418 ' HA ' ' CD ' ' A' ' 69' ' ' LYS . 94.0 m -61.67 -42.28 98.7 Favored 'General case' 0 N--CA 1.501 2.116 0 C-N-CA 119.3 -0.96 . . . . 0.0 110.297 -179.642 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.56 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.6 pp -83.25 -31.85 26.76 Favored 'General case' 0 N--CA 1.504 2.267 0 C-N-CA 118.828 -1.149 . . . . 0.0 112.485 -179.022 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.456 ' HD1' HG23 ' A' ' 73' ' ' ILE . 66.8 t80 -86.24 -33.16 20.8 Favored 'General case' 0 N--CA 1.514 2.732 0 O-C-N 120.659 -1.275 . . . . 0.0 111.71 -179.508 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -98.37 -18.95 18.03 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 120.813 -1.179 . . . . 0.0 112.726 -178.662 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.418 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 5.6 mttt -120.97 -59.32 1.74 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 120.439 -1.413 . . . . 0.0 110.944 179.844 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.411 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 1.0 OUTLIER -63.1 -30.76 71.85 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.124 -0.985 . . . . 0.0 110.763 -179.648 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 42.0 tttt 57.68 42.35 23.95 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 120.751 -1.218 . . . . 0.0 110.062 -179.554 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -111.9 35.12 3.83 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.406 -0.809 . . . . 0.0 109.879 179.285 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.56 HG21 ' CD1' ' A' ' 66' ' ' LEU . 14.0 tt -154.17 162.48 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 O-C-N 121.234 -0.916 . . . . 0.0 109.895 179.969 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 43.5 m -107.6 145.08 33.75 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.137 -0.977 . . . . 0.0 110.301 179.863 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -46.71 -30.6 2.46 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.293 -0.879 . . . . 0.0 111.772 179.95 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.44 -50.46 73.5 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.781 -1.199 . . . . 0.0 109.462 179.677 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 24.5 tp -69.26 -44.02 72.76 Favored 'General case' 0 N--CA 1.505 2.277 0 C-N-CA 118.918 -1.113 . . . . 0.0 108.232 178.637 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.666 ' HA ' HD12 ' A' ' 81' ' ' LEU . 20.0 t80 -57.41 -38.6 74.59 Favored 'General case' 0 N--CA 1.509 2.475 0 C-N-CA 119.547 -0.861 . . . . 0.0 109.228 178.662 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -74.99 -42.45 57.51 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 177.925 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.865 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 81.4 t90 -55.44 -37.86 68.27 Favored 'General case' 0 N--CA 1.511 2.596 0 O-C-N 121.27 -0.894 . . . . 0.0 109.361 178.444 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.666 HD12 ' HA ' ' A' ' 78' ' ' TYR . 9.2 mt -68.32 -50.2 55.02 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.17 -0.956 . . . . 0.0 108.828 178.917 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.43 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 36.5 mm -56.4 -30.72 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.647 0 O-C-N 121.271 -0.893 . . . . 0.0 110.115 179.36 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 54.1 mttt -89.09 -22.17 23.03 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.932 -1.105 . . . . 0.0 111.753 -179.999 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.435 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 60.2 mm-40 -98.46 21.58 10.95 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 120.618 -1.301 . . . . 0.0 111.941 -179.97 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.6 tttm 74.39 74.1 0.11 Allowed 'General case' 0 N--CA 1.511 2.624 0 O-C-N 121.062 -1.024 . . . . 0.0 111.765 179.258 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.458 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 29.7 m-85 -133.22 -62.4 0.79 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.488 -0.757 . . . . 0.0 109.342 179.603 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.571 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -127.65 161.81 28.01 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.423 -0.798 . . . . 0.0 109.402 179.219 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.457 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 8.5 t0 -108.33 111.39 23.3 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.125 -0.984 . . . . 0.0 110.445 -179.853 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.0 mmtp -58.23 -36.81 73.73 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.313 -0.867 . . . . 0.0 110.109 179.707 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.1 tp -58.2 -38.64 77.14 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.075 -1.016 . . . . 0.0 110.131 179.707 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.623 ' HA ' HD21 ' A' ' 106' ' ' LEU . 64.1 tp -70.24 -53.22 17.89 Favored 'General case' 0 N--CA 1.505 2.311 0 C-N-CA 119.196 -1.002 . . . . 0.0 108.751 179.284 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.449 HG22 ' HD2' ' A' ' 96' ' ' ARG . 54.8 mt -59.38 -31.33 46.19 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.47 0 C-N-CA 119.225 -0.99 . . . . 0.0 109.299 178.469 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.5 -45.57 83.03 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 120.962 -1.086 . . . . 0.0 109.733 179.219 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.497 ' HD3' HD23 ' A' ' 106' ' ' LEU . 7.2 mttp -60.89 -45.03 96.2 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.088 -1.007 . . . . 0.0 109.882 179.376 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.7 m0 -58.31 -37.6 75.4 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.987 -1.071 . . . . 0.0 109.843 179.366 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.449 ' HD2' HG22 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -77.09 -36.75 55.48 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.204 -0.935 . . . . 0.0 109.743 178.864 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 31.1 mmtt -54.36 -177.12 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.641 0 O-C-N 121.075 -1.016 . . . . 0.0 110.226 179.588 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 33.1 m -108.57 141.03 41.08 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.247 -0.908 . . . . 0.0 109.341 178.807 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 106.5 -29.72 10.57 Favored Glycine 0 N--CA 1.492 2.42 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 -178.987 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 51.9 m-85 -92.64 56.83 2.77 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 120.895 -1.356 . . . . 0.0 110.061 179.747 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -69.44 -39.42 77.82 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 120.939 -1.101 . . . . 0.0 109.707 179.649 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.56 81.54 1.74 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.234 -0.916 . . . . 0.0 110.094 179.923 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.994 HD12 HD13 ' A' ' 109' ' ' ILE . 2.2 tt -113.99 137.14 52.09 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.107 -0.996 . . . . 0.0 110.212 -179.983 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.44 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.0 p -105.56 -30.07 9.75 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.394 -0.816 . . . . 0.0 111.871 179.259 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.671 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 13.1 m -145.28 -168.03 2.84 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 120.323 -1.486 . . . . 0.0 109.444 178.813 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.623 HD21 ' HA ' ' A' ' 91' ' ' LEU . 15.1 mt -99.13 -37.03 9.49 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.119 -0.988 . . . . 0.0 110.492 178.898 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 1.8 ttt-85 -103.95 34.98 2.81 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.851 -1.156 . . . . 0.0 109.417 178.456 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.671 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.309 1.7 t -129.46 21.17 5.62 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -179.39 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.994 HD13 HD12 ' A' ' 103' ' ' LEU . 1.6 pt -156.73 37.08 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.282 0 O-C-N 120.953 -1.092 . . . . 0.0 110.634 -178.626 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.51 ' C ' HG23 ' A' ' 119' ' ' THR . 1.7 mt-30 -65.83 78.39 0.08 Allowed 'General case' 0 N--CA 1.514 2.745 0 O-C-N 120.858 -1.151 . . . . 0.0 110.833 -178.864 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.555 ' HG3' HG21 ' A' ' 119' ' ' THR . 0.0 OUTLIER -149.12 171.55 16.24 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.033 -1.042 . . . . 0.0 110.353 179.451 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -157.12 -58.71 0.09 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.133 -0.979 . . . . 0.0 110.772 179.954 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -161.99 -55.9 0.04 OUTLIER 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.144 -0.972 . . . . 0.0 110.939 -179.993 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -138.62 81.57 1.86 Allowed 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.329 -0.857 . . . . 0.0 110.174 179.972 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 23.3 m-80 -136.57 -59.85 0.71 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.203 -0.936 . . . . 0.0 110.158 179.94 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 4.0 m120 52.97 73.84 0.33 Allowed 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.072 -1.017 . . . . 0.0 110.803 179.953 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -139.44 -84.21 0.1 Allowed Glycine 0 N--CA 1.492 2.422 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 179.961 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 56.0 m -117.05 91.49 3.59 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.258 -1.142 . . . . 0.0 110.055 179.895 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.555 HG21 ' HG3' ' A' ' 111' ' ' LYS . 4.0 m -139.14 166.97 23.13 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.26 -0.9 . . . . 0.0 110.372 -179.835 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 49.5 t -89.32 153.75 20.63 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.242 -0.911 . . . . 0.0 109.183 178.99 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.82 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -74.12 -35.63 41.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 121.048 -1.032 . . . . 0.0 111.184 -178.898 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.458 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.7 p -56.05 -35.84 67.37 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.886 -1.134 . . . . 0.0 111.058 -178.613 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.519 ' HG3' HG22 ' A' ' 109' ' ' ILE . 0.5 OUTLIER -58.82 -33.96 70.97 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.004 -1.06 . . . . 0.0 109.959 178.662 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.428 HG22 ' CE ' ' A' ' 111' ' ' LYS . 47.2 t -76.51 125.36 87.55 Favored Pre-proline 0 N--CA 1.505 2.28 0 O-C-N 121.065 -1.022 . . . . 0.0 110.077 179.957 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.4 ' HB3' ' CB ' ' A' ' 154' ' ' ALA . 37.9 Cg_endo -65.04 175.64 3.69 Favored 'Trans proline' 0 N--CA 1.488 1.204 0 O-C-N 123.236 1.124 . . . . 0.0 110.801 179.428 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -75.02 -36.66 61.91 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.274 -0.891 . . . . 0.0 110.542 -179.977 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.29 -40.36 77.63 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.035 -1.04 . . . . 0.0 109.989 -179.935 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.21 -42.43 75.77 Favored 'General case' 0 N--CA 1.506 2.356 0 C-N-CA 119.358 -0.937 . . . . 0.0 109.169 179.313 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.579 HD11 HD11 ' A' ' 121' ' ' ILE . 3.5 mt -66.94 -39.68 87.38 Favored 'General case' 0 N--CA 1.505 2.279 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.342 178.989 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -60.51 -38.02 82.99 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.237 -0.915 . . . . 0.0 109.82 179.404 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -57.74 -37.0 72.83 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.17 -0.956 . . . . 0.0 110.372 179.787 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -63.57 -50.38 69.69 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.131 -0.981 . . . . 0.0 109.673 179.862 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.53 -38.35 87.1 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.186 -0.946 . . . . 0.0 109.991 179.745 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 5.1 ttt85 -68.96 -36.53 78.0 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 121.057 -1.027 . . . . 0.0 110.265 179.61 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -79.03 -33.83 44.43 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.01 -1.056 . . . . 0.0 110.587 179.861 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 23.1 mttt -83.97 -19.28 34.88 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.054 -1.029 . . . . 0.0 111.765 179.758 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.37 32.73 10.07 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 -179.502 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 7.8 t -135.88 -160.88 1.1 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.031 -1.276 . . . . 0.0 109.738 179.883 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -132.72 142.21 48.93 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.063 -1.023 . . . . 0.0 110.232 179.905 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.7 p -125.6 160.54 31.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 O-C-N 121.246 -0.909 . . . . 0.0 110.027 179.738 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 32.4 t -167.71 83.14 0.2 Allowed 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.223 -0.923 . . . . 0.0 111.277 -179.828 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.752 ' CG ' HD12 ' A' ' 121' ' ' ILE . 46.6 t80 -92.72 159.61 15.35 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.175 -0.953 . . . . 0.0 109.981 179.601 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 20.7 m170 -136.97 -61.31 0.67 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.434 -0.791 . . . . 0.0 109.136 179.245 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -135.63 151.65 50.46 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.48 -0.762 . . . . 0.0 109.227 178.988 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 29.8 p -92.85 154.05 18.47 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.107 -0.996 . . . . 0.0 110.877 -179.761 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 26.8 m -72.05 -25.63 24.02 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.533 0 O-C-N 121.422 -0.799 . . . . 0.0 111.481 -179.487 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -51.32 -55.14 19.98 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 120.811 -1.18 . . . . 0.0 109.94 -179.958 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.5 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 28.4 p -131.39 -170.15 2.32 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.235 -0.915 . . . . 0.0 110.583 179.571 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 149' ' ' GLY . . . . . 0.4 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -97.7 58.44 1.09 Allowed Glycine 0 N--CA 1.492 2.425 0 N-CA-C 107.937 -2.065 . . . . 0.0 107.937 178.421 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 13.0 t -97.71 146.21 25.58 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.369 -1.077 . . . . 0.0 109.797 -179.157 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 14.9 mmt85 -98.16 50.29 1.01 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.287 -0.883 . . . . 0.0 109.503 179.123 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.95 98.0 0.03 OUTLIER Glycine 0 N--CA 1.486 2.008 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 -179.877 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.0 p -110.48 129.35 55.8 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.298 -1.119 . . . . 0.0 110.336 179.699 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 154' ' ' ALA . . . . . 0.4 ' CB ' ' HB3' ' A' ' 125' ' ' PRO . . . -143.08 145.75 33.16 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.05 -1.031 . . . . 0.0 110.046 -179.789 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -104.48 -48.38 3.83 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.159 -0.963 . . . . 0.0 110.62 -179.752 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.17 -39.92 70.08 Favored 'General case' 0 N--CA 1.511 2.62 0 O-C-N 120.994 -1.066 . . . . 0.0 110.517 -179.667 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 . . . . . 0 N--CA 1.494 1.768 0 CA-C-O 117.958 -1.02 . . . . 0.0 110.24 179.962 . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.343 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -90.21 131.65 10.86 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 -179.965 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.412 ' OG ' ' HD2' ' A' ' 2' ' ' PRO . 28.4 t -119.25 152.92 53.09 Favored Pre-proline 0 N--CA 1.494 1.746 0 O-C-N 121.209 -1.171 . . . . 0.0 110.183 179.93 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.412 ' HD2' ' OG ' ' A' ' 1' ' ' SER . 45.9 Cg_endo -72.22 115.2 4.23 Favored 'Trans proline' 0 C--N 1.316 -1.171 0 O-C-N 123.416 1.219 . . . . 0.0 110.44 -179.977 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -125.27 80.99 1.93 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.188 -0.945 . . . . 0.0 110.213 -179.989 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 82.4 mt -130.91 130.05 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 121.221 -0.925 . . . . 0.0 110.0 179.974 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 8.6 tptt -130.32 122.37 27.79 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.17 -0.956 . . . . 0.0 110.179 179.921 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 39.5 p -126.05 120.98 31.66 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.222 -0.924 . . . . 0.0 110.272 -179.994 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 34.6 mtt180 -134.26 -65.82 0.64 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.239 -0.913 . . . . 0.0 110.186 179.902 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.7 ttt85 -147.51 90.05 1.83 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.142 -0.974 . . . . 0.0 110.358 179.99 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.4 m -131.38 157.88 42.22 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.239 -0.913 . . . . 0.0 110.239 179.998 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.9 tttt -124.26 96.21 42.22 Favored Pre-proline 0 N--CA 1.494 1.73 0 O-C-N 121.253 -0.904 . . . . 0.0 110.273 -179.952 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.64 160.7 45.84 Favored 'Trans proline' 0 C--N 1.317 -1.129 0 O-C-N 123.464 1.244 . . . . 0.0 110.608 179.944 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.865 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -62.56 134.38 95.12 Favored Pre-proline 0 N--CA 1.511 2.579 0 C-N-CA 119.467 -0.893 . . . . 0.0 109.006 179.724 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -83.12 83.08 1.99 Allowed 'Trans proline' 0 C--N 1.318 -1.057 0 O-C-N 123.186 1.098 . . . . 0.0 112.434 -178.131 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 48.81 92.07 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.322 -0.862 . . . . 0.0 111.676 178.473 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.06 -39.58 0.46 Allowed Glycine 0 N--CA 1.5 2.95 0 C-N-CA 119.658 -1.258 . . . . 0.0 110.579 179.554 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.582 ' N ' HD21 ' A' ' 77' ' ' LEU . 18.1 t80 -58.03 -31.47 67.02 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.073 -1.251 . . . . 0.0 110.509 179.812 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -52.69 -33.81 49.21 Favored 'General case' 0 N--CA 1.512 2.671 0 O-C-N 120.968 -1.083 . . . . 0.0 110.218 179.247 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 42.8 mmtt -58.4 -38.2 76.87 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.147 -0.971 . . . . 0.0 110.111 179.525 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.525 HD11 HD21 ' A' ' 81' ' ' LEU . 3.8 pt -116.65 36.94 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.213 -0.929 . . . . 0.0 110.499 179.727 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.427 ' N ' ' HD2' ' A' ' 21' ' ' PRO . 1.4 tmtt? -84.1 -42.64 0.76 Allowed Pre-proline 0 N--CA 1.508 2.447 0 O-C-N 121.173 -0.954 . . . . 0.0 113.523 -178.941 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.427 ' HD2' ' N ' ' A' ' 20' ' ' LYS . 44.6 Cg_endo -74.58 -36.88 2.63 Favored 'Trans proline' 0 N--CA 1.486 1.054 0 O-C-N 122.518 0.746 . . . . 0.0 111.967 -177.971 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.959 HG21 ' CE2' ' A' ' 62' ' ' TYR . 70.4 m -62.22 -48.0 81.91 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 120.96 -1.088 . . . . 0.0 109.786 -179.97 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.428 ' CD1' HD12 ' A' ' 19' ' ' ILE . 5.2 mt -60.09 -35.42 75.16 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.252 -0.905 . . . . 0.0 109.825 179.196 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 25.2 m -55.76 -36.91 67.84 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.026 -1.046 . . . . 0.0 110.11 179.324 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -57.47 -38.42 74.48 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.184 -0.948 . . . . 0.0 109.946 179.554 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.75 ' CD2' HD22 ' A' ' 55' ' ' LEU . 20.5 m-85 -59.34 -40.66 87.08 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.15 -0.969 . . . . 0.0 109.887 179.616 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -58.63 -25.27 62.52 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.299 -0.875 . . . . 0.0 111.321 -179.874 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.537 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.6 mp -79.0 -34.61 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.442 0 O-C-N 120.889 -1.132 . . . . 0.0 109.833 179.705 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -81.85 -36.72 27.95 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.007 -1.058 . . . . 0.0 109.109 178.554 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.737 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -73.9 -31.98 63.37 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.163 -0.96 . . . . 0.0 110.109 178.81 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.1 ptm180 -69.57 -36.49 76.34 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 120.799 -1.188 . . . . 0.0 109.753 179.354 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.49 -42.19 99.33 Favored 'General case' 0 N--CA 1.508 2.435 0 C-N-CA 119.043 -1.063 . . . . 0.0 109.123 179.316 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.602 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -69.7 -42.4 74.14 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.373 -0.931 . . . . 0.0 108.839 178.775 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 34.3 mm-40 -58.98 -35.02 72.51 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.308 -0.87 . . . . 0.0 110.138 179.436 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -90.04 -39.45 12.93 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 120.976 -1.077 . . . . 0.0 110.133 179.653 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -57.42 -35.2 69.76 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.2 -0.937 . . . . 0.0 110.308 179.639 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.42 ' HG3' ' OG ' ' A' ' 45' ' ' SER . 9.7 ttpp -84.94 -47.42 10.3 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.017 -1.052 . . . . 0.0 109.827 179.743 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.8 t 51.97 69.46 0.67 Allowed 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.163 -0.96 . . . . 0.0 111.014 179.755 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 51.62 -163.82 0.06 Allowed 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.921 -1.112 . . . . 0.0 110.679 179.774 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 16.5 mtpt -83.79 82.05 8.5 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.124 -0.985 . . . . 0.0 109.8 179.687 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.4 tt -113.37 -54.13 2.64 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.341 -0.849 . . . . 0.0 110.498 -179.778 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -110.96 -163.97 0.88 Allowed 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.136 -0.978 . . . . 0.0 110.122 179.983 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -100.25 -172.3 2.19 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.111 -0.993 . . . . 0.0 110.139 179.834 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.4 tttt 53.02 51.5 15.69 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 120.996 -1.065 . . . . 0.0 110.415 -179.756 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.42 ' OG ' ' HG3' ' A' ' 37' ' ' LYS . 28.3 t -96.69 -37.99 10.1 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.269 -0.894 . . . . 0.0 110.733 -179.933 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.403 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 15.1 m-80 -57.51 -40.62 79.09 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.073 -1.017 . . . . 0.0 109.954 179.918 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -61.23 -40.0 92.37 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.229 -0.92 . . . . 0.0 109.878 179.667 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 25.4 tp60 -68.13 -38.96 82.78 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.123 -0.986 . . . . 0.0 109.858 179.574 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.539 HD23 HD12 ' A' ' 52' ' ' ILE . 63.4 mt -70.19 -33.51 71.81 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.193 -0.942 . . . . 0.0 110.599 179.91 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.487 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.1 m0 -57.43 -40.89 79.37 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 120.865 -1.147 . . . . 0.0 109.85 179.824 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -63.18 -33.83 76.33 Favored 'General case' 0 N--CA 1.504 2.24 0 C-N-CA 119.177 -1.009 . . . . 0.0 109.481 178.413 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.737 HG23 ' CG ' ' A' ' 30' ' ' LEU . 76.1 mt -71.28 -56.04 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.217 0 O-C-N 121.059 -1.025 . . . . 0.0 109.218 179.323 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.3 ptm -63.21 -30.19 71.39 Favored 'General case' 0 N--CA 1.506 2.374 0 C-N-CA 118.547 -1.261 . . . . 0.0 109.883 178.816 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -66.6 -38.97 88.12 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 120.817 -1.177 . . . . 0.0 108.907 178.227 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.75 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.5 mt -53.63 -33.13 54.01 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 121.105 -0.997 . . . . 0.0 110.117 178.93 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.474 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 69.6 t60 -54.73 -37.9 66.46 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.048 -1.032 . . . . 0.0 109.973 179.668 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.434 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.0 m170 -60.89 -49.38 77.68 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.2 -0.938 . . . . 0.0 109.257 179.437 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.57 -36.21 77.93 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.386 -0.925 . . . . 0.0 109.374 178.74 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.42 ' HG3' ' CE2' ' A' ' 26' ' ' PHE . 0.5 OUTLIER -62.6 -49.76 73.96 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.139 -0.976 . . . . 0.0 109.299 179.229 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 92.3 p -64.65 -39.97 94.63 Favored 'General case' 0 N--CA 1.503 2.199 0 C-N-CA 119.222 -0.991 . . . . 0.0 108.982 179.175 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.1 ttp85 -63.18 -40.25 96.97 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.135 -0.978 . . . . 0.0 109.091 178.927 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.959 ' CE2' HG21 ' A' ' 22' ' ' THR . 43.6 t80 -64.15 -53.76 44.35 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.202 -0.937 . . . . 0.0 109.187 179.293 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.722 HD12 ' HB2' ' A' ' 87' ' ' ALA . 78.6 mt -66.28 -34.71 72.0 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 C-N-CA 119.163 -1.015 . . . . 0.0 109.36 179.292 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.461 ' HD2' HD13 ' A' ' 92' ' ' ILE . 12.4 t80 -68.87 -42.57 76.82 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.993 -1.067 . . . . 0.0 108.797 178.789 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.403 ' HA ' ' HD3' ' A' ' 69' ' ' LYS . 85.4 m -59.45 -39.28 83.08 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.219 -0.926 . . . . 0.0 110.615 -179.608 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.609 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.6 pp -83.02 -34.42 26.29 Favored 'General case' 0 N--CA 1.503 2.224 0 C-N-CA 118.596 -1.241 . . . . 0.0 112.114 -179.08 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.548 ' N ' HD12 ' A' ' 66' ' ' LEU . 36.5 t80 -86.52 -32.09 20.92 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 120.705 -1.247 . . . . 0.0 111.948 -179.395 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.436 ' CD2' ' CE2' ' A' ' 64' ' ' TYR . 9.4 m-85 -98.39 -17.9 18.58 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.764 -1.21 . . . . 0.0 112.943 -178.495 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.403 ' HD3' ' HA ' ' A' ' 65' ' ' THR . 21.0 mtpt -118.29 -57.16 2.1 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.433 -1.417 . . . . 0.0 110.846 -179.962 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.406 ' HB2' ' HA ' ' A' ' 66' ' ' LEU . 46.4 mtp180 -68.8 -29.25 67.57 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.177 -0.952 . . . . 0.0 110.964 -179.581 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.21 42.02 22.66 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 120.881 -1.137 . . . . 0.0 109.896 -179.425 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.86 35.25 3.97 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.453 -0.779 . . . . 0.0 109.927 179.286 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.609 HG21 ' CD1' ' A' ' 66' ' ' LEU . 13.4 tt -152.91 162.05 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.2 -0.937 . . . . 0.0 109.775 179.933 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -108.33 149.57 28.5 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.155 -0.966 . . . . 0.0 110.204 -179.916 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.2 ttpt -46.84 -32.23 3.59 Favored 'General case' 0 N--CA 1.514 2.763 0 O-C-N 121.314 -0.866 . . . . 0.0 111.426 179.992 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -64.24 -47.82 78.18 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 120.846 -1.159 . . . . 0.0 109.319 179.349 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.582 HD21 ' N ' ' A' ' 16' ' ' PHE . 0.4 OUTLIER -67.39 -41.01 85.67 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.186 -0.946 . . . . 0.0 108.749 178.869 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.472 ' CE1' HG22 ' A' ' 63' ' ' ILE . 13.2 t80 -66.33 -41.34 89.77 Favored 'General case' 0 N--CA 1.505 2.298 0 C-N-CA 119.565 -0.854 . . . . 0.0 109.263 179.027 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -72.9 -41.78 64.24 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.136 -0.978 . . . . 0.0 108.788 178.78 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.865 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 87.8 t90 -55.8 -37.37 68.53 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.158 -0.964 . . . . 0.0 109.31 178.803 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.525 HD21 HD11 ' A' ' 19' ' ' ILE . 17.2 mt -67.81 -59.76 3.05 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.136 -0.978 . . . . 0.0 108.627 178.869 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.537 HG21 ' HG3' ' A' ' 89' ' ' LYS . 3.8 mt -57.18 -26.91 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 O-C-N 120.924 -1.11 . . . . 0.0 110.026 179.306 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.2 tptm -80.19 -18.74 48.77 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 120.873 -1.142 . . . . 0.0 110.946 178.549 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.44 ' HB2' ' CE1' ' A' ' 86' ' ' TYR . 11.0 mm-40 -109.24 23.89 13.87 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.66 -1.275 . . . . 0.0 112.0 179.982 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.418 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 15.0 tttm 77.17 68.35 0.05 Allowed 'General case' 0 N--CA 1.515 2.775 0 O-C-N 121.212 -0.93 . . . . 0.0 112.133 179.243 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.472 ' CE2' HD23 ' A' ' 81' ' ' LEU . 21.6 m-85 -130.53 -62.4 0.92 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.404 -0.81 . . . . 0.0 109.186 179.196 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.722 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -128.6 173.32 10.38 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.447 -0.783 . . . . 0.0 109.602 179.596 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.474 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 13.7 t0 -120.29 108.54 14.3 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.035 -1.041 . . . . 0.0 110.453 179.965 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.537 ' HG3' HG21 ' A' ' 82' ' ' ILE . 20.8 mtmt -58.84 -39.17 80.46 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.195 -0.941 . . . . 0.0 110.1 179.863 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.574 HD23 HD22 ' A' ' 106' ' ' LEU . 16.5 tp -59.61 -38.58 81.66 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.108 -0.995 . . . . 0.0 110.258 -179.831 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.461 ' N ' HD11 ' A' ' 106' ' ' LEU . 53.6 tp -68.18 -48.76 64.41 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.191 -1.004 . . . . 0.0 109.184 179.482 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.461 HD13 ' HD2' ' A' ' 64' ' ' TYR . 70.8 mt -59.59 -37.91 72.89 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.495 0 O-C-N 121.126 -0.984 . . . . 0.0 108.838 178.658 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.76 -38.98 87.67 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.12 -0.988 . . . . 0.0 109.059 178.442 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.616 ' HB3' HD22 ' A' ' 103' ' ' LEU . 9.6 mmtm -57.17 -42.97 82.12 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.116 -0.99 . . . . 0.0 109.493 179.34 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 2.4 m0 -63.52 -33.43 75.57 Favored 'General case' 0 N--CA 1.507 2.418 0 C-N-CA 119.583 -0.847 . . . . 0.0 110.316 179.576 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.8 -33.25 25.0 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.024 -1.048 . . . . 0.0 110.655 179.611 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.8 mmmt -51.31 176.93 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.761 0 O-C-N 120.857 -1.152 . . . . 0.0 110.831 179.907 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -103.5 140.81 37.01 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.196 -0.94 . . . . 0.0 109.321 179.163 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 102.48 -26.91 22.53 Favored Glycine 0 N--CA 1.493 2.451 0 C-N-CA 119.755 -1.212 . . . . 0.0 110.106 -179.099 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.568 ' HB3' HD23 ' A' ' 103' ' ' LEU . 67.6 m-85 -92.29 57.85 3.12 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 120.83 -1.394 . . . . 0.0 110.132 179.815 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -68.66 -36.87 79.13 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 120.936 -1.102 . . . . 0.0 110.009 179.637 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.31 81.75 2.0 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.064 -1.022 . . . . 0.0 110.481 -179.88 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.649 ' HB2' HD13 ' A' ' 109' ' ' ILE . 2.0 pp -116.4 140.23 49.57 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.084 -1.01 . . . . 0.0 110.1 179.703 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.434 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.1 p -107.4 -30.21 8.81 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.241 -0.912 . . . . 0.0 112.575 -179.722 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.712 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 10.9 m -146.41 -170.3 3.47 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 120.329 -1.482 . . . . 0.0 109.994 179.23 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.574 HD22 HD23 ' A' ' 90' ' ' LEU . 18.0 mt -99.61 -34.98 10.0 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.337 -0.852 . . . . 0.0 110.445 178.688 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 3.9 ttm180 -104.57 36.05 2.54 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.8 -1.188 . . . . 0.0 109.205 178.275 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.712 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.281 1.6 t -127.68 -59.55 1.2 Allowed 'General case' 0 N--CA 1.497 1.905 0 N-CA-C 105.901 -1.889 . . . . 0.0 105.901 -179.426 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.673 ' O ' HG21 ' A' ' 119' ' ' THR . 9.4 pt -67.81 -23.71 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.699 0 O-C-N 120.925 -1.109 . . . . 0.0 111.052 177.084 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.57 ' C ' HG23 ' A' ' 119' ' ' THR . 27.3 tt0 -122.09 163.71 18.98 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.836 -1.165 . . . . 0.0 110.024 -179.321 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.2 156.96 18.75 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.203 -0.936 . . . . 0.0 110.373 179.978 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 22.9 m-80 -127.38 26.03 6.05 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.132 -0.98 . . . . 0.0 111.549 -179.714 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -106.53 165.53 11.22 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.814 -1.179 . . . . 0.0 110.071 179.89 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 12.3 p -115.28 64.56 0.68 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.207 -0.933 . . . . 0.0 110.282 -179.933 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -142.63 -59.95 0.44 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.154 -0.966 . . . . 0.0 110.135 179.912 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -150.32 171.16 17.42 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.216 -0.927 . . . . 0.0 110.499 -179.969 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -68.66 88.8 0.22 Allowed Glycine 0 N--CA 1.493 2.457 0 N-CA-C 109.391 -1.484 . . . . 0.0 109.391 179.942 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 1.8 m -123.02 99.72 6.52 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.17 -1.194 . . . . 0.0 110.351 -179.843 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.673 HG21 ' O ' ' A' ' 109' ' ' ILE . 1.6 m -113.06 172.05 7.17 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.199 -0.938 . . . . 0.0 110.018 179.755 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 27.4 t -57.97 154.59 12.2 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.134 -0.979 . . . . 0.0 109.952 179.821 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.827 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -75.15 -34.92 32.79 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.471 0 O-C-N 121.14 -0.975 . . . . 0.0 111.239 -179.269 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.469 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 12.1 p -54.42 -33.6 59.74 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.763 -1.21 . . . . 0.0 111.251 -178.485 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.5 -34.99 73.29 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 120.916 -1.115 . . . . 0.0 109.615 178.471 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 47.7 t -79.91 124.87 82.97 Favored Pre-proline 0 N--CA 1.504 2.254 0 O-C-N 121.134 -0.979 . . . . 0.0 109.884 179.786 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.609 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.0 Cg_endo -65.03 176.33 3.17 Favored 'Trans proline' 0 N--CA 1.489 1.233 0 O-C-N 123.113 1.059 . . . . 0.0 110.921 179.499 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -75.04 -37.21 61.77 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.296 -0.877 . . . . 0.0 110.481 -179.837 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.27 -40.75 78.36 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 120.954 -1.091 . . . . 0.0 109.926 179.946 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 9.9 tp60 -70.27 -41.61 73.19 Favored 'General case' 0 N--CA 1.505 2.305 0 C-N-CA 119.378 -0.929 . . . . 0.0 108.998 178.956 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.611 HD11 HD11 ' A' ' 121' ' ' ILE . 2.2 mt -65.09 -39.3 92.97 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.301 -0.875 . . . . 0.0 109.394 179.081 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -60.1 -39.51 86.44 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.134 -0.979 . . . . 0.0 109.905 179.639 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -58.72 -37.2 75.61 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.173 -0.955 . . . . 0.0 110.289 179.755 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -59.97 -43.46 95.05 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.159 -0.963 . . . . 0.0 109.957 179.925 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 133' ' ' ALA . . . . . 0.662 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -60.12 -38.96 84.6 Favored 'General case' 0 N--CA 1.51 2.544 0 C-N-CA 119.374 -0.93 . . . . 0.0 109.993 179.879 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 20.9 mtt-85 -67.11 -40.27 86.84 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.142 -0.974 . . . . 0.0 109.822 179.803 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 26.6 mmtp -68.95 -35.99 77.42 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.206 -0.934 . . . . 0.0 110.34 179.714 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 136' ' ' LYS . . . . . 0.431 ' HB3' HG22 ' A' ' 138' ' ' THR . 2.4 tppt? -85.48 -21.7 28.55 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.045 -1.034 . . . . 0.0 111.446 179.781 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 91.61 31.47 9.44 Favored Glycine 0 N--CA 1.493 2.473 0 N-CA-C 110.069 -1.213 . . . . 0.0 110.069 -179.727 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.662 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.9 t -140.64 -161.66 1.24 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.961 -1.317 . . . . 0.0 109.835 179.682 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -123.2 171.54 9.27 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.124 -0.985 . . . . 0.0 110.266 179.997 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 10.1 p -155.18 160.45 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.203 -0.936 . . . . 0.0 110.702 179.801 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 44.2 t -168.51 89.28 0.24 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.288 -0.882 . . . . 0.0 111.086 -179.937 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.73 ' CG ' HD12 ' A' ' 121' ' ' ILE . 50.3 t80 -95.69 159.02 15.19 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.235 -0.915 . . . . 0.0 110.13 179.867 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 8.3 m80 -136.46 -61.4 0.69 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.47 -0.769 . . . . 0.0 109.08 179.179 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 144' ' ' GLN . . . . . 0.405 ' OE1' ' CZ3' ' A' ' 50' ' ' TRP . 11.5 pt20 -135.74 151.28 49.98 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 178.918 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 145' ' ' CYS . . . . . 0.425 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.3 p -90.13 153.09 20.79 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.155 -1.018 . . . . 0.0 111.008 -179.67 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.8 m -71.14 -26.73 27.71 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 C-N-CA 119.715 -0.794 . . . . 0.0 111.496 -179.436 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -51.69 -60.66 2.91 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 120.835 -1.166 . . . . 0.0 110.288 -179.856 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.487 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 24.3 p -125.29 -170.9 2.25 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.214 -0.929 . . . . 0.0 110.849 179.862 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -95.78 59.41 1.5 Allowed Glycine 0 N--CA 1.493 2.451 0 N-CA-C 108.297 -1.921 . . . . 0.0 108.297 178.752 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 19.3 t -100.91 140.38 35.29 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.372 -1.075 . . . . 0.0 109.849 -179.367 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.6 53.18 1.43 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.282 -0.886 . . . . 0.0 109.563 179.287 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.95 98.52 0.03 OUTLIER Glycine 0 N--CA 1.486 2.001 0 N-CA-C 109.81 -1.316 . . . . 0.0 109.81 -179.952 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.8 p -108.75 127.59 54.13 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.303 -1.116 . . . . 0.0 110.451 179.683 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -143.23 147.8 35.42 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.129 -0.982 . . . . 0.0 109.927 -179.68 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -106.08 -49.27 3.41 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.218 -0.926 . . . . 0.0 110.624 -179.709 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 5.9 m -54.44 -38.32 66.19 Favored 'General case' 0 N--CA 1.512 2.671 0 O-C-N 121.029 -1.044 . . . . 0.0 110.624 -179.775 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 . . . . . 0 N--CA 1.494 1.746 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.173 179.908 . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 65.12 149.6 0.06 OUTLIER Glycine 0 N--CA 1.493 2.437 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 179.995 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.6 m -126.5 145.0 51.44 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.195 -1.179 . . . . 0.0 110.219 179.994 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -73.71 -171.23 0.81 Allowed 'Trans proline' 0 C--N 1.318 -1.036 0 O-C-N 123.344 1.181 . . . . 0.0 110.332 -179.965 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.75 136.8 17.35 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.176 -0.952 . . . . 0.0 110.618 179.916 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 85.8 mt -117.26 145.87 22.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.228 -0.92 . . . . 0.0 110.077 -179.99 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -125.19 157.04 37.46 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.221 -0.924 . . . . 0.0 110.148 -179.941 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 53.0 -174.45 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.023 -1.048 . . . . 0.0 110.743 -179.972 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.2 mtt85 -140.22 84.34 1.96 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.215 -0.928 . . . . 0.0 110.201 -179.943 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.82 51.88 1.39 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.166 -0.958 . . . . 0.0 110.227 179.984 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.9 p -115.64 96.79 5.79 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.163 -0.961 . . . . 0.0 110.074 179.899 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.5 mttm -132.97 172.86 6.64 Favored Pre-proline 0 N--CA 1.495 1.776 0 O-C-N 121.227 -0.92 . . . . 0.0 110.331 -179.894 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.66 160.18 48.89 Favored 'Trans proline' 0 C--N 1.316 -1.138 0 O-C-N 123.409 1.215 . . . . 0.0 110.676 179.95 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.666 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -84.04 145.32 46.09 Favored Pre-proline 0 N--CA 1.505 2.282 0 O-C-N 121.323 -0.861 . . . . 0.0 109.765 179.75 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -71.21 163.74 38.11 Favored 'Trans proline' 0 C--N 1.316 -1.158 0 O-C-N 123.433 1.228 . . . . 0.0 110.89 -179.669 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -48.72 -31.67 7.25 Favored 'General case' 0 N--CA 1.513 2.715 0 O-C-N 121.416 -0.802 . . . . 0.0 111.463 -179.892 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.62 -34.88 36.5 Favored Glycine 0 N--CA 1.499 2.863 0 O-C-N 120.961 -1.087 . . . . 0.0 110.552 179.828 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.405 ' HB2' HD11 ' A' ' 77' ' ' LEU . 28.2 t80 -55.4 -32.79 62.95 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 121.008 -1.289 . . . . 0.0 110.614 179.692 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -54.3 -37.66 65.04 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 121.039 -1.038 . . . . 0.0 110.234 179.695 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 27.9 mttt -57.59 -36.74 72.14 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.303 -0.873 . . . . 0.0 110.177 179.452 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.89 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.1 pt -116.64 35.06 1.13 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.176 -0.952 . . . . 0.0 110.449 179.509 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.431 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 1.2 tmtt? -84.79 -43.04 0.69 Allowed Pre-proline 0 N--CA 1.509 2.511 0 O-C-N 121.122 -0.986 . . . . 0.0 113.172 -179.024 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.9 Cg_endo -76.22 -37.7 1.37 Allowed 'Trans proline' 0 N--CA 1.487 1.121 0 O-C-N 122.618 0.799 . . . . 0.0 111.571 -178.337 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.759 HG21 ' CE2' ' A' ' 62' ' ' TYR . 88.5 m -59.6 -41.62 90.74 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.031 -1.043 . . . . 0.0 109.959 -179.726 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.89 HD12 ' O ' ' A' ' 19' ' ' ILE . 6.0 mt -65.19 -39.57 93.04 Favored 'General case' 0 N--CA 1.506 2.338 0 C-N-CA 119.484 -0.887 . . . . 0.0 109.461 179.238 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.15 -35.02 69.02 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.073 -1.017 . . . . 0.0 110.235 179.335 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -56.45 -35.82 68.33 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 121.118 -0.988 . . . . 0.0 110.407 179.82 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.571 ' CE2' HD12 ' A' ' 55' ' ' LEU . 15.8 m-85 -57.25 -36.84 71.45 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.074 -1.016 . . . . 0.0 110.673 -179.952 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -60.31 -37.96 82.2 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.149 -0.969 . . . . 0.0 110.893 -178.93 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.409 HD12 ' H ' ' A' ' 28' ' ' ILE . 2.9 mp -63.28 -40.31 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.475 0 C-N-CA 118.992 -1.083 . . . . 0.0 108.961 179.783 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -70.08 -55.98 8.08 Favored 'General case' 0 N--CA 1.505 2.316 0 C-N-CA 119.115 -1.034 . . . . 0.0 108.468 178.63 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.939 HD12 HD23 ' A' ' 55' ' ' LEU . 0.8 OUTLIER -56.67 -31.28 64.27 Favored 'General case' 0 N--CA 1.509 2.508 0 C-N-CA 119.242 -0.983 . . . . 0.0 109.738 178.382 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -57.75 -38.78 75.98 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 120.942 -1.099 . . . . 0.0 110.19 179.891 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -64.32 -50.29 68.4 Favored 'General case' 0 N--CA 1.506 2.351 0 C-N-CA 119.097 -1.041 . . . . 0.0 109.728 -179.902 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.449 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -70.61 -37.59 73.88 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.371 -0.932 . . . . 0.0 109.517 179.183 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 7.2 mm100 -71.55 -30.82 66.31 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 121.164 -0.96 . . . . 0.0 110.206 179.339 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.7 mtpp -91.79 -35.21 14.24 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.905 -1.122 . . . . 0.0 110.552 179.771 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -69.33 -40.18 77.73 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.109 -0.994 . . . . 0.0 109.356 179.377 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.548 ' HA ' HD13 ' A' ' 41' ' ' LEU . 0.7 OUTLIER -59.76 -36.91 77.61 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.16 -0.962 . . . . 0.0 110.114 179.512 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 11.5 p -104.0 39.46 1.63 Allowed 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.084 -1.01 . . . . 0.0 110.188 179.733 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 46.8 t -154.8 -57.99 0.11 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.224 -0.922 . . . . 0.0 110.379 179.909 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.4 mmtp -134.08 103.33 5.74 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.272 -0.892 . . . . 0.0 109.848 179.737 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.548 HD13 ' HA ' ' A' ' 37' ' ' LYS . 8.8 tp -124.33 72.67 1.2 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.282 -0.886 . . . . 0.0 110.286 -179.887 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -108.79 -53.24 2.67 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.147 -0.971 . . . . 0.0 110.095 179.701 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -116.43 145.66 43.11 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.176 -0.953 . . . . 0.0 110.075 179.824 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 28.5 tttt 53.52 89.15 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.139 0 O-C-N 120.962 -1.086 . . . . 0.0 110.652 -179.927 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 38.6 t -115.49 -55.62 2.43 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.206 -0.934 . . . . 0.0 110.496 -179.96 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 -55.87 -39.23 71.23 Favored 'General case' 0 N--CA 1.512 2.642 0 O-C-N 121.208 -0.932 . . . . 0.0 109.91 179.846 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -59.55 -36.79 76.86 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.269 -0.894 . . . . 0.0 110.028 179.524 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -62.08 -47.47 84.49 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.076 -1.015 . . . . 0.0 109.718 179.89 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 49' ' ' LEU . 12.5 mt -58.52 -38.04 76.89 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.187 -0.945 . . . . 0.0 110.127 179.908 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 48.1 m0 -59.23 -34.04 71.73 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.122 -0.986 . . . . 0.0 110.049 179.464 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.666 ' O ' HD22 ' A' ' 55' ' ' LEU . 0.7 OUTLIER -62.76 -31.09 71.98 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.077 -1.015 . . . . 0.0 109.947 178.646 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.745 HG23 HD11 ' A' ' 30' ' ' LEU . 5.7 mt -71.41 -58.89 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.263 0 O-C-N 120.921 -1.112 . . . . 0.0 109.324 179.547 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.52 -25.95 60.62 Favored 'General case' 0 N--CA 1.513 2.717 0 C-N-CA 118.312 -1.355 . . . . 0.0 110.076 178.829 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.6 mm100 -64.07 -40.07 95.46 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 120.742 -1.224 . . . . 0.0 109.405 178.522 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.939 HD23 HD12 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -55.0 -33.93 62.99 Favored 'General case' 0 N--CA 1.513 2.702 0 O-C-N 120.942 -1.099 . . . . 0.0 109.873 179.074 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.47 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 16.3 t60 -55.54 -39.78 71.02 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 120.972 -1.08 . . . . 0.0 110.291 -179.672 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 57' ' ' HIS . . . . . 0.446 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.2 m170 -64.85 -50.96 64.59 Favored 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 119.208 -0.997 . . . . 0.0 109.61 179.45 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 54.1 tp60 -57.11 -34.87 68.78 Favored 'General case' 0 N--CA 1.507 2.423 0 C-N-CA 119.436 -0.905 . . . . 0.0 109.962 179.286 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.456 ' HD3' ' CD1' ' A' ' 26' ' ' PHE . 19.2 mmm-85 -65.16 -50.32 66.43 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.027 -1.046 . . . . 0.0 109.567 179.333 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 53.8 p -60.76 -39.91 90.52 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.375 -0.93 . . . . 0.0 109.695 179.769 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.2 tpt180 -63.97 -41.19 97.63 Favored 'General case' 0 N--CA 1.505 2.314 0 C-N-CA 119.174 -1.01 . . . . 0.0 109.186 179.204 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.759 ' CE2' HG21 ' A' ' 22' ' ' THR . 36.7 t80 -63.23 -49.95 72.16 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.177 -0.952 . . . . 0.0 109.682 179.499 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.881 HD12 ' HB2' ' A' ' 87' ' ' ALA . 74.0 mt -71.61 -36.03 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 O-C-N 121.209 -0.932 . . . . 0.0 109.654 179.585 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.437 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 10.5 t80 -69.28 -41.64 76.57 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 120.974 -1.079 . . . . 0.0 108.871 178.848 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 87.8 m -61.19 -40.85 95.47 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.046 -1.034 . . . . 0.0 109.876 179.683 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.659 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.8 pp -83.23 -35.89 25.03 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 120.962 -1.086 . . . . 0.0 112.374 -179.241 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.596 ' N ' HD12 ' A' ' 66' ' ' LEU . 63.9 t80 -86.58 -35.14 19.64 Favored 'General case' 0 N--CA 1.513 2.71 0 O-C-N 120.585 -1.322 . . . . 0.0 111.839 -179.499 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.437 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 7.6 m-85 -98.26 -3.58 37.03 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 120.837 -1.164 . . . . 0.0 113.17 -178.574 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.76 -58.86 0.61 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.354 -1.466 . . . . 0.0 110.819 179.555 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.408 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 10.1 tpt180 -63.11 -29.12 70.55 Favored 'General case' 0 N--CA 1.51 2.561 0 O-C-N 121.063 -1.023 . . . . 0.0 110.609 179.956 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt 57.83 43.34 21.85 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 120.855 -1.153 . . . . 0.0 110.163 -179.512 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -115.02 36.86 3.69 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.499 -0.751 . . . . 0.0 109.737 179.213 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.744 HG13 HD23 ' A' ' 77' ' ' LEU . 13.8 tt -156.43 162.39 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.21 -0.931 . . . . 0.0 110.174 -179.83 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 31.8 m -109.93 147.54 33.24 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.163 -0.961 . . . . 0.0 109.971 179.595 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.2 tttm -45.29 -32.61 2.05 Favored 'General case' 0 N--CA 1.516 2.829 0 O-C-N 121.406 -0.809 . . . . 0.0 111.675 -179.866 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -61.72 -50.35 72.79 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 120.95 -1.093 . . . . 0.0 109.324 179.496 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.744 HD23 HG13 ' A' ' 73' ' ' ILE . 25.4 tp -67.27 -43.7 81.16 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 119.15 -1.02 . . . . 0.0 108.582 178.831 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.491 ' HA ' HD12 ' A' ' 81' ' ' LEU . 16.1 t80 -60.66 -37.97 83.3 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.312 -0.868 . . . . 0.0 109.435 178.913 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.475 ' O ' HG22 ' A' ' 82' ' ' ILE . 10.0 t70 -74.88 -41.38 59.9 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.099 -1.0 . . . . 0.0 108.968 178.786 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.666 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 82.6 t90 -59.21 -38.45 79.94 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.111 -0.993 . . . . 0.0 109.212 178.816 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.491 HD12 ' HA ' ' A' ' 78' ' ' TYR . 15.1 mt -65.95 -55.8 14.99 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.249 -0.907 . . . . 0.0 109.278 179.116 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.524 HD12 ' HB3' ' A' ' 87' ' ' ALA . 0.8 OUTLIER -56.22 -27.11 23.24 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.429 0 O-C-N 121.16 -0.962 . . . . 0.0 110.852 -179.633 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.18 -18.71 26.57 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.95 -1.094 . . . . 0.0 111.674 179.598 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.446 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 10.4 mm-40 -103.75 25.19 10.11 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 120.601 -1.312 . . . . 0.0 111.809 179.97 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 7.8 mmpt? 75.25 69.97 0.08 Allowed 'General case' 0 N--CA 1.513 2.72 0 O-C-N 121.319 -0.863 . . . . 0.0 111.989 179.362 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.524 ' HE2' HD13 ' A' ' 23' ' ' LEU . 27.7 m-85 -131.9 -64.0 0.8 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.41 -0.806 . . . . 0.0 109.192 178.997 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.881 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -129.71 -178.68 4.8 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.339 -0.85 . . . . 0.0 109.734 179.44 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.47 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 6.4 t70 -131.12 124.24 30.31 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.093 -1.004 . . . . 0.0 110.615 -179.835 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -74.35 -36.75 63.62 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.264 -0.897 . . . . 0.0 109.899 179.349 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.903 HD23 HD13 ' A' ' 106' ' ' LEU . 16.0 tp -60.1 -43.35 95.62 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.022 -1.049 . . . . 0.0 109.763 179.867 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.691 ' HA ' HD21 ' A' ' 106' ' ' LEU . 67.8 tp -67.56 -48.54 66.63 Favored 'General case' 0 N--CA 1.506 2.364 0 C-N-CA 119.16 -1.016 . . . . 0.0 108.511 179.014 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 63.9 mt -58.52 -40.0 77.26 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.473 0 O-C-N 121.112 -0.993 . . . . 0.0 108.628 178.464 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.91 -39.23 91.3 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.18 -0.95 . . . . 0.0 109.459 178.803 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.411 ' HB3' ' CD2' ' A' ' 103' ' ' LEU . 5.8 mmtt -59.0 -45.4 90.77 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.051 -1.031 . . . . 0.0 109.423 179.523 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.498 ' CD1' HD23 ' A' ' 103' ' ' LEU . 8.2 m0 -64.53 -41.93 96.07 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.45 -0.9 . . . . 0.0 109.718 179.639 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 3.0 mtp85 -65.27 -31.73 73.03 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.319 -0.863 . . . . 0.0 110.595 179.58 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 3.1 mmtp -54.26 -177.17 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.668 0 O-C-N 121.018 -1.051 . . . . 0.0 110.524 179.934 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.71 133.3 52.32 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.181 -0.949 . . . . 0.0 109.838 179.405 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.23 4.16 55.3 Favored Glycine 0 N--CA 1.493 2.458 0 C-N-CA 120.149 -1.024 . . . . 0.0 111.184 -179.488 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -110.29 46.86 1.0 Allowed 'General case' 0 N--CA 1.497 1.924 0 CA-C-N 119.658 1.729 . . . . 0.0 110.048 179.696 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -60.85 -39.74 90.25 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.171 -0.956 . . . . 0.0 109.829 179.835 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -116.01 101.89 9.16 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.3 -0.875 . . . . 0.0 109.899 179.906 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.699 HD11 ' O ' ' A' ' 105' ' ' CYS . 1.2 tp -137.98 139.82 39.89 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.247 -0.908 . . . . 0.0 109.452 -179.372 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.681 ' N ' HD12 ' A' ' 103' ' ' LEU . 29.4 p -112.36 -37.76 4.89 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.148 -0.97 . . . . 0.0 112.765 -179.521 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 105' ' ' CYS . . . . . 0.699 ' O ' HD11 ' A' ' 103' ' ' LEU . 6.4 m -142.57 -169.43 2.98 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 120.209 -1.557 . . . . 0.0 110.361 179.292 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.903 HD13 HD23 ' A' ' 90' ' ' LEU . 18.0 mt -96.69 -38.76 9.79 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.103 -0.998 . . . . 0.0 110.28 179.124 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 8.1 ttm180 -101.03 29.2 4.76 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 120.944 -1.098 . . . . 0.0 109.883 178.012 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.654 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.299 1.8 t -126.64 14.35 7.55 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.052 -1.03 . . . . 0.0 109.344 -179.429 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.576 ' CD1' HD13 ' A' ' 103' ' ' LEU . 1.0 OUTLIER -160.07 37.88 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.386 0 O-C-N 120.826 -1.171 . . . . 0.0 110.648 -178.963 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.654 ' O ' HG23 ' A' ' 119' ' ' THR . 25.8 mt-30 -127.91 145.0 51.09 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.678 -1.264 . . . . 0.0 111.552 -178.562 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 7.8 ttmt -121.22 -57.1 1.87 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.341 -0.849 . . . . 0.0 110.234 179.671 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 52.54 28.04 5.66 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 121.011 -1.055 . . . . 0.0 111.695 179.925 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -150.75 -171.46 3.93 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.959 -1.088 . . . . 0.0 110.553 -179.932 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 1.2 p -125.39 137.48 54.02 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.212 -0.93 . . . . 0.0 110.084 179.992 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 64.83 -70.63 0.08 Allowed 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.069 -1.019 . . . . 0.0 110.642 -179.942 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -127.86 114.1 16.78 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.009 -1.057 . . . . 0.0 110.193 -179.981 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -131.8 -144.43 5.36 Favored Glycine 0 N--CA 1.493 2.471 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 -179.978 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 4.1 m -117.53 89.07 3.04 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.241 -1.152 . . . . 0.0 110.208 179.994 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.654 HG23 ' O ' ' A' ' 110' ' ' GLN . 1.7 m -134.34 170.9 15.04 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.233 -0.917 . . . . 0.0 110.255 179.969 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.432 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 48.1 t -97.7 155.52 16.97 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.319 -0.863 . . . . 0.0 109.068 178.996 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.722 HG23 ' CE1' ' A' ' 142' ' ' PHE . 14.6 tt -77.49 -29.43 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.296 0 O-C-N 120.995 -1.066 . . . . 0.0 112.022 -179.257 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.475 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.3 p -54.76 -35.78 64.15 Favored 'General case' 0 N--CA 1.512 2.643 0 O-C-N 120.517 -1.365 . . . . 0.0 110.2 -179.278 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.86 -29.39 64.97 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.984 -1.072 . . . . 0.0 109.514 177.476 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.525 HG12 ' HG ' ' A' ' 129' ' ' LEU . 51.2 t -73.16 118.37 68.0 Favored Pre-proline 0 N--CA 1.507 2.403 0 O-C-N 121.1 -1.0 . . . . 0.0 110.221 179.764 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.404 ' HB3' ' CB ' ' A' ' 154' ' ' ALA . 37.7 Cg_endo -64.91 168.44 13.66 Favored 'Trans proline' 0 N--CA 1.489 1.221 0 O-C-N 123.088 1.046 . . . . 0.0 110.678 178.736 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 -74.98 -38.9 61.53 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.199 -0.938 . . . . 0.0 110.335 179.983 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.66 -40.62 83.99 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.079 -1.013 . . . . 0.0 110.078 -179.779 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -66.08 -41.65 90.43 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.167 -0.958 . . . . 0.0 109.514 179.604 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.611 ' O ' HG11 ' A' ' 140' ' ' VAL . 58.0 mt -64.15 -40.2 95.64 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.191 -0.943 . . . . 0.0 109.633 179.502 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -60.34 -39.15 86.09 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.211 -0.93 . . . . 0.0 110.126 179.955 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.75 -39.01 93.24 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.059 -1.025 . . . . 0.0 110.184 179.924 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -65.46 -40.42 93.16 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.176 -0.952 . . . . 0.0 109.881 179.879 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -66.54 -41.08 89.24 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.149 -0.969 . . . . 0.0 109.647 179.704 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.26 -33.44 73.55 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.134 -0.979 . . . . 0.0 110.185 179.493 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 22.2 mttt -79.26 -29.22 42.52 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.893 -1.129 . . . . 0.0 111.147 179.975 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 36.9 mttt -97.53 21.96 9.55 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 120.825 -1.172 . . . . 0.0 111.855 -179.941 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.18 46.42 56.72 Favored Glycine 0 N--CA 1.499 2.898 0 O-C-N 120.666 -1.271 . . . . 0.0 110.8 179.317 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 7.9 t -149.39 -164.68 2.08 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.203 -1.174 . . . . 0.0 110.404 179.987 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -134.34 162.77 31.29 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.106 -0.996 . . . . 0.0 110.346 -179.902 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.611 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.9 p -151.16 161.43 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.257 -0.902 . . . . 0.0 110.453 -179.85 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 46.5 t -170.38 110.3 0.38 Allowed 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.179 -0.951 . . . . 0.0 111.202 179.789 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 142' ' ' PHE . . . . . 0.722 ' CE1' HG23 ' A' ' 121' ' ' ILE . 86.0 t80 -105.78 158.78 16.49 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.224 -0.922 . . . . 0.0 110.601 179.741 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 21.9 t-160 -138.42 -60.07 0.62 Allowed 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.673 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -148.05 149.01 31.32 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.42 -0.8 . . . . 0.0 109.175 178.646 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 145' ' ' CYS . . . . . 0.454 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 25.0 p -93.46 156.1 16.96 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.007 -1.058 . . . . 0.0 111.105 -179.247 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.9 p -73.31 -25.85 21.83 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.447 0 O-C-N 121.43 -0.794 . . . . 0.0 111.679 -179.235 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 61.0 m170 -49.06 -52.5 25.18 Favored 'General case' 0 N--CA 1.516 2.853 0 O-C-N 120.816 -1.177 . . . . 0.0 110.412 -179.724 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 28.2 p -135.39 -165.02 1.62 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.227 -0.921 . . . . 0.0 110.404 179.72 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.34 61.78 0.65 Allowed Glycine 0 N--CA 1.492 2.376 0 N-CA-C 107.867 -2.093 . . . . 0.0 107.867 178.309 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.8 t -103.26 137.38 41.48 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.368 -1.077 . . . . 0.0 109.847 -179.007 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 19.1 mtp85 -96.03 52.8 1.32 Allowed 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.206 -0.934 . . . . 0.0 109.612 179.305 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.52 97.59 0.05 OUTLIER Glycine 0 N--CA 1.488 2.164 0 N-CA-C 109.947 -1.261 . . . . 0.0 109.947 179.924 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.6 p -107.9 126.0 52.15 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.246 -1.149 . . . . 0.0 110.049 179.463 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 154' ' ' ALA . . . . . 0.404 ' CB ' ' HB3' ' A' ' 125' ' ' PRO . . . -139.45 137.52 35.66 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.047 -1.033 . . . . 0.0 109.924 -179.374 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.75 -51.07 2.96 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.124 -0.985 . . . . 0.0 110.485 -179.867 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 10.7 p -58.51 -40.2 82.17 Favored 'General case' 0 N--CA 1.511 2.575 0 O-C-N 121.064 -1.022 . . . . 0.0 110.279 -179.891 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 . . . . . 0 N--CA 1.496 1.848 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.442 -179.995 . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.687 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.501 2.095 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -70.58 161.73 45.01 Favored 'Trans proline' 0 C--N 1.317 -1.108 0 O-C-N 123.382 1.201 . . . . 0.0 110.81 -179.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -48.95 -31.69 7.82 Favored 'General case' 0 N--CA 1.514 2.758 0 O-C-N 121.42 -0.8 . . . . 0.0 111.384 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.71 -33.81 35.2 Favored Glycine 0 N--CA 1.499 2.855 0 O-C-N 120.925 -1.109 . . . . 0.0 110.671 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.411 ' HB2' HD11 ' A' ' 77' ' ' LEU . 25.1 t80 -55.42 -33.51 63.6 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 120.929 -1.336 . . . . 0.0 110.623 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -54.13 -36.8 63.67 Favored 'General case' 0 N--CA 1.512 2.654 0 O-C-N 121.01 -1.056 . . . . 0.0 110.331 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.4 mtpp -58.13 -36.22 72.63 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.248 -0.908 . . . . 0.0 110.261 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.848 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.9 pt -116.33 35.8 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 O-C-N 121.192 -0.942 . . . . 0.0 110.602 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.425 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 3.9 tmtt? -83.59 -43.16 0.81 Allowed Pre-proline 0 N--CA 1.508 2.451 0 O-C-N 121.04 -1.038 . . . . 0.0 113.12 -179.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.425 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.6 Cg_endo -76.24 -35.69 2.2 Favored 'Trans proline' 0 N--CA 1.486 1.061 0 O-C-N 122.582 0.78 . . . . 0.0 111.725 -178.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.912 HG21 ' CE2' ' A' ' 62' ' ' TYR . 85.3 m -59.6 -43.8 93.59 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 120.921 -1.112 . . . . 0.0 109.973 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.848 HD12 ' O ' ' A' ' 19' ' ' ILE . 7.2 mt -64.78 -39.88 94.33 Favored 'General case' 0 N--CA 1.506 2.349 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.472 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.8 m -58.23 -35.22 71.37 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.119 -0.988 . . . . 0.0 110.168 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -56.57 -35.88 68.69 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.037 -1.039 . . . . 0.0 110.383 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.61 ' CD1' HD22 ' A' ' 55' ' ' LEU . 11.7 m-85 -57.16 -38.27 73.32 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.085 -1.009 . . . . 0.0 110.578 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 55.2 mm-40 -58.64 -39.61 81.06 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.23 -0.919 . . . . 0.0 110.49 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.422 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.2 mp -65.75 -41.26 89.94 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.385 0 C-N-CA 119.187 -1.005 . . . . 0.0 108.77 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -69.18 -50.33 48.57 Favored 'General case' 0 N--CA 1.506 2.336 0 C-N-CA 119.244 -0.982 . . . . 0.0 108.534 178.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.023 HD11 HG23 ' A' ' 52' ' ' ILE . 3.1 tp -59.73 -35.29 74.25 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.254 -0.904 . . . . 0.0 109.453 178.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.63 -37.32 73.12 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.035 -1.041 . . . . 0.0 110.352 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -62.92 -51.61 66.28 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.201 -1.0 . . . . 0.0 109.588 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.437 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -69.76 -41.2 75.49 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 119.029 -1.069 . . . . 0.0 108.726 178.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -62.5 -34.85 77.69 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.242 -0.911 . . . . 0.0 109.868 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.8 mmtm -70.44 -38.68 74.56 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 120.984 -1.072 . . . . 0.0 110.183 179.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 N--CA 1.51 2.547 0 O-C-N 121.16 -0.962 . . . . 0.0 110.107 179.839 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.497 1.886 0 CA-C-O 120.614 0.245 . . . . 0.0 110.423 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.431 ' HB3' ' CZ2' ' A' ' 50' ' ' TRP . 5.3 m-20 -56.65 -39.66 74.08 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.194 -0.941 . . . . 0.0 109.989 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -60.1 -38.08 81.88 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.26 -0.9 . . . . 0.0 109.922 179.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.42 ' HG2' ' CB ' ' A' ' 33' ' ' ALA . 0.3 OUTLIER -60.02 -45.87 91.36 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.086 -1.008 . . . . 0.0 109.656 179.727 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.44 HD23 ' HA ' ' A' ' 49' ' ' LEU . 30.3 mt -65.39 -36.72 84.84 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.391 -0.924 . . . . 0.0 110.146 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.503 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.0 m0 -59.1 -38.57 79.85 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.058 -1.026 . . . . 0.0 109.635 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -63.01 -31.95 73.2 Favored 'General case' 0 N--CA 1.503 2.221 0 C-N-CA 119.097 -1.041 . . . . 0.0 109.464 178.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 1.023 HG23 HD11 ' A' ' 30' ' ' LEU . 11.3 mt -71.61 -58.55 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.184 0 O-C-N 121.0 -1.062 . . . . 0.0 109.111 179.205 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.7 ptm -59.87 -28.33 67.44 Favored 'General case' 0 N--CA 1.509 2.484 0 C-N-CA 118.601 -1.239 . . . . 0.0 109.988 178.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -69.24 -37.93 78.21 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.826 -1.171 . . . . 0.0 109.153 178.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.61 HD22 ' CD1' ' A' ' 26' ' ' PHE . 11.0 mt -53.66 -33.28 54.71 Favored 'General case' 0 N--CA 1.512 2.654 0 O-C-N 120.956 -1.09 . . . . 0.0 110.098 179.059 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.44 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 13.7 t60 -54.87 -36.27 64.93 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.082 -1.011 . . . . 0.0 110.137 179.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.435 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 8.0 m170 -59.64 -49.33 78.17 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.029 -1.045 . . . . 0.0 109.381 179.303 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -58.48 -34.46 70.91 Favored 'General case' 0 N--CA 1.507 2.421 0 C-N-CA 119.526 -0.87 . . . . 0.0 109.729 179.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.435 ' HG2' ' CE1' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -64.18 -50.58 67.58 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.068 -1.02 . . . . 0.0 109.545 179.363 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 87.9 p -63.49 -39.67 95.06 Favored 'General case' 0 N--CA 1.504 2.237 0 C-N-CA 119.25 -0.98 . . . . 0.0 109.296 179.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 18.9 ttt85 -63.99 -39.24 93.67 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 119.255 -0.978 . . . . 0.0 109.264 178.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.912 ' CE2' HG21 ' A' ' 22' ' ' THR . 40.4 t80 -63.49 -52.28 61.96 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.175 -0.953 . . . . 0.0 109.416 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.96 HD12 ' HB2' ' A' ' 87' ' ' ALA . 77.5 mt -70.2 -36.71 68.88 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 C-N-CA 119.163 -1.015 . . . . 0.0 109.34 179.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.41 ' HD2' HD13 ' A' ' 92' ' ' ILE . 13.0 t80 -66.83 -43.08 84.66 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.057 -1.027 . . . . 0.0 108.907 179.001 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.406 ' HA ' ' CD ' ' A' ' 69' ' ' LYS . 90.0 m -61.35 -40.46 94.36 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.132 -0.98 . . . . 0.0 110.475 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.576 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.05 -33.32 26.47 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 120.921 -1.112 . . . . 0.0 112.353 -178.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.502 ' N ' HD12 ' A' ' 66' ' ' LEU . 46.9 t80 -86.35 -32.16 21.13 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 120.64 -1.288 . . . . 0.0 111.807 -179.413 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -98.26 -19.32 17.9 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.817 -1.177 . . . . 0.0 112.645 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.406 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 9.1 mtpt -120.35 -59.28 1.79 Allowed 'General case' 0 N--CA 1.502 2.135 0 O-C-N 120.488 -1.382 . . . . 0.0 110.704 179.666 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.406 ' HB3' ' HA ' ' A' ' 66' ' ' LEU . 3.0 ttt85 -62.67 -30.83 71.68 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.164 -0.96 . . . . 0.0 110.837 -179.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 56.86 42.16 26.89 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 120.77 -1.207 . . . . 0.0 109.994 -179.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.66 35.4 3.87 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.38 -0.825 . . . . 0.0 109.991 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.676 HG13 HD23 ' A' ' 77' ' ' LEU . 14.3 tt -153.73 162.6 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.199 -0.938 . . . . 0.0 109.909 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -108.73 146.76 33.02 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.102 -0.999 . . . . 0.0 110.298 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -46.04 -32.11 2.66 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.341 -0.849 . . . . 0.0 111.586 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 38.4 m-20 -61.65 -49.95 74.47 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 120.895 -1.128 . . . . 0.0 109.352 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.676 HD23 HG13 ' A' ' 73' ' ' ILE . 28.9 tp -67.9 -44.28 77.31 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.16 -1.016 . . . . 0.0 108.408 178.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.55 ' HA ' HD12 ' A' ' 81' ' ' LEU . 18.3 t80 -60.03 -37.88 81.05 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.326 -0.859 . . . . 0.0 109.393 179.037 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -74.14 -42.66 59.61 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.154 -0.966 . . . . 0.0 108.695 178.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.687 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 77.7 t90 -57.43 -36.37 71.27 Favored 'General case' 0 N--CA 1.51 2.557 0 O-C-N 121.278 -0.889 . . . . 0.0 109.716 178.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.55 HD12 ' HA ' ' A' ' 78' ' ' TYR . 12.1 mt -69.92 -48.7 57.51 Favored 'General case' 0 N--CA 1.505 2.308 0 O-C-N 121.163 -0.961 . . . . 0.0 108.858 179.079 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.403 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 33.8 mm -56.9 -32.27 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.629 0 O-C-N 121.259 -0.901 . . . . 0.0 110.11 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.8 tmtt? -89.23 -17.9 28.13 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 120.958 -1.089 . . . . 0.0 112.074 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.443 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 21.3 mm-40 -103.68 21.71 15.69 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 120.645 -1.284 . . . . 0.0 112.087 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.7 tttp 74.6 75.07 0.11 Allowed 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.108 -0.995 . . . . 0.0 111.729 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.509 ' HB3' HD11 ' A' ' 63' ' ' ILE . 33.6 m-85 -135.94 -63.42 0.65 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.458 -0.776 . . . . 0.0 109.334 179.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.96 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -123.05 -171.23 2.25 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.401 -0.812 . . . . 0.0 109.276 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.462 ' OD1' HD11 ' A' ' 106' ' ' LEU . 5.5 t0 -131.09 120.25 23.13 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.086 -1.009 . . . . 0.0 110.522 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 10.8 mmtp -77.34 -39.84 46.23 Favored 'General case' 0 N--CA 1.505 2.306 0 C-N-CA 119.528 -0.869 . . . . 0.0 109.649 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 33.0 tp -60.64 -39.96 90.23 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.196 -0.94 . . . . 0.0 109.74 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.792 ' HA ' HD21 ' A' ' 106' ' ' LEU . 60.5 tp -69.85 -49.92 47.73 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.101 -0.999 . . . . 0.0 108.788 179.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.411 HG22 ' HD2' ' A' ' 96' ' ' ARG . 58.1 mt -58.87 -32.35 47.0 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.392 0 C-N-CA 119.361 -0.936 . . . . 0.0 108.993 178.25 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.04 -44.03 70.06 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 120.962 -1.087 . . . . 0.0 109.358 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.49 ' HD3' HD23 ' A' ' 106' ' ' LEU . 5.1 mttp -58.21 -39.14 78.24 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.099 -1.001 . . . . 0.0 110.106 179.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.0 m0 -69.09 -39.77 78.81 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.109 -0.995 . . . . 0.0 109.767 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.411 ' HD2' HG22 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -67.84 -33.95 75.75 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.245 -0.91 . . . . 0.0 110.349 179.494 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 10.3 mmtm -54.17 -177.18 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.679 0 O-C-N 121.081 -1.012 . . . . 0.0 110.526 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.96 131.75 53.69 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.217 -0.927 . . . . 0.0 109.614 179.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 101.44 1.91 53.58 Favored Glycine 0 N--CA 1.492 2.398 0 C-N-CA 120.066 -1.064 . . . . 0.0 111.192 -179.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 41.2 m-85 -105.64 64.03 0.69 Allowed 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 119.595 1.698 . . . . 0.0 109.903 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -88.82 -36.57 15.97 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.102 -0.998 . . . . 0.0 110.121 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -108.23 71.24 0.79 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.153 -0.967 . . . . 0.0 109.786 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.855 HD13 HD13 ' A' ' 109' ' ' ILE . 7.2 tp -117.84 133.08 56.28 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.223 -0.923 . . . . 0.0 109.627 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.435 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.3 p -109.72 -37.44 5.66 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.242 -0.911 . . . . 0.0 112.361 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.757 ' O ' HD11 ' A' ' 103' ' ' LEU . 6.6 m -141.04 -169.06 2.75 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.217 -1.552 . . . . 0.0 110.1 178.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.792 HD21 ' HA ' ' A' ' 91' ' ' LEU . 27.9 mt -97.34 -38.07 9.79 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.186 -0.946 . . . . 0.0 110.282 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 8.7 ttt-85 -101.15 30.06 4.34 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 120.966 -1.084 . . . . 0.0 109.734 177.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.667 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.3 1.7 t -126.56 15.07 7.63 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.07 -1.019 . . . . 0.0 108.995 -179.375 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.855 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -159.07 37.26 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.404 0 O-C-N 120.788 -1.195 . . . . 0.0 110.759 -179.015 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.619 ' C ' HG23 ' A' ' 119' ' ' THR . 10.6 mm100 . . . . . 0 N--CA 1.5 2.061 0 O-C-N 120.643 -1.286 . . . . 0.0 111.767 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.619 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.1 m . . . . . 0 N--CA 1.494 1.766 0 CA-C-O 120.735 0.302 . . . . 0.0 110.321 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.425 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 47.9 t -105.37 155.37 19.18 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.395 -0.816 . . . . 0.0 109.385 179.123 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.812 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -71.41 -35.94 59.05 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.344 0 O-C-N 121.113 -0.992 . . . . 0.0 110.801 -179.471 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.436 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.3 p -55.59 -34.27 64.67 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 120.8 -1.187 . . . . 0.0 110.929 -179.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -35.83 78.17 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 120.957 -1.09 . . . . 0.0 109.607 178.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.2 t -77.63 124.98 86.54 Favored Pre-proline 0 N--CA 1.505 2.291 0 O-C-N 121.167 -0.958 . . . . 0.0 109.952 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.618 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.0 Cg_endo -64.94 178.92 1.61 Allowed 'Trans proline' 0 N--CA 1.489 1.237 0 O-C-N 123.176 1.093 . . . . 0.0 110.718 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -75.01 -36.96 61.93 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.287 -0.883 . . . . 0.0 110.627 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.61 -41.57 81.52 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 120.985 -1.072 . . . . 0.0 109.886 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -70.1 -41.19 74.35 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.338 -0.945 . . . . 0.0 108.966 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.618 HD12 ' O ' ' A' ' 125' ' ' PRO . 4.2 mt -64.94 -39.3 93.3 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.27 -0.894 . . . . 0.0 109.465 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -60.41 -40.0 89.41 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.134 -0.979 . . . . 0.0 109.806 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -59.29 -37.67 78.28 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.152 -0.968 . . . . 0.0 110.251 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -59.37 -41.69 89.91 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.178 -0.951 . . . . 0.0 110.042 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.647 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -62.75 -48.23 80.09 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.192 -0.943 . . . . 0.0 109.614 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 1.1 ttt-85 -60.82 -37.1 80.85 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.211 -0.931 . . . . 0.0 110.067 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 33.4 mmtm -67.96 -34.12 75.96 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.103 -0.998 . . . . 0.0 110.781 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 18.4 mtmt -102.82 23.28 12.37 Favored 'General case' 0 N--CA 1.502 2.165 0 O-C-N 120.925 -1.109 . . . . 0.0 111.718 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.53 46.5 53.11 Favored Glycine 0 N--CA 1.499 2.866 0 O-C-N 120.715 -1.24 . . . . 0.0 110.851 179.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.647 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 9.2 t -147.18 -167.7 2.85 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.132 -1.216 . . . . 0.0 110.433 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -123.81 174.61 7.41 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.239 -0.913 . . . . 0.0 110.317 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.6 p -157.35 159.81 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.253 -0.904 . . . . 0.0 110.855 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 29.6 t -170.24 85.95 0.12 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.243 -0.911 . . . . 0.0 110.924 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.787 ' CG ' HD12 ' A' ' 121' ' ' ILE . 47.1 t80 -97.85 161.5 13.71 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.197 -0.939 . . . . 0.0 110.612 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 13.3 m80 -140.63 -61.08 0.5 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.521 -0.737 . . . . 0.0 109.104 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.7 151.48 51.1 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.413 -0.805 . . . . 0.0 109.037 178.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 29.2 p -95.79 153.26 17.83 Favored 'General case' 0 N--CA 1.503 2.203 0 C-N-CA 119.163 -1.015 . . . . 0.0 111.102 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.4 m -72.08 -25.7 24.07 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 O-C-N 121.44 -0.787 . . . . 0.0 111.563 -179.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -50.08 -60.41 2.97 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 120.868 -1.145 . . . . 0.0 110.219 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.503 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 25.0 p -125.83 -165.93 1.49 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.295 -0.878 . . . . 0.0 110.574 179.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -98.59 59.09 0.93 Allowed Glycine 0 N--CA 1.492 2.373 0 N-CA-C 108.16 -1.976 . . . . 0.0 108.16 178.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.7 t -103.84 143.97 32.13 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.316 -1.108 . . . . 0.0 109.931 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 14.0 ttt-85 -98.67 49.78 0.98 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.289 -0.882 . . . . 0.0 109.545 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.25 97.57 0.05 OUTLIER Glycine 0 N--CA 1.488 2.105 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.7 p -109.51 123.79 49.99 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.293 -1.122 . . . . 0.0 110.221 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -140.02 121.56 15.18 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.108 -0.995 . . . . 0.0 109.605 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.502 2.171 0 O-C-N 121.121 -0.987 . . . . 0.0 110.419 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.718 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.503 2.197 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.407 ' HG2' HD13 ' A' ' 77' ' ' LEU . 45.6 Cg_endo -70.7 162.77 41.37 Favored 'Trans proline' 0 C--N 1.317 -1.109 0 O-C-N 123.405 1.213 . . . . 0.0 110.879 -179.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -48.64 -31.88 7.39 Favored 'General case' 0 N--CA 1.514 2.764 0 O-C-N 121.443 -0.785 . . . . 0.0 111.375 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.03 -35.14 40.22 Favored Glycine 0 N--CA 1.5 2.931 0 O-C-N 121.046 -1.034 . . . . 0.0 110.542 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -56.03 -32.93 64.47 Favored 'General case' 0 N--CA 1.511 2.621 0 O-C-N 120.973 -1.31 . . . . 0.0 110.554 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -54.61 -38.5 66.87 Favored 'General case' 0 N--CA 1.511 2.62 0 O-C-N 120.98 -1.075 . . . . 0.0 110.123 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.0 mtmt -58.64 -37.44 75.93 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.315 -0.866 . . . . 0.0 110.087 179.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.712 HD12 ' CD1' ' A' ' 23' ' ' LEU . 2.1 pt -114.86 34.79 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.152 -0.967 . . . . 0.0 110.452 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.5 OUTLIER -83.57 -43.79 0.81 Allowed Pre-proline 0 N--CA 1.509 2.48 0 O-C-N 121.052 -1.03 . . . . 0.0 113.12 -179.177 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.2 Cg_endo -76.13 -36.96 1.67 Allowed 'Trans proline' 0 N--CA 1.486 1.079 0 O-C-N 122.712 0.849 . . . . 0.0 111.455 -178.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.782 HG21 ' CE2' ' A' ' 62' ' ' TYR . 62.7 m -60.39 -44.24 95.84 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.004 -1.06 . . . . 0.0 109.972 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.712 ' CD1' HD12 ' A' ' 19' ' ' ILE . 3.3 mt -65.25 -40.06 93.51 Favored 'General case' 0 N--CA 1.506 2.327 0 C-N-CA 119.411 -0.916 . . . . 0.0 109.453 179.318 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 47.9 m -57.93 -35.51 71.19 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.25 -0.906 . . . . 0.0 110.1 179.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.59 -36.92 69.94 Favored 'General case' 0 N--CA 1.511 2.606 0 O-C-N 121.05 -1.031 . . . . 0.0 110.252 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.73 ' CD2' HD22 ' A' ' 55' ' ' LEU . 14.9 m-85 -58.57 -39.47 80.41 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.094 -1.004 . . . . 0.0 110.457 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -59.89 -38.74 83.09 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.073 -1.017 . . . . 0.0 110.662 -179.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.418 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.2 mp -66.7 -40.27 85.7 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.412 0 C-N-CA 119.196 -1.001 . . . . 0.0 109.241 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.6 tp60 -69.58 -46.5 66.21 Favored 'General case' 0 N--CA 1.506 2.342 0 C-N-CA 119.211 -0.996 . . . . 0.0 108.821 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.739 HD21 HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -64.21 -35.28 80.28 Favored 'General case' 0 N--CA 1.508 2.469 0 C-N-CA 119.283 -0.967 . . . . 0.0 108.923 178.359 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.31 -40.04 77.05 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 120.959 -1.088 . . . . 0.0 110.075 179.338 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -62.58 -50.24 72.08 Favored 'General case' 0 N--CA 1.507 2.392 0 C-N-CA 119.262 -0.975 . . . . 0.0 109.37 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.606 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -65.9 -41.5 91.4 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.38 -0.928 . . . . 0.0 109.088 179.002 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.441 ' CG ' HD23 ' A' ' 30' ' ' LEU . 10.1 mm-40 -63.18 -34.99 78.84 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.22 -0.925 . . . . 0.0 110.03 179.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.6 mtpt -84.1 -37.09 22.46 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.998 -1.064 . . . . 0.0 110.318 179.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 19.2 t70 . . . . . 0 N--CA 1.51 2.543 0 O-C-N 121.044 -1.035 . . . . 0.0 110.032 179.778 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.6 p . . . . . 0 N--CA 1.498 1.932 0 CA-C-O 120.586 0.232 . . . . 0.0 110.491 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -55.31 -37.19 67.04 Favored 'General case' 0 N--CA 1.511 2.6 0 O-C-N 121.153 -0.967 . . . . 0.0 110.172 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -59.05 -39.48 82.17 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.142 -0.974 . . . . 0.0 110.042 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 50.1 tp60 -61.6 -41.23 97.15 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.119 -0.988 . . . . 0.0 109.888 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 49' ' ' LEU . 12.6 mt -59.46 -38.36 80.55 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.273 -0.892 . . . . 0.0 110.319 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.507 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.5 m0 -59.91 -36.79 77.74 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.165 -0.96 . . . . 0.0 110.174 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -60.36 -30.33 69.49 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.065 -1.022 . . . . 0.0 110.126 178.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.739 HG23 HD21 ' A' ' 30' ' ' LEU . 75.0 mt -72.33 -58.68 4.53 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.276 0 O-C-N 120.879 -1.138 . . . . 0.0 109.209 179.253 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 ptm -61.55 -29.55 70.08 Favored 'General case' 0 N--CA 1.508 2.465 0 C-N-CA 118.504 -1.278 . . . . 0.0 109.683 178.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 -68.85 -37.25 79.0 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.79 -1.194 . . . . 0.0 109.063 178.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.73 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.1 mt -53.02 -32.19 45.33 Favored 'General case' 0 N--CA 1.512 2.659 0 O-C-N 121.045 -1.035 . . . . 0.0 110.155 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.464 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 66.0 t60 -54.63 -38.06 66.4 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.062 -1.024 . . . . 0.0 110.072 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.45 ' CD2' HD21 ' A' ' 91' ' ' LEU . 5.5 m170 -61.35 -51.19 69.86 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.17 -0.956 . . . . 0.0 109.362 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -59.38 -33.98 71.87 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 119.474 -0.89 . . . . 0.0 109.668 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.461 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -68.18 -50.2 55.91 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.067 -1.021 . . . . 0.0 109.191 179.15 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 77.3 p -63.38 -38.44 91.16 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.093 -1.004 . . . . 0.0 109.154 178.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 10.4 ttm-85 -64.28 -39.86 94.79 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.165 -0.96 . . . . 0.0 109.184 178.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.782 ' CE2' HG21 ' A' ' 22' ' ' THR . 37.8 t80 -62.85 -51.26 67.73 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.113 -0.992 . . . . 0.0 109.292 179.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.803 HD12 ' HB2' ' A' ' 87' ' ' ALA . 77.5 mt -69.65 -38.99 77.65 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 O-C-N 121.257 -0.902 . . . . 0.0 109.179 179.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.41 ' HD2' HD13 ' A' ' 92' ' ' ILE . 11.8 t80 -65.48 -43.25 90.83 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.195 -0.941 . . . . 0.0 109.05 179.154 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.409 ' HA ' ' CD ' ' A' ' 69' ' ' LYS . 88.2 m -61.04 -41.26 96.25 Favored 'General case' 0 N--CA 1.503 2.186 0 C-N-CA 119.331 -0.948 . . . . 0.0 110.546 -179.501 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.582 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.22 -33.35 26.13 Favored 'General case' 0 N--CA 1.504 2.245 0 C-N-CA 118.926 -1.11 . . . . 0.0 112.52 -178.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.496 ' N ' HD12 ' A' ' 66' ' ' LEU . 52.0 t80 -86.33 -32.7 20.87 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 120.738 -1.226 . . . . 0.0 111.779 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -98.26 -15.74 19.69 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.752 -1.217 . . . . 0.0 112.759 -178.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.409 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 8.2 mtpt -124.88 -59.38 1.43 Allowed 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.394 -1.441 . . . . 0.0 110.778 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.404 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 4.5 ttp85 -62.43 -30.59 71.33 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.153 -0.967 . . . . 0.0 110.829 -179.558 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.4 tttp 57.68 42.49 23.72 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 120.816 -1.178 . . . . 0.0 110.073 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.82 36.3 3.71 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.404 -0.81 . . . . 0.0 109.82 179.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.761 HG13 HD23 ' A' ' 77' ' ' LEU . 14.2 tt -154.53 162.7 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.126 -0.984 . . . . 0.0 110.011 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 73.3 m -109.8 146.81 34.38 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.174 -0.954 . . . . 0.0 110.065 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -45.25 -32.45 1.94 Allowed 'General case' 0 N--CA 1.515 2.819 0 O-C-N 121.323 -0.861 . . . . 0.0 111.7 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -61.88 -50.63 71.45 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.956 -1.09 . . . . 0.0 109.374 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.761 HD23 HG13 ' A' ' 73' ' ' ILE . 30.6 tp -66.98 -43.75 82.21 Favored 'General case' 0 N--CA 1.505 2.296 0 C-N-CA 119.155 -1.018 . . . . 0.0 108.584 178.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.473 ' HA ' HD12 ' A' ' 81' ' ' LEU . 15.7 t80 -60.78 -38.38 85.07 Favored 'General case' 0 N--CA 1.506 2.344 0 C-N-CA 119.645 -0.822 . . . . 0.0 109.317 178.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.493 ' O ' HG22 ' A' ' 82' ' ' ILE . 20.1 t0 -74.63 -41.19 60.82 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.136 -0.977 . . . . 0.0 108.892 178.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.718 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 86.6 t90 -59.13 -39.14 81.41 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.184 -0.947 . . . . 0.0 109.259 178.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.473 HD12 ' HA ' ' A' ' 78' ' ' TYR . 14.8 mt -65.61 -54.75 23.4 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.211 -0.93 . . . . 0.0 109.223 179.072 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.578 HD12 ' HB3' ' A' ' 87' ' ' ALA . 0.7 OUTLIER -55.9 -27.63 22.94 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.423 0 O-C-N 121.123 -0.986 . . . . 0.0 110.701 -179.745 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.2 tttm -88.2 -19.46 26.86 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 120.899 -1.126 . . . . 0.0 111.628 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.446 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 77.0 mm-40 -102.77 23.74 11.65 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 120.623 -1.298 . . . . 0.0 111.843 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.41 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 15.6 tttt 76.34 69.57 0.07 Allowed 'General case' 0 N--CA 1.513 2.696 0 O-C-N 121.175 -0.953 . . . . 0.0 111.916 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.57 ' HE2' HD13 ' A' ' 23' ' ' LEU . 28.3 m-85 -132.04 -63.1 0.82 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.467 -0.771 . . . . 0.0 109.134 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.803 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -131.2 167.43 19.17 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.477 -0.764 . . . . 0.0 109.464 179.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.464 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 24.2 t70 -120.35 121.1 37.86 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.091 -1.006 . . . . 0.0 110.599 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 29.5 mtpt -67.75 -35.39 78.64 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 121.304 -0.873 . . . . 0.0 110.227 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.726 HD23 HD13 ' A' ' 106' ' ' LEU . 25.7 tp -58.56 -40.87 84.3 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.017 -1.052 . . . . 0.0 109.965 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.462 ' HA ' HD21 ' A' ' 106' ' ' LEU . 58.5 tp -70.58 -50.62 35.41 Favored 'General case' 0 N--CA 1.506 2.343 0 C-N-CA 119.185 -1.006 . . . . 0.0 108.652 179.145 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.41 HD13 ' HD2' ' A' ' 64' ' ' TYR . 63.2 mt -58.45 -34.83 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.457 0 C-N-CA 119.209 -0.996 . . . . 0.0 108.823 178.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.95 -39.51 87.29 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.049 -1.032 . . . . 0.0 109.135 178.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.424 ' HD2' ' CE1' ' A' ' 100' ' ' TYR . 4.9 mmtt -57.27 -44.66 84.17 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.098 -1.001 . . . . 0.0 109.174 179.176 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.3 m0 -63.41 -35.41 80.33 Favored 'General case' 0 N--CA 1.509 2.477 0 C-N-CA 119.562 -0.855 . . . . 0.0 110.1 179.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.01 -32.53 45.15 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.087 -1.008 . . . . 0.0 110.723 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.5 mmtt -53.69 -176.91 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.714 0 O-C-N 120.989 -1.069 . . . . 0.0 110.715 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.2 m -102.91 135.07 45.27 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.099 -1.001 . . . . 0.0 109.711 179.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.03 11.71 54.07 Favored Glycine 0 N--CA 1.494 2.524 0 C-N-CA 120.183 -1.008 . . . . 0.0 111.056 -179.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.585 ' HB3' HD23 ' A' ' 103' ' ' LEU . 50.4 m-85 -119.97 71.94 0.91 Allowed 'General case' 0 N--CA 1.492 1.641 0 CA-C-N 119.41 1.605 . . . . 0.0 109.823 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -97.37 -34.24 11.12 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.192 -0.942 . . . . 0.0 111.18 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.1 63.4 1.15 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.974 -1.079 . . . . 0.0 111.044 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.585 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.1 pp -111.57 152.98 26.95 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.0 -1.062 . . . . 0.0 109.67 179.182 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.429 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.8 p -113.17 -30.28 7.01 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.156 -0.965 . . . . 0.0 113.463 -179.138 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.634 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.9 m -143.47 -169.03 2.97 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 120.161 -1.587 . . . . 0.0 110.175 179.372 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.726 HD13 HD23 ' A' ' 90' ' ' LEU . 16.4 mt -95.39 -38.74 10.35 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.173 -0.954 . . . . 0.0 109.95 178.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 5.6 ttt85 -102.02 29.81 4.83 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.928 -1.108 . . . . 0.0 110.092 178.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.634 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.301 1.8 t -127.65 17.57 6.89 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.035 -1.041 . . . . 0.0 108.847 -179.564 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.461 HG23 ' C ' ' A' ' 108' ' ' CYS . 1.3 pt -158.36 38.66 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.277 0 O-C-N 120.982 -1.074 . . . . 0.0 110.216 -178.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.765 ' C ' HG23 ' A' ' 119' ' ' THR . 25.6 mt-30 . . . . . 0 N--CA 1.506 2.366 0 O-C-N 120.91 -1.119 . . . . 0.0 111.02 -178.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.765 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.4 m . . . . . 0 N--CA 1.494 1.754 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 48.7 t -94.37 154.21 17.59 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 119.401 -0.92 . . . . 0.0 108.804 178.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.953 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -74.66 -30.6 25.22 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.381 0 O-C-N 121.021 -1.05 . . . . 0.0 111.654 -178.706 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.493 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.7 p -59.46 -35.75 74.67 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 120.594 -1.316 . . . . 0.0 110.639 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.82 -31.1 64.38 Favored 'General case' 0 N--CA 1.512 2.655 0 O-C-N 120.95 -1.093 . . . . 0.0 109.998 178.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 60.7 t -82.61 124.54 77.45 Favored Pre-proline 0 N--CA 1.504 2.256 0 O-C-N 121.061 -1.024 . . . . 0.0 109.974 179.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -66.21 176.03 4.31 Favored 'Trans proline' 0 N--CA 1.489 1.242 0 O-C-N 123.172 1.09 . . . . 0.0 110.871 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.0 mmm-85 -75.15 -38.37 60.98 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.292 -0.88 . . . . 0.0 110.162 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.47 -40.01 77.63 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 121.042 -1.036 . . . . 0.0 109.994 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -68.38 -42.59 78.87 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.228 -0.92 . . . . 0.0 109.192 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.889 HD11 HD11 ' A' ' 121' ' ' ILE . 11.7 mt -65.1 -39.36 93.03 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.413 -0.915 . . . . 0.0 109.362 179.145 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -59.04 -37.96 78.19 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.116 -0.99 . . . . 0.0 110.061 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -58.34 -39.03 78.38 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 121.123 -0.986 . . . . 0.0 110.195 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -62.41 -46.93 86.35 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.268 -0.895 . . . . 0.0 109.724 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.532 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -59.21 -38.39 79.8 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.167 -0.958 . . . . 0.0 110.2 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 25.6 ttt85 -67.59 -38.97 84.79 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.19 -0.944 . . . . 0.0 110.107 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 16.9 mttp -72.01 -34.67 69.04 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.067 -1.02 . . . . 0.0 110.511 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -88.61 -19.67 25.96 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.044 -1.035 . . . . 0.0 111.626 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.38 33.36 9.45 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.532 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.6 t -133.07 -160.67 1.07 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.066 -1.256 . . . . 0.0 109.737 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -134.19 144.45 48.47 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.076 -1.015 . . . . 0.0 110.098 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.495 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.7 p -131.45 160.58 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.169 -0.957 . . . . 0.0 110.349 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 39.2 t -169.26 95.16 0.32 Allowed 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.219 -0.925 . . . . 0.0 110.928 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.953 ' CD1' HD12 ' A' ' 121' ' ' ILE . 72.9 t80 -99.25 159.88 14.68 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.273 -0.892 . . . . 0.0 110.767 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 10.1 m170 -138.43 -61.12 0.6 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -138.57 150.82 46.72 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.429 -0.794 . . . . 0.0 109.227 178.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . 0.429 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 30.6 p -93.6 154.12 18.02 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.015 -1.053 . . . . 0.0 110.941 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 19.7 m -73.55 -23.14 19.27 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.46 0 O-C-N 121.363 -0.835 . . . . 0.0 111.669 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -51.39 -62.06 1.85 Allowed 'General case' 0 N--CA 1.515 2.793 0 O-C-N 120.742 -1.224 . . . . 0.0 110.066 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.507 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 21.6 p -124.17 -163.8 1.19 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.265 -0.897 . . . . 0.0 110.385 179.543 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . 0.412 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.33 63.86 0.61 Allowed Glycine 0 N--CA 1.491 2.333 0 N-CA-C 107.997 -2.041 . . . . 0.0 107.997 178.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 34.4 t -101.09 142.41 32.59 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.289 -1.124 . . . . 0.0 109.687 -179.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -101.09 43.44 1.06 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.233 -0.917 . . . . 0.0 109.78 179.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 80.62 94.81 0.41 Allowed Glycine 0 N--CA 1.486 2.009 0 N-CA-C 109.87 -1.292 . . . . 0.0 109.87 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.8 p -107.85 123.95 49.36 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.272 -1.134 . . . . 0.0 110.205 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -143.1 141.66 31.3 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.081 -1.012 . . . . 0.0 110.089 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.497 1.897 0 O-C-N 121.167 -0.958 . . . . 0.0 109.617 179.544 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.698 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.506 2.365 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.26 162.12 42.51 Favored 'Trans proline' 0 C--N 1.317 -1.092 0 O-C-N 123.311 1.164 . . . . 0.0 110.794 -179.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -48.99 -31.77 8.02 Favored 'General case' 0 N--CA 1.514 2.758 0 O-C-N 121.474 -0.767 . . . . 0.0 111.339 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.53 -34.45 42.69 Favored Glycine 0 N--CA 1.5 2.909 0 O-C-N 120.987 -1.071 . . . . 0.0 110.431 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -54.65 -32.35 59.0 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 120.968 -1.313 . . . . 0.0 110.649 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -55.21 -38.95 69.09 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.012 -1.055 . . . . 0.0 110.194 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 29.5 mttt -58.2 -37.28 74.49 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.236 -0.915 . . . . 0.0 110.078 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.714 HG22 ' OH ' ' A' ' 62' ' ' TYR . 1.6 pt -114.62 34.61 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.2 -0.938 . . . . 0.0 110.323 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.439 ' NZ ' ' OG1' ' A' ' 24' ' ' THR . 0.0 OUTLIER -84.73 -43.04 0.7 Allowed Pre-proline 0 N--CA 1.51 2.534 0 O-C-N 120.974 -1.079 . . . . 0.0 113.331 -179.024 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.1 Cg_endo -75.6 -36.66 2.1 Favored 'Trans proline' 0 N--CA 1.487 1.092 0 O-C-N 122.566 0.772 . . . . 0.0 111.583 -178.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.577 HG21 ' CE2' ' A' ' 62' ' ' TYR . 75.2 m -60.4 -43.5 96.63 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.046 -1.034 . . . . 0.0 109.936 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.666 HD12 ' O ' ' A' ' 19' ' ' ILE . 3.3 mt -64.05 -39.38 93.96 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.233 -0.917 . . . . 0.0 109.571 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.439 ' OG1' ' NZ ' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -58.95 -37.0 75.74 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.062 -1.024 . . . . 0.0 110.15 179.595 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -57.38 -36.41 71.22 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.167 -0.958 . . . . 0.0 110.29 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.726 ' CD2' HD22 ' A' ' 55' ' ' LEU . 16.9 m-85 -57.43 -38.54 74.55 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.085 -1.009 . . . . 0.0 110.47 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -62.96 -22.48 66.84 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.168 -0.958 . . . . 0.0 111.854 -179.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.568 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.8 mp -81.26 -33.94 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.738 -1.226 . . . . 0.0 109.954 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -81.66 -34.59 30.68 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 120.949 -1.094 . . . . 0.0 109.438 178.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.755 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -75.83 -32.08 59.64 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.1 -1.0 . . . . 0.0 109.942 178.8 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.2 ptt85 -68.55 -34.84 76.54 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 120.874 -1.141 . . . . 0.0 109.998 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -68.15 -41.1 82.08 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.01 -1.056 . . . . 0.0 109.54 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.479 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -67.21 -43.35 82.29 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.269 -0.895 . . . . 0.0 109.325 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.6 mm100 -61.99 -38.79 89.92 Favored 'General case' 0 N--CA 1.506 2.373 0 C-N-CA 119.454 -0.898 . . . . 0.0 109.815 179.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 37.2 mmtm -62.41 -36.7 83.18 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.101 -1.0 . . . . 0.0 110.422 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.5 t70 . . . . . 0 N--CA 1.509 2.52 0 O-C-N 121.059 -1.026 . . . . 0.0 110.04 -179.891 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 18.7 m . . . . . 0 N--CA 1.499 1.984 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -57.74 -39.62 77.75 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.2 -0.937 . . . . 0.0 109.813 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -60.05 -38.55 83.11 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.15 -0.969 . . . . 0.0 109.917 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 34.2 tp60 -59.09 -42.54 90.7 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 121.068 -1.02 . . . . 0.0 109.895 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.46 HD13 ' HA ' ' A' ' 49' ' ' LEU . 4.2 mm? -58.96 -37.93 77.9 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.224 -0.923 . . . . 0.0 109.993 179.466 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.495 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 37.5 m0 -59.95 -36.16 76.48 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.198 -0.939 . . . . 0.0 109.435 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -64.74 -33.11 75.19 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 120.696 -1.252 . . . . 0.0 109.502 178.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.755 HG23 ' CG ' ' A' ' 30' ' ' LEU . 73.4 mt -71.24 -55.17 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.315 0 O-C-N 120.981 -1.074 . . . . 0.0 109.377 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.487 ' CE ' ' HB2' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -60.56 -32.22 71.3 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 118.687 -1.205 . . . . 0.0 109.5 179.015 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.18 -41.35 96.65 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 120.856 -1.153 . . . . 0.0 108.975 178.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.726 HD22 ' CD2' ' A' ' 26' ' ' PHE . 18.2 mt -54.27 -33.76 59.34 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.242 -0.911 . . . . 0.0 109.779 178.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.447 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 13.8 t60 -56.58 -40.62 75.53 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.105 -0.997 . . . . 0.0 109.545 179.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.489 ' CD2' HD21 ' A' ' 91' ' ' LEU . 7.5 m170 -61.13 -49.84 75.61 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.212 -0.93 . . . . 0.0 108.981 178.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -60.57 -38.46 84.66 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.289 -0.882 . . . . 0.0 109.302 179.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.456 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.71 -48.98 74.91 Favored 'General case' 0 N--CA 1.507 2.381 0 C-N-CA 119.33 -0.948 . . . . 0.0 109.015 179.187 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 76.8 p -66.71 -40.43 88.45 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.159 -0.963 . . . . 0.0 108.881 178.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 39.4 ttt85 -64.17 -37.16 86.46 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.115 -0.99 . . . . 0.0 109.502 178.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.714 ' OH ' HG22 ' A' ' 19' ' ' ILE . 40.7 t80 -60.98 -49.73 76.25 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.078 -1.014 . . . . 0.0 109.332 179.473 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.951 HD12 ' HB2' ' A' ' 87' ' ' ALA . 83.9 mt -75.87 -42.75 39.82 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.32 0 O-C-N 121.207 -0.933 . . . . 0.0 109.011 179.108 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.523 ' CE1' HG23 ' A' ' 92' ' ' ILE . 34.8 t80 -59.05 -26.73 64.85 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.384 -0.822 . . . . 0.0 110.352 178.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 67.1 m -87.28 -34.69 18.82 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.787 -1.195 . . . . 0.0 110.533 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.614 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -82.9 -34.17 26.71 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 120.77 -1.207 . . . . 0.0 112.151 -179.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.548 ' N ' HD12 ' A' ' 66' ' ' LEU . 54.2 t80 -86.54 -36.65 18.82 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 120.672 -1.267 . . . . 0.0 111.873 -179.395 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -95.83 -20.58 18.71 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.901 -1.124 . . . . 0.0 112.84 -178.255 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -119.34 -58.05 1.95 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 120.574 -1.329 . . . . 0.0 111.164 -179.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.423 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -64.77 -30.48 71.49 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.004 -1.06 . . . . 0.0 110.655 -179.841 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 58.74 44.26 17.42 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 120.852 -1.155 . . . . 0.0 110.047 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -115.91 37.61 3.59 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.416 -0.802 . . . . 0.0 109.836 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.785 HG13 HD23 ' A' ' 77' ' ' LEU . 14.2 tt -156.09 162.8 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.182 -0.949 . . . . 0.0 110.118 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.3 p -108.47 147.63 31.39 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.101 -0.999 . . . . 0.0 110.102 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.4 tttp -45.9 -32.67 2.79 Favored 'General case' 0 N--CA 1.516 2.861 0 O-C-N 121.381 -0.825 . . . . 0.0 111.574 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -61.75 -49.33 76.81 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.886 -1.134 . . . . 0.0 109.467 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.785 HD23 HG13 ' A' ' 73' ' ' ILE . 50.4 tp -67.42 -44.08 79.64 Favored 'General case' 0 N--CA 1.505 2.317 0 C-N-CA 119.212 -0.995 . . . . 0.0 108.606 178.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.474 ' HA ' HD12 ' A' ' 81' ' ' LEU . 21.8 t80 -60.98 -38.48 86.1 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.304 -0.872 . . . . 0.0 109.43 178.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -73.89 -42.3 60.9 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.083 -1.011 . . . . 0.0 108.942 178.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.698 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 81.6 t90 -58.3 -37.04 74.25 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.24 -0.913 . . . . 0.0 109.667 178.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.508 HD22 ' CD2' ' A' ' 86' ' ' TYR . 13.6 mt -68.96 -48.68 62.6 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.175 -0.953 . . . . 0.0 108.981 179.209 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.459 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 32.4 mm -57.1 -30.89 35.64 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.553 0 O-C-N 121.145 -0.972 . . . . 0.0 110.1 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -87.86 -22.24 24.55 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.896 -1.128 . . . . 0.0 111.804 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.444 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 72.9 mm-40 -100.42 21.17 13.57 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 120.696 -1.253 . . . . 0.0 111.998 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt 73.56 79.42 0.13 Allowed 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.021 -1.049 . . . . 0.0 111.472 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.641 ' HE2' HD13 ' A' ' 23' ' ' LEU . 31.5 m-85 -137.35 -64.92 0.55 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.554 -0.716 . . . . 0.0 109.669 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.951 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -115.47 173.08 6.71 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.425 -0.797 . . . . 0.0 109.212 179.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.447 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 3.5 t0 -116.95 104.13 10.97 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.072 -1.017 . . . . 0.0 110.403 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.77 -39.23 84.17 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.225 -0.922 . . . . 0.0 109.857 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 18.1 tp -60.92 -40.54 93.58 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.219 -0.925 . . . . 0.0 109.947 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.587 ' HA ' HD21 ' A' ' 106' ' ' LEU . 45.5 tp -70.65 -49.06 51.43 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.266 -0.973 . . . . 0.0 108.875 179.346 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.523 HG23 ' CE1' ' A' ' 64' ' ' TYR . 49.6 mt -62.29 -32.08 53.71 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.32 0 C-N-CA 119.287 -0.965 . . . . 0.0 108.917 178.34 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -71.76 -42.08 67.64 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.02 -1.05 . . . . 0.0 109.157 178.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.496 ' HD3' HD23 ' A' ' 106' ' ' LEU . 13.0 mttp -60.73 -40.1 91.13 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.073 -1.017 . . . . 0.0 110.07 179.346 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 3.4 m0 -66.03 -38.01 87.33 Favored 'General case' 0 N--CA 1.509 2.514 0 C-N-CA 119.188 -1.005 . . . . 0.0 109.967 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.19 -35.27 63.96 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.113 -0.992 . . . . 0.0 110.179 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 17.0 mmtt -53.31 -178.82 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.671 0 O-C-N 121.124 -0.985 . . . . 0.0 110.639 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 18.4 m -107.09 142.05 37.37 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.261 -0.899 . . . . 0.0 109.438 179.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 101.98 -25.39 28.02 Favored Glycine 0 N--CA 1.494 2.508 0 C-N-CA 119.793 -1.194 . . . . 0.0 110.32 -179.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -91.71 57.88 3.34 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 120.691 -1.476 . . . . 0.0 110.111 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -70.65 -38.3 73.82 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.07 -1.019 . . . . 0.0 109.934 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.26 87.88 2.81 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.177 -0.952 . . . . 0.0 110.153 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.962 HD13 HD13 ' A' ' 109' ' ' ILE . 15.8 tp -120.35 133.01 55.52 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.187 -0.946 . . . . 0.0 109.733 -179.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.446 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.1 p -106.21 -36.03 7.01 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.175 -0.953 . . . . 0.0 112.165 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.866 ' O ' HD11 ' A' ' 103' ' ' LEU . 7.1 m -140.17 -169.11 2.68 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.26 -1.525 . . . . 0.0 109.461 178.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.587 HD21 ' HA ' ' A' ' 91' ' ' LEU . 15.3 mt -98.45 -36.1 10.05 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.064 -1.022 . . . . 0.0 110.662 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 18.3 ttm-85 -103.57 35.25 2.66 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 120.903 -1.123 . . . . 0.0 109.06 177.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.68 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.306 1.7 t -129.12 18.91 5.97 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.273 -0.892 . . . . 0.0 109.011 -178.907 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.962 HD13 HD13 ' A' ' 103' ' ' LEU . 1.3 pt -158.14 38.31 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 O-C-N 120.929 -1.107 . . . . 0.0 110.288 -178.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.576 ' C ' HG23 ' A' ' 119' ' ' THR . 11.7 tm0? . . . . . 0 N--CA 1.509 2.525 0 O-C-N 120.878 -1.139 . . . . 0.0 110.79 -178.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.576 HG23 ' C ' ' A' ' 110' ' ' GLN . 2.8 m . . . . . 0 N--CA 1.495 1.821 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.447 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 48.9 t -102.4 154.98 18.56 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.241 -0.912 . . . . 0.0 109.74 179.273 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.802 HD12 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -73.39 -36.83 49.73 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.348 0 O-C-N 121.202 -0.936 . . . . 0.0 111.016 -179.422 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.44 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 6.5 p -53.35 -31.39 44.26 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 120.775 -1.203 . . . . 0.0 111.262 -178.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.73 -32.89 72.15 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 120.98 -1.075 . . . . 0.0 109.765 178.334 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 53.0 t -81.57 125.5 78.3 Favored Pre-proline 0 N--CA 1.505 2.319 0 O-C-N 121.032 -1.042 . . . . 0.0 110.075 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.522 ' O ' HD12 ' A' ' 129' ' ' LEU . 40.0 Cg_endo -67.18 175.9 5.24 Favored 'Trans proline' 0 N--CA 1.488 1.199 0 O-C-N 123.191 1.1 . . . . 0.0 110.639 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.11 -36.74 61.65 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.241 -0.912 . . . . 0.0 110.739 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.98 -41.65 83.41 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 120.946 -1.096 . . . . 0.0 110.024 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -68.16 -41.63 81.28 Favored 'General case' 0 N--CA 1.506 2.356 0 C-N-CA 119.317 -0.953 . . . . 0.0 109.221 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.523 HD11 HD11 ' A' ' 121' ' ' ILE . 2.5 mt -62.79 -39.52 94.51 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.236 -0.915 . . . . 0.0 109.669 179.235 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -59.24 -39.56 83.14 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.191 -0.943 . . . . 0.0 110.027 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -60.19 -39.26 85.89 Favored 'General case' 0 N--CA 1.508 2.46 0 C-N-CA 119.385 -0.926 . . . . 0.0 110.05 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -61.86 -46.09 90.92 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.231 -0.918 . . . . 0.0 109.812 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.487 ' HB1' ' HA ' ' A' ' 139' ' ' GLN . . . -61.53 -41.21 97.0 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.177 -0.952 . . . . 0.0 109.916 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 10.0 mmt-85 -65.57 -33.89 76.98 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.228 -0.92 . . . . 0.0 110.343 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 26.2 ttmt -76.82 -31.67 57.07 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.042 -1.036 . . . . 0.0 111.016 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 4.0 tppt? -99.93 23.38 9.87 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 120.945 -1.097 . . . . 0.0 111.762 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.89 46.74 49.11 Favored Glycine 0 N--CA 1.5 2.913 0 O-C-N 120.732 -1.23 . . . . 0.0 110.951 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.438 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 10.1 t -146.61 -163.54 1.77 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.065 -1.256 . . . . 0.0 110.295 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . 0.487 ' HA ' ' HB1' ' A' ' 133' ' ' ALA . 30.5 mt-30 -137.12 151.02 48.38 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.105 -0.997 . . . . 0.0 110.396 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.473 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.3 p -132.9 161.1 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.23 -0.919 . . . . 0.0 110.004 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 47.3 t -169.3 75.73 0.09 Allowed 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.172 -0.955 . . . . 0.0 111.211 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.802 ' CG ' HD12 ' A' ' 121' ' ' ILE . 36.8 t80 -91.86 161.62 14.77 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.263 -0.898 . . . . 0.0 109.975 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 3.3 m80 -139.54 -60.91 0.55 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.517 -0.739 . . . . 0.0 109.157 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.26 152.27 50.69 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 179.259 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 25.4 p -98.66 155.24 17.42 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.313 -0.867 . . . . 0.0 110.532 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.3 p -75.33 -23.31 16.92 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.572 0 O-C-N 121.271 -0.893 . . . . 0.0 112.045 -179.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -52.27 -44.54 65.02 Favored 'General case' 0 N--CA 1.516 2.867 0 O-C-N 120.667 -1.27 . . . . 0.0 109.592 179.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.495 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 29.3 p -140.15 -169.41 2.74 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.34 -0.85 . . . . 0.0 110.599 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . 0.446 ' CA ' ' CE3' ' A' ' 50' ' ' TRP . . . -98.98 56.93 0.93 Allowed Glycine 0 N--CA 1.489 2.169 0 N-CA-C 107.426 -2.27 . . . . 0.0 107.426 178.268 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 24.1 t -101.19 142.51 32.52 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.466 -1.02 . . . . 0.0 109.672 -178.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 2.4 ttp85 -97.4 53.02 1.13 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.258 -0.901 . . . . 0.0 109.379 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.42 97.55 0.03 OUTLIER Glycine 0 N--CA 1.488 2.139 0 N-CA-C 109.559 -1.417 . . . . 0.0 109.559 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 p -107.57 128.69 54.75 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.319 -1.106 . . . . 0.0 110.338 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -136.79 141.58 42.92 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.157 -0.964 . . . . 0.0 110.108 -179.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.498 1.927 0 O-C-N 121.211 -0.931 . . . . 0.0 109.672 179.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.733 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.503 2.198 0 CA-C-O 120.45 0.167 . . . . 0.0 110.69 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -73.75 162.71 38.93 Favored 'Trans proline' 0 C--N 1.318 -1.037 0 O-C-N 123.272 1.143 . . . . 0.0 110.52 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -48.94 -31.95 8.23 Favored 'General case' 0 N--CA 1.516 2.845 0 O-C-N 121.317 -0.864 . . . . 0.0 111.327 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.93 -34.46 51.77 Favored Glycine 0 N--CA 1.498 2.775 0 O-C-N 121.01 -1.056 . . . . 0.0 110.517 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -54.62 -31.8 57.83 Favored 'General case' 0 N--CA 1.511 2.621 0 O-C-N 120.924 -1.339 . . . . 0.0 110.821 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -54.24 -37.83 65.07 Favored 'General case' 0 N--CA 1.512 2.652 0 O-C-N 120.886 -1.134 . . . . 0.0 110.286 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 15.8 mttm -59.27 -37.62 78.07 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.254 -0.904 . . . . 0.0 110.139 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.868 HD12 HD11 ' A' ' 23' ' ' LEU . 1.7 pt -116.3 34.78 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 O-C-N 121.166 -0.959 . . . . 0.0 110.498 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.42 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.4 OUTLIER -85.1 -43.72 0.67 Allowed Pre-proline 0 N--CA 1.509 2.52 0 O-C-N 121.038 -1.039 . . . . 0.0 113.529 -178.911 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.42 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.1 Cg_endo -74.8 -34.14 4.32 Favored 'Trans proline' 0 N--CA 1.487 1.095 0 O-C-N 122.529 0.752 . . . . 0.0 111.96 -177.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.546 HG21 ' CE2' ' A' ' 62' ' ' TYR . 91.6 m -62.06 -47.78 83.16 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 120.909 -1.119 . . . . 0.0 109.792 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.868 HD11 HD12 ' A' ' 19' ' ' ILE . 7.7 mt -62.45 -39.53 93.68 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.27 -0.894 . . . . 0.0 109.519 179.357 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.7 m -57.1 -34.82 68.73 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.17 -0.956 . . . . 0.0 110.206 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -56.62 -37.13 70.27 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.094 -1.004 . . . . 0.0 110.266 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.606 ' CD2' HD22 ' A' ' 55' ' ' LEU . 20.2 m-85 -56.97 -37.4 71.54 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.141 -0.974 . . . . 0.0 110.254 179.576 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -56.45 -27.81 57.86 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.23 -0.919 . . . . 0.0 110.975 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.486 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.7 mp -77.75 -35.82 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.45 0 O-C-N 121.044 -1.035 . . . . 0.0 109.411 179.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -79.83 -40.03 29.41 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.006 -1.059 . . . . 0.0 108.603 178.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.057 HD11 HG23 ' A' ' 52' ' ' ILE . 7.0 tp -69.46 -34.04 73.81 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.238 -0.914 . . . . 0.0 110.364 179.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -71.41 -35.72 71.09 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 118.833 -1.147 . . . . 0.0 109.854 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -65.33 -39.95 93.05 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.106 -0.996 . . . . 0.0 109.645 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.438 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -72.76 -42.02 64.45 Favored 'General case' 0 N--CA 1.504 2.265 0 C-N-CA 119.167 -1.013 . . . . 0.0 109.031 179.01 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -62.92 -34.11 76.76 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.282 -0.887 . . . . 0.0 109.936 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 40.7 mmtt -84.4 -32.68 24.01 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.036 -1.04 . . . . 0.0 110.78 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.1 t70 . . . . . 0 N--CA 1.511 2.616 0 O-C-N 120.985 -1.072 . . . . 0.0 110.392 179.88 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.8 t . . . . . 0 N--CA 1.504 2.236 0 CA-C-O 120.432 0.158 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 50.0 m-20 -55.85 -38.99 70.83 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 120.982 -1.074 . . . . 0.0 110.122 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -62.36 -41.57 98.72 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.236 -0.915 . . . . 0.0 109.67 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 55.7 tp60 -61.98 -40.62 96.24 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.19 -0.944 . . . . 0.0 109.681 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.408 HD23 HD12 ' A' ' 52' ' ' ILE . 12.5 mt -58.68 -39.02 79.51 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.172 -0.955 . . . . 0.0 109.979 179.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.502 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 52.8 m0 -58.56 -36.84 74.55 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.153 -0.967 . . . . 0.0 109.826 179.398 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -60.71 -30.19 69.81 Favored 'General case' 0 N--CA 1.506 2.325 0 O-C-N 121.08 -1.013 . . . . 0.0 109.733 178.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 1.057 HG23 HD11 ' A' ' 30' ' ' LEU . 22.6 mt -71.36 -60.64 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.226 0 O-C-N 120.952 -1.092 . . . . 0.0 108.845 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.47 ' HE1' ' O ' ' A' ' 147' ' ' HIS . 0.9 OUTLIER -60.51 -28.69 68.58 Favored 'General case' 0 N--CA 1.51 2.537 0 C-N-CA 118.547 -1.261 . . . . 0.0 109.774 178.61 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -72.24 -39.22 68.62 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 120.875 -1.14 . . . . 0.0 108.89 178.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.606 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.0 mt -54.04 -33.71 58.06 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 121.105 -0.997 . . . . 0.0 110.269 178.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.44 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 12.9 t60 -57.03 -35.39 69.22 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.089 -1.007 . . . . 0.0 110.438 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.528 ' NE2' HD21 ' A' ' 91' ' ' LEU . 6.3 m170 -60.56 -50.65 72.69 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 120.981 -1.074 . . . . 0.0 109.603 179.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -58.72 -35.83 73.29 Favored 'General case' 0 N--CA 1.508 2.449 0 C-N-CA 119.501 -0.88 . . . . 0.0 109.596 179.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.449 ' CD ' ' CD1' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -68.27 -49.61 59.37 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.079 -1.013 . . . . 0.0 109.176 179.003 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.1 p -62.12 -38.46 89.02 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.201 -0.937 . . . . 0.0 109.356 179.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 37.5 ttt-85 -65.12 -38.22 89.97 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.092 -1.005 . . . . 0.0 109.384 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.582 ' OH ' HG22 ' A' ' 19' ' ' ILE . 34.1 t80 -59.78 -48.87 79.95 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.211 -0.93 . . . . 0.0 109.368 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.78 HD12 ' HB2' ' A' ' 87' ' ' ALA . 92.0 mt -76.27 -44.25 36.42 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.266 0 C-N-CA 119.505 -0.878 . . . . 0.0 108.869 179.121 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.516 ' CE1' HG23 ' A' ' 92' ' ' ILE . 40.9 t80 -58.92 -25.7 63.67 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.323 -0.86 . . . . 0.0 110.365 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.465 HG23 ' HD3' ' A' ' 69' ' ' LYS . 88.4 m -87.25 -36.09 18.13 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.756 -1.215 . . . . 0.0 110.373 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.564 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -82.92 -33.08 26.93 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 120.813 -1.179 . . . . 0.0 112.34 -179.267 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.518 ' N ' HD12 ' A' ' 66' ' ' LEU . 33.3 t80 -86.42 -34.61 20.1 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 120.707 -1.246 . . . . 0.0 111.922 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.402 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 14.4 m-85 -96.21 -22.02 17.52 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 120.903 -1.123 . . . . 0.0 112.986 -178.181 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.465 ' HD3' HG23 ' A' ' 65' ' ' THR . 8.5 mtpt -112.59 -58.13 2.19 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 120.527 -1.358 . . . . 0.0 110.979 -179.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.401 ' HB2' ' HA ' ' A' ' 66' ' ' LEU . 10.2 mmm-85 -71.7 -29.39 64.51 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.139 -0.975 . . . . 0.0 110.919 -179.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 58.83 43.91 17.61 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.815 -1.178 . . . . 0.0 109.953 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.01 35.08 3.52 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.302 -0.874 . . . . 0.0 109.807 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.778 HG13 HD23 ' A' ' 77' ' ' LEU . 13.4 tt -153.1 162.7 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.23 -0.919 . . . . 0.0 109.784 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.4 p -107.44 146.76 31.31 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.089 -1.007 . . . . 0.0 110.415 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -46.34 -32.31 3.09 Favored 'General case' 0 N--CA 1.516 2.869 0 O-C-N 121.307 -0.87 . . . . 0.0 111.469 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -62.14 -49.68 74.88 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 120.894 -1.129 . . . . 0.0 109.302 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.778 HD23 HG13 ' A' ' 73' ' ' ILE . 49.5 tp -67.28 -43.46 81.74 Favored 'General case' 0 N--CA 1.505 2.295 0 C-N-CA 119.185 -1.006 . . . . 0.0 108.552 178.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.416 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 17.5 t80 -61.64 -38.87 89.27 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.291 -0.88 . . . . 0.0 109.432 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -72.22 -42.41 65.77 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 120.998 -1.064 . . . . 0.0 108.991 178.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.733 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 84.2 t90 -57.94 -36.89 73.16 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.214 -0.929 . . . . 0.0 109.691 179.159 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.659 HD22 ' CD2' ' A' ' 86' ' ' TYR . 30.7 mt -68.75 -46.06 69.82 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.129 -0.982 . . . . 0.0 109.116 179.296 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.2 mm -58.46 -32.84 46.47 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.532 0 O-C-N 121.26 -0.9 . . . . 0.0 110.001 179.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.5 mmtp -89.16 -8.79 52.98 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 120.895 -1.128 . . . . 0.0 112.278 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.452 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 75.7 mm-40 -112.17 21.55 15.71 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 120.556 -1.34 . . . . 0.0 112.04 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt 74.05 77.9 0.12 Allowed 'General case' 0 N--CA 1.51 2.543 0 O-C-N 120.97 -1.081 . . . . 0.0 111.456 179.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.681 ' HE2' HD13 ' A' ' 23' ' ' LEU . 33.6 m-85 -137.06 -63.0 0.62 Allowed 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.558 -0.714 . . . . 0.0 109.49 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.78 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -126.38 175.97 7.47 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.403 -0.811 . . . . 0.0 109.44 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.44 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 19.1 t0 -116.24 105.5 12.64 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.114 -0.991 . . . . 0.0 110.505 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 13.1 mmmt -61.34 -39.74 91.69 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.228 -0.92 . . . . 0.0 109.655 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.773 HD23 HD13 ' A' ' 106' ' ' LEU . 26.9 tp -60.49 -42.41 96.28 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.104 -0.997 . . . . 0.0 109.658 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.776 ' HA ' HD21 ' A' ' 106' ' ' LEU . 43.4 tp -67.78 -49.36 62.82 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.291 -0.964 . . . . 0.0 109.119 179.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.516 HG23 ' CE1' ' A' ' 64' ' ' TYR . 34.3 mt -58.54 -29.88 39.97 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.48 0 C-N-CA 119.27 -0.972 . . . . 0.0 109.212 178.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.68 -46.2 66.62 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 120.911 -1.118 . . . . 0.0 109.328 178.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.514 ' HD3' HD23 ' A' ' 106' ' ' LEU . 6.4 mttp -58.16 -38.94 77.61 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.094 -1.004 . . . . 0.0 110.084 179.194 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.6 m0 -66.27 -39.98 89.81 Favored 'General case' 0 N--CA 1.508 2.467 0 C-N-CA 119.318 -0.953 . . . . 0.0 109.515 179.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.05 -33.65 70.49 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.282 -0.886 . . . . 0.0 110.358 179.468 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.6 mmtp -53.78 -177.17 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.699 0 O-C-N 121.037 -1.039 . . . . 0.0 110.651 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -106.34 133.22 51.37 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.183 -0.948 . . . . 0.0 109.797 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.95 3.1 56.0 Favored Glycine 0 N--CA 1.493 2.487 0 C-N-CA 120.06 -1.067 . . . . 0.0 111.31 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -108.62 48.48 0.86 Allowed 'General case' 0 N--CA 1.498 1.968 0 CA-C-N 119.645 1.723 . . . . 0.0 110.115 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -64.58 -39.51 93.87 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.213 -0.93 . . . . 0.0 109.911 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.78 104.26 11.78 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.153 -0.967 . . . . 0.0 109.979 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.906 HD13 HD13 ' A' ' 109' ' ' ILE . 8.9 tp -141.59 132.48 25.93 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.17 -0.956 . . . . 0.0 109.713 -179.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.444 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.4 p -108.4 -37.3 6.01 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.176 -0.953 . . . . 0.0 112.305 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.816 ' O ' HD11 ' A' ' 103' ' ' LEU . 7.6 m -140.76 -168.93 2.69 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 120.265 -1.522 . . . . 0.0 109.924 178.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.776 HD21 ' HA ' ' A' ' 91' ' ' LEU . 32.7 mt -97.69 -36.74 10.15 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.035 -1.04 . . . . 0.0 110.462 179.272 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 12.1 ttm-85 -103.11 32.72 3.6 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 120.92 -1.112 . . . . 0.0 109.473 178.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.657 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.309 1.7 t -128.98 16.47 6.24 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.207 -0.933 . . . . 0.0 109.219 -179.066 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.906 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -158.89 37.99 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 O-C-N 120.843 -1.161 . . . . 0.0 110.604 -178.732 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.575 ' O ' HG23 ' A' ' 119' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.099 0 O-C-N 120.708 -1.245 . . . . 0.0 111.79 -178.433 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.575 HG23 ' O ' ' A' ' 110' ' ' GLN . 2.5 m . . . . . 0 N--CA 1.493 1.711 0 N-CA-C 110.216 -0.291 . . . . 0.0 110.216 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 45.6 t -92.14 154.44 18.7 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.296 -0.878 . . . . 0.0 109.038 178.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.813 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -71.31 -36.33 61.17 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.42 0 O-C-N 121.101 -1.0 . . . . 0.0 110.882 -179.159 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.446 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.4 p -55.37 -34.35 64.23 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 120.828 -1.17 . . . . 0.0 110.869 -179.004 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.496 ' HG3' HG22 ' A' ' 109' ' ' ILE . 3.0 ttp85 -59.36 -35.55 74.1 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.006 -1.059 . . . . 0.0 109.65 178.399 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 55.6 t -78.91 125.03 84.67 Favored Pre-proline 0 N--CA 1.503 2.202 0 O-C-N 121.171 -0.956 . . . . 0.0 109.823 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.462 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.2 Cg_endo -65.03 174.92 4.26 Favored 'Trans proline' 0 N--CA 1.487 1.133 0 O-C-N 123.143 1.075 . . . . 0.0 110.734 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -75.05 -36.18 61.83 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.203 -0.936 . . . . 0.0 110.719 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.53 -40.9 79.79 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.005 -1.06 . . . . 0.0 109.985 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 7.7 tp60 -69.68 -41.32 75.63 Favored 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 119.341 -0.944 . . . . 0.0 109.274 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.573 HD11 HD11 ' A' ' 121' ' ' ILE . 3.1 mt -65.5 -38.77 90.67 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.204 -0.935 . . . . 0.0 109.554 179.122 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -61.25 -39.91 92.09 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.181 -0.949 . . . . 0.0 109.757 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -59.03 -37.13 76.25 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.179 -0.951 . . . . 0.0 110.326 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -61.4 -44.97 96.22 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.115 -0.991 . . . . 0.0 110.057 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.428 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -60.8 -41.68 96.13 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.172 -0.955 . . . . 0.0 109.914 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 11.0 mtt180 -59.46 -36.9 76.85 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.143 -0.973 . . . . 0.0 110.178 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 44.6 mttm -65.93 -33.77 76.59 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.075 -1.016 . . . . 0.0 110.81 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 35.6 mtmt -105.51 22.39 15.56 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 120.931 -1.106 . . . . 0.0 111.923 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.72 46.47 54.16 Favored Glycine 0 N--CA 1.499 2.89 0 O-C-N 120.608 -1.307 . . . . 0.0 110.799 179.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.428 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 9.4 t -138.84 -163.5 1.48 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.197 -1.178 . . . . 0.0 110.088 179.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -138.6 146.62 41.99 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.098 -1.001 . . . . 0.0 110.549 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.429 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.9 p -131.0 161.46 40.98 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.185 -0.947 . . . . 0.0 109.723 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 42.1 t -166.75 83.56 0.26 Allowed 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.128 -0.982 . . . . 0.0 111.305 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.792 ' CG ' HD12 ' A' ' 121' ' ' ILE . 38.9 t80 -95.0 161.75 14.01 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.295 -0.878 . . . . 0.0 110.049 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -140.67 -60.61 0.51 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.571 -0.705 . . . . 0.0 109.19 179.011 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.22 151.25 50.94 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.437 -0.789 . . . . 0.0 109.293 178.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 28.0 p -97.06 154.43 17.33 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.122 -0.986 . . . . 0.0 111.065 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 19.7 m -74.06 -23.35 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.433 0 O-C-N 121.395 -0.816 . . . . 0.0 111.676 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . 0.47 ' O ' ' HE1' ' A' ' 53' ' ' MET . 3.7 m-70 -51.68 -52.01 51.44 Favored 'General case' 0 N--CA 1.515 2.779 0 O-C-N 120.717 -1.239 . . . . 0.0 109.967 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.502 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 26.4 p -133.58 -164.88 1.55 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.329 -0.857 . . . . 0.0 110.518 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.59 56.51 0.78 Allowed Glycine 0 N--CA 1.492 2.386 0 N-CA-C 107.925 -2.07 . . . . 0.0 107.925 178.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 18.3 t -101.39 144.07 30.65 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.33 -1.1 . . . . 0.0 109.912 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 7.6 ttm-85 -98.49 50.27 0.99 Allowed 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.3 -0.875 . . . . 0.0 109.531 179.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 69.73 98.82 0.04 OUTLIER Glycine 0 N--CA 1.488 2.106 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.0 p -111.13 128.32 55.85 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.237 -1.155 . . . . 0.0 110.229 179.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -144.95 137.31 26.07 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.075 -1.016 . . . . 0.0 110.2 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.502 2.156 0 O-C-N 121.208 -0.933 . . . . 0.0 110.559 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.693 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.499 1.987 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.435 ' HG2' HD13 ' A' ' 77' ' ' LEU . 44.2 Cg_endo -69.94 162.7 41.19 Favored 'Trans proline' 0 C--N 1.317 -1.125 0 O-C-N 123.315 1.166 . . . . 0.0 110.812 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -48.7 -31.83 7.46 Favored 'General case' 0 N--CA 1.514 2.758 0 O-C-N 121.451 -0.78 . . . . 0.0 111.339 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.67 -34.29 43.47 Favored Glycine 0 N--CA 1.499 2.861 0 O-C-N 120.941 -1.1 . . . . 0.0 110.609 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -55.6 -33.19 63.73 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 120.965 -1.315 . . . . 0.0 110.688 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -54.03 -37.65 64.33 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 121.04 -1.037 . . . . 0.0 110.187 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -58.9 -37.45 76.64 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.288 -0.882 . . . . 0.0 110.072 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.727 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.5 pt -116.43 34.5 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 O-C-N 121.118 -0.989 . . . . 0.0 110.554 179.689 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -82.89 -44.29 0.89 Allowed Pre-proline 0 N--CA 1.51 2.544 0 O-C-N 121.011 -1.055 . . . . 0.0 112.871 -179.252 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.4 Cg_endo -76.68 -36.12 1.74 Allowed 'Trans proline' 0 N--CA 1.486 1.087 0 O-C-N 122.642 0.811 . . . . 0.0 111.407 -178.464 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.87 HG21 ' CE2' ' A' ' 62' ' ' TYR . 87.3 m -58.71 -41.77 87.1 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 120.986 -1.071 . . . . 0.0 109.964 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.727 HD12 ' O ' ' A' ' 19' ' ' ILE . 2.3 mt -66.84 -40.97 88.14 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.263 -0.898 . . . . 0.0 109.397 179.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.6 m -59.42 -35.26 73.68 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.199 -0.938 . . . . 0.0 110.084 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -57.04 -36.94 71.07 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 121.036 -1.04 . . . . 0.0 110.266 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.597 ' CD2' HD22 ' A' ' 55' ' ' LEU . 12.5 m-85 -58.18 -37.95 75.74 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.136 -0.977 . . . . 0.0 110.497 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -60.74 -39.78 89.98 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.147 -0.971 . . . . 0.0 110.602 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.414 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.1 mp -65.83 -41.57 90.4 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 C-N-CA 119.23 -0.988 . . . . 0.0 109.039 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -67.78 -48.16 67.13 Favored 'General case' 0 N--CA 1.505 2.319 0 C-N-CA 119.224 -0.99 . . . . 0.0 108.643 178.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.702 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -62.93 -36.39 83.24 Favored 'General case' 0 N--CA 1.509 2.507 0 C-N-CA 119.35 -0.94 . . . . 0.0 108.936 178.356 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -57.31 -41.8 80.59 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.061 -1.025 . . . . 0.0 109.879 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -61.99 -45.28 94.33 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 119.393 -0.923 . . . . 0.0 109.862 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.548 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -68.72 -39.68 80.29 Favored 'General case' 0 N--CA 1.507 2.385 0 C-N-CA 119.343 -0.943 . . . . 0.0 109.652 179.479 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.519 ' HG3' HD23 ' A' ' 30' ' ' LEU . 56.6 mt-30 -68.93 -31.13 69.81 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.218 -0.926 . . . . 0.0 110.647 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.9 mtpt -98.02 -29.17 13.43 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.94 -1.1 . . . . 0.0 111.886 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 . . . . . 0 N--CA 1.511 2.59 0 O-C-N 120.757 -1.214 . . . . 0.0 110.344 -179.837 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.501 2.077 0 CA-C-O 120.608 0.242 . . . . 0.0 110.871 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -57.85 -40.31 79.84 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.098 -1.001 . . . . 0.0 110.151 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -59.94 -39.29 85.02 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.26 -0.9 . . . . 0.0 110.052 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -62.36 -45.94 90.93 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.174 -0.954 . . . . 0.0 109.736 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.449 HD23 ' HA ' ' A' ' 49' ' ' LEU . 23.9 mt -59.21 -36.74 75.94 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.177 -0.952 . . . . 0.0 110.32 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 47.7 m0 -58.63 -37.74 76.56 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 121.035 -1.04 . . . . 0.0 110.038 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -61.22 -32.86 72.64 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 119.148 -1.021 . . . . 0.0 109.701 178.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.702 HG23 ' CG ' ' A' ' 30' ' ' LEU . 74.1 mt -71.06 -59.65 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.283 0 O-C-N 121.092 -1.005 . . . . 0.0 108.883 179.101 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -61.1 -29.4 69.73 Favored 'General case' 0 N--CA 1.511 2.591 0 C-N-CA 118.544 -1.263 . . . . 0.0 109.754 178.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -69.48 -37.15 77.14 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.79 -1.194 . . . . 0.0 109.062 178.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.597 HD22 ' CD2' ' A' ' 26' ' ' PHE . 10.9 mt -53.31 -33.55 53.81 Favored 'General case' 0 N--CA 1.511 2.616 0 O-C-N 120.982 -1.074 . . . . 0.0 110.179 179.048 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.468 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 71.1 t60 -54.47 -38.28 66.22 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 120.965 -1.085 . . . . 0.0 110.059 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.448 ' CD2' HD21 ' A' ' 91' ' ' LEU . 6.6 m170 -61.09 -48.08 83.35 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.193 -0.942 . . . . 0.0 109.359 179.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -59.39 -36.57 76.06 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.279 -0.888 . . . . 0.0 109.676 179.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.417 ' HD2' ' CD2' ' A' ' 26' ' ' PHE . 8.0 mtp85 -63.59 -49.58 72.79 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.125 -0.984 . . . . 0.0 109.477 179.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 93.8 p -63.83 -40.74 97.34 Favored 'General case' 0 N--CA 1.504 2.269 0 C-N-CA 119.301 -0.96 . . . . 0.0 109.118 179.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.9 ttt85 -62.14 -38.85 90.55 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.192 -0.943 . . . . 0.0 109.405 179.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.87 ' CE2' HG21 ' A' ' 22' ' ' THR . 39.1 t80 -62.94 -51.7 65.88 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.081 -1.012 . . . . 0.0 109.345 179.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.588 HD12 ' HB2' ' A' ' 87' ' ' ALA . 92.7 mt -69.81 -37.97 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.365 0 C-N-CA 119.321 -0.952 . . . . 0.0 109.332 179.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.44 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 7.1 t80 -66.1 -42.65 89.0 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.127 -0.983 . . . . 0.0 109.018 178.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 92.9 m -60.78 -40.88 94.21 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.19 -0.944 . . . . 0.0 110.384 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.594 HD12 ' N ' ' A' ' 67' ' ' TYR . 3.7 pp -83.14 -35.34 25.64 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.818 -1.176 . . . . 0.0 112.422 -178.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.594 ' N ' HD12 ' A' ' 66' ' ' LEU . 30.6 t80 -86.48 -33.02 20.49 Favored 'General case' 0 N--CA 1.513 2.712 0 O-C-N 120.589 -1.319 . . . . 0.0 112.054 -179.308 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.44 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 7.0 m-85 -98.41 -6.29 30.88 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 120.802 -1.186 . . . . 0.0 113.138 -178.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 15.0 mtpt -129.8 -58.09 1.1 Allowed 'General case' 0 N--CA 1.502 2.17 0 O-C-N 120.366 -1.459 . . . . 0.0 110.534 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.3 mtt85 -72.01 -28.95 63.72 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.145 -0.972 . . . . 0.0 110.83 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.7 tttp 58.58 43.62 18.89 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.771 -1.205 . . . . 0.0 110.034 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -109.85 34.23 3.96 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.363 -0.836 . . . . 0.0 109.915 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.67 HG13 HD23 ' A' ' 77' ' ' LEU . 13.4 tt -151.07 162.65 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 O-C-N 121.202 -0.936 . . . . 0.0 109.657 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.8 t -107.92 144.3 35.36 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.128 -0.983 . . . . 0.0 110.34 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 50.6 tttt -45.08 -32.48 1.76 Allowed 'General case' 0 N--CA 1.515 2.785 0 O-C-N 121.328 -0.857 . . . . 0.0 111.732 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.42 -49.65 76.02 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 120.915 -1.115 . . . . 0.0 109.321 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.67 HD23 HG13 ' A' ' 73' ' ' ILE . 33.6 tp -67.09 -46.93 72.75 Favored 'General case' 0 N--CA 1.505 2.276 0 C-N-CA 119.077 -1.049 . . . . 0.0 108.45 178.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.806 ' HA ' HD12 ' A' ' 81' ' ' LEU . 19.2 t80 -58.15 -38.64 76.98 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.294 -0.879 . . . . 0.0 109.395 178.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -71.7 -42.97 66.73 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.035 -1.041 . . . . 0.0 108.433 178.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.693 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 73.4 t90 -56.33 -37.76 70.4 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.265 -0.897 . . . . 0.0 109.561 178.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.806 HD12 ' HA ' ' A' ' 78' ' ' TYR . 8.0 mt -66.56 -50.39 63.28 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.206 -0.934 . . . . 0.0 109.153 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 36.9 mm -57.91 -33.18 45.24 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.545 0 O-C-N 121.178 -0.951 . . . . 0.0 110.181 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -89.18 -6.07 57.21 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.894 -1.129 . . . . 0.0 112.416 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.455 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 17.3 mm-40 -115.01 22.61 13.24 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.395 -1.441 . . . . 0.0 112.016 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt 75.08 72.82 0.1 Allowed 'General case' 0 N--CA 1.511 2.623 0 O-C-N 121.104 -0.997 . . . . 0.0 111.679 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.656 ' HE2' HD13 ' A' ' 23' ' ' LEU . 31.5 m-85 -133.37 -62.35 0.79 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.432 -0.793 . . . . 0.0 109.333 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.588 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -132.24 167.26 20.13 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.467 -0.771 . . . . 0.0 109.593 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.468 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.5 t0 -109.77 107.24 17.16 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.155 -0.965 . . . . 0.0 110.237 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 12.4 mmtt -58.17 -38.15 76.08 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.263 -0.898 . . . . 0.0 110.035 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.465 HD23 HD13 ' A' ' 106' ' ' LEU . 13.6 tp -58.82 -38.43 78.62 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.213 -0.929 . . . . 0.0 110.161 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.448 HD21 ' CD2' ' A' ' 57' ' ' HIS . 57.6 tp -71.23 -45.35 63.49 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.133 -0.979 . . . . 0.0 108.835 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.439 HG23 ' CE2' ' A' ' 64' ' ' TYR . 24.9 mt -59.63 -37.78 72.38 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 C-N-CA 119.396 -0.921 . . . . 0.0 108.531 178.208 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.73 -38.99 87.78 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.176 -0.953 . . . . 0.0 109.112 178.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.444 ' HB3' HD22 ' A' ' 103' ' ' LEU . 9.8 mmtm -57.75 -41.25 81.5 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.001 -1.062 . . . . 0.0 109.755 179.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.3 m0 -68.1 -35.36 78.03 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.259 -0.901 . . . . 0.0 110.337 179.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 10.1 mtp85 -83.36 -31.41 26.77 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.072 -1.018 . . . . 0.0 110.888 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.3 mmtt -51.63 177.15 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.739 0 O-C-N 120.865 -1.147 . . . . 0.0 110.759 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.58 140.67 37.23 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.202 -0.936 . . . . 0.0 109.48 179.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 101.07 -23.52 35.23 Favored Glycine 0 N--CA 1.493 2.474 0 C-N-CA 119.814 -1.184 . . . . 0.0 110.407 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.632 ' HB3' HD23 ' A' ' 103' ' ' LEU . 63.5 m-85 -92.04 58.11 3.27 Favored 'General case' 0 N--CA 1.504 2.246 0 CA-C-N 119.098 1.449 . . . . 0.0 110.056 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -66.92 -32.83 74.35 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.138 -0.976 . . . . 0.0 110.522 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt -132.9 102.07 5.49 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.002 -1.061 . . . . 0.0 110.506 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.632 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.9 pp -140.62 155.0 46.67 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.083 -1.011 . . . . 0.0 110.551 179.609 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.429 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.5 p -118.95 -35.61 3.61 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.29 -0.881 . . . . 0.0 113.222 -179.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.697 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.4 m -142.91 -170.72 3.3 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.253 -1.529 . . . . 0.0 110.384 179.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.465 HD13 HD23 ' A' ' 90' ' ' LEU . 24.3 mt -98.35 -35.91 10.15 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.28 -0.887 . . . . 0.0 110.333 178.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 1.1 ttt-85 -103.47 35.18 2.67 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.816 -1.177 . . . . 0.0 109.538 178.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.697 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.279 1.7 t -126.85 -59.75 1.25 Allowed 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 105.65 -1.982 . . . . 0.0 105.65 -179.631 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.752 ' O ' HG21 ' A' ' 119' ' ' THR . 15.1 pt -68.95 -26.01 31.45 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.546 0 O-C-N 120.902 -1.124 . . . . 0.0 110.854 176.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.415 ' N ' HG13 ' A' ' 109' ' ' ILE . 44.3 tt0 . . . . . 0 N--CA 1.494 1.735 0 O-C-N 120.972 -1.08 . . . . 0.0 110.138 -179.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.752 HG21 ' O ' ' A' ' 109' ' ' ILE . 1.7 m . . . . . 0 N--CA 1.495 1.788 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 34.0 t -53.41 153.94 3.73 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 120.928 -1.108 . . . . 0.0 109.801 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.79 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -73.77 -35.26 43.01 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.444 0 O-C-N 121.08 -1.012 . . . . 0.0 111.161 -178.948 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.484 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 12.1 p -54.52 -33.53 60.16 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 120.735 -1.228 . . . . 0.0 111.208 -178.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -34.16 70.1 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.907 -1.121 . . . . 0.0 109.635 178.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.58 HG12 ' HG ' ' A' ' 129' ' ' LEU . 53.0 t -81.65 124.66 79.62 Favored Pre-proline 0 N--CA 1.505 2.282 0 O-C-N 121.123 -0.985 . . . . 0.0 109.779 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.465 ' HD3' ' HB1' ' A' ' 154' ' ' ALA . 39.2 Cg_endo -66.25 178.82 2.28 Favored 'Trans proline' 0 N--CA 1.489 1.234 0 O-C-N 123.194 1.102 . . . . 0.0 110.637 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 6.6 tpt180 -75.04 -38.41 61.44 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.197 -0.939 . . . . 0.0 110.427 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.26 -43.32 92.45 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.074 -1.016 . . . . 0.0 109.809 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.8 tm0? -67.31 -41.17 85.81 Favored 'General case' 0 N--CA 1.505 2.296 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.239 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.639 HD11 HD11 ' A' ' 121' ' ' ILE . 74.6 mt -63.96 -39.94 95.3 Favored 'General case' 0 N--CA 1.506 2.369 0 C-N-CA 119.493 -0.883 . . . . 0.0 109.491 179.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -59.2 -38.3 79.52 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.119 -0.988 . . . . 0.0 109.966 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -57.52 -36.48 71.63 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.107 -0.995 . . . . 0.0 110.397 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -63.07 -48.94 76.47 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.205 -0.934 . . . . 0.0 109.833 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.62 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -59.08 -38.43 79.44 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.09 -1.007 . . . . 0.0 109.834 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -59.74 -38.58 82.12 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.146 -0.971 . . . . 0.0 110.207 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 58.7 mttt -87.13 -42.14 13.25 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.071 -1.018 . . . . 0.0 109.96 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 21.6 mmtt -63.03 -25.82 68.56 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.27 -0.894 . . . . 0.0 111.178 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.75 33.51 9.07 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.62 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 7.8 t -145.99 -160.84 1.2 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.084 -1.245 . . . . 0.0 109.91 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -130.89 143.85 51.03 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.079 -1.013 . . . . 0.0 109.967 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 12.3 p -124.85 160.28 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.206 -0.934 . . . . 0.0 110.722 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 43.8 t -165.5 87.97 0.41 Allowed 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.365 -0.834 . . . . 0.0 110.6 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.767 ' CG ' HD12 ' A' ' 121' ' ' ILE . 60.5 t80 -100.41 161.1 13.82 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.23 -0.919 . . . . 0.0 110.999 -179.19 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -139.29 -60.96 0.56 Allowed 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -134.68 150.52 50.64 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.359 -0.838 . . . . 0.0 108.952 178.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . 0.437 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.5 p -90.79 152.71 20.68 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.056 -1.027 . . . . 0.0 111.237 -179.528 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.8 m -70.9 -26.5 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 C-N-CA 119.736 -0.786 . . . . 0.0 111.298 -179.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -50.38 -58.83 4.8 Favored 'General case' 0 N--CA 1.515 2.818 0 O-C-N 120.9 -1.125 . . . . 0.0 110.221 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 22.9 p -128.3 -166.73 1.67 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.248 -0.908 . . . . 0.0 110.451 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -99.95 60.92 0.71 Allowed Glycine 0 N--CA 1.493 2.44 0 N-CA-C 108.076 -2.01 . . . . 0.0 108.076 178.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 17.4 t -98.72 145.44 26.9 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.315 -1.109 . . . . 0.0 109.902 -179.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 32.4 mtt-85 -98.62 49.93 0.98 Allowed 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.236 -0.915 . . . . 0.0 109.444 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 68.18 97.39 0.04 OUTLIER Glycine 0 N--CA 1.488 2.141 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 22.4 p -109.94 129.08 55.71 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.163 -1.198 . . . . 0.0 110.508 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . 0.465 ' HB1' ' HD3' ' A' ' 125' ' ' PRO . . . -151.0 140.17 21.2 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.187 -0.946 . . . . 0.0 110.179 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.493 1.706 0 O-C-N 121.211 -0.931 . . . . 0.0 110.277 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.749 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.503 2.201 0 CA-C-O 120.432 0.158 . . . . 0.0 110.721 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -72.6 165.21 33.38 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 O-C-N 123.287 1.151 . . . . 0.0 110.612 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -48.47 -32.02 7.21 Favored 'General case' 0 N--CA 1.515 2.776 0 O-C-N 121.481 -0.762 . . . . 0.0 111.391 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.83 -34.84 51.82 Favored Glycine 0 N--CA 1.498 2.795 0 N-CA-C 110.449 -1.061 . . . . 0.0 110.449 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.489 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 28.9 t80 -54.77 -32.74 60.42 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 120.919 -1.341 . . . . 0.0 110.673 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -53.94 -37.66 64.12 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 121.015 -1.053 . . . . 0.0 110.276 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.0 mmpt? -58.31 -36.13 72.88 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.203 -0.935 . . . . 0.0 110.275 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.678 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.7 pt -117.06 36.26 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.181 -0.95 . . . . 0.0 110.547 179.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.422 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.5 OUTLIER -83.22 -44.68 0.85 Allowed Pre-proline 0 N--CA 1.509 2.514 0 O-C-N 121.075 -1.016 . . . . 0.0 113.065 -179.178 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.422 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.1 Cg_endo -75.64 -35.87 2.48 Favored 'Trans proline' 0 N--CA 1.485 1.027 0 O-C-N 122.655 0.819 . . . . 0.0 111.757 -178.138 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.784 HG21 ' CE2' ' A' ' 62' ' ' TYR . 60.7 m -60.35 -43.64 96.31 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 120.933 -1.104 . . . . 0.0 110.014 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.728 HD13 ' HE2' ' A' ' 86' ' ' TYR . 4.2 mt -65.49 -41.03 93.73 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 119.45 -0.9 . . . . 0.0 109.419 179.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -57.56 -34.15 68.88 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.164 -0.96 . . . . 0.0 110.192 179.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -57.0 -37.21 71.34 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.106 -0.996 . . . . 0.0 110.316 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.595 ' CD2' HD22 ' A' ' 55' ' ' LEU . 13.3 m-85 -58.76 -38.69 79.03 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.136 -0.977 . . . . 0.0 110.476 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -59.56 -39.7 84.92 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.164 -0.96 . . . . 0.0 110.437 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.412 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.0 mp -64.99 -40.22 88.35 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 C-N-CA 119.227 -0.989 . . . . 0.0 108.958 179.549 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -69.01 -50.41 49.1 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.122 -0.986 . . . . 0.0 108.887 178.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.756 HD11 HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -60.94 -35.54 77.0 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.119 -0.988 . . . . 0.0 109.278 178.535 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.44 -39.36 70.2 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 121.087 -1.008 . . . . 0.0 109.911 179.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.41 -41.75 88.8 Favored 'General case' 0 N--CA 1.507 2.376 0 C-N-CA 119.206 -0.998 . . . . 0.0 109.395 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.48 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -70.84 -41.92 70.85 Favored 'General case' 0 N--CA 1.504 2.229 0 C-N-CA 119.228 -0.989 . . . . 0.0 109.073 179.068 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -60.4 -34.44 73.92 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.285 -0.885 . . . . 0.0 109.963 179.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.8 mmmt -80.08 -29.69 39.16 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.0 -1.062 . . . . 0.0 110.965 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.513 2.721 0 O-C-N 120.808 -1.183 . . . . 0.0 110.266 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.499 1.99 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.401 ' OD1' ' CZ2' ' A' ' 50' ' ' TRP . 1.5 t-20 -62.69 -39.65 94.65 Favored 'General case' 0 N--CA 1.506 2.345 0 C-N-CA 119.446 -0.902 . . . . 0.0 109.338 179.173 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -65.75 -40.15 91.79 Favored 'General case' 0 N--CA 1.507 2.39 0 C-N-CA 119.473 -0.891 . . . . 0.0 109.566 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.411 ' CG ' ' HA ' ' A' ' 33' ' ' ALA . 49.4 tp60 -63.31 -40.86 98.51 Favored 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 119.413 -0.915 . . . . 0.0 109.664 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.556 HD23 HD12 ' A' ' 52' ' ' ILE . 12.4 mt -59.54 -39.28 83.46 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.13 -0.981 . . . . 0.0 109.72 179.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.509 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.1 m0 -58.01 -36.23 72.39 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.202 -0.936 . . . . 0.0 109.842 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -62.41 -29.89 70.82 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.054 -1.028 . . . . 0.0 109.672 178.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.756 HG23 HD11 ' A' ' 30' ' ' LEU . 46.4 mt -70.55 -59.07 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 120.953 -1.092 . . . . 0.0 109.089 179.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.3 ptm -60.37 -29.82 69.17 Favored 'General case' 0 N--CA 1.51 2.546 0 C-N-CA 118.46 -1.296 . . . . 0.0 109.754 178.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -68.01 -37.41 81.4 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 120.885 -1.134 . . . . 0.0 109.263 178.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.755 HD12 HD12 ' A' ' 30' ' ' LEU . 11.9 mt -53.05 -32.19 45.54 Favored 'General case' 0 N--CA 1.513 2.688 0 O-C-N 120.962 -1.086 . . . . 0.0 110.304 179.055 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.443 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 5.0 t60 -56.1 -36.77 68.55 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.057 -1.027 . . . . 0.0 110.113 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.482 ' NE2' HD21 ' A' ' 91' ' ' LEU . 5.5 m170 -60.48 -49.49 77.34 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.1 -1.0 . . . . 0.0 109.508 179.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -58.24 -37.42 74.87 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.3 -0.875 . . . . 0.0 109.679 179.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.426 HH12 HD13 ' A' ' 30' ' ' LEU . 7.3 mtt180 -63.07 -48.77 77.23 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.172 -0.955 . . . . 0.0 109.482 179.247 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.7 p -60.74 -40.37 92.14 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.172 -0.955 . . . . 0.0 109.564 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.407 ' O ' ' OG1' ' A' ' 65' ' ' THR . 4.1 tpt85 -62.6 -40.99 98.68 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 119.343 -0.943 . . . . 0.0 109.319 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.784 ' CE2' HG21 ' A' ' 22' ' ' THR . 45.3 t80 -62.95 -50.23 71.63 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.276 -0.89 . . . . 0.0 109.512 179.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.833 HD12 ' HB2' ' A' ' 87' ' ' ALA . 79.7 mt -70.28 -36.78 68.78 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 C-N-CA 119.3 -0.96 . . . . 0.0 109.453 179.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.447 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 9.5 t80 -67.8 -42.12 82.09 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.068 -1.02 . . . . 0.0 108.891 178.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.407 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 90.1 m -60.92 -40.83 94.68 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.175 -0.953 . . . . 0.0 110.097 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.626 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.8 pp -83.2 -36.49 24.62 Favored 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 118.99 -1.084 . . . . 0.0 112.465 -179.126 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.612 ' N ' HD12 ' A' ' 66' ' ' LEU . 50.0 t80 -86.65 -35.12 19.54 Favored 'General case' 0 N--CA 1.513 2.693 0 O-C-N 120.63 -1.294 . . . . 0.0 111.858 -179.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.447 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 6.6 m-85 -98.32 -3.42 37.21 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.903 -1.123 . . . . 0.0 113.25 -178.5 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.87 -58.93 0.61 Allowed 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.374 -1.454 . . . . 0.0 110.749 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.413 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -62.57 -29.44 70.59 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.063 -1.023 . . . . 0.0 110.654 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.1 tttt 59.87 44.41 13.75 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.768 -1.207 . . . . 0.0 109.985 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -117.38 37.61 3.83 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.342 -0.849 . . . . 0.0 109.888 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.762 HG13 HD23 ' A' ' 77' ' ' LEU . 14.9 tt -157.35 162.69 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.227 -0.921 . . . . 0.0 110.411 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.8 p -110.31 149.0 30.82 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.119 -0.988 . . . . 0.0 110.104 179.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.3 tttt -46.34 -31.92 2.87 Favored 'General case' 0 N--CA 1.515 2.791 0 O-C-N 121.269 -0.895 . . . . 0.0 111.722 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -62.86 -51.91 65.17 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 120.964 -1.085 . . . . 0.0 109.423 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.762 HD23 HG13 ' A' ' 73' ' ' ILE . 31.4 tp -65.04 -43.02 93.72 Favored 'General case' 0 N--CA 1.507 2.38 0 C-N-CA 119.145 -1.022 . . . . 0.0 108.816 178.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.639 ' HA ' HD12 ' A' ' 81' ' ' LEU . 16.9 t80 -62.53 -40.48 96.94 Favored 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 119.53 -0.868 . . . . 0.0 109.235 179.182 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -70.25 -42.05 72.7 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.168 -0.957 . . . . 0.0 108.849 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.749 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 81.1 t90 -57.06 -35.51 69.43 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.262 -0.899 . . . . 0.0 109.876 179.062 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.639 HD12 ' HA ' ' A' ' 78' ' ' TYR . 12.4 mt -69.9 -48.23 59.44 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.079 -1.013 . . . . 0.0 108.971 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.9 mm -57.47 -31.66 39.45 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.609 0 O-C-N 121.312 -0.868 . . . . 0.0 110.053 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 6.9 tttp -89.28 -15.87 32.52 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.938 -1.101 . . . . 0.0 112.136 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.444 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 18.9 mm-40 -106.33 22.26 16.06 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 120.529 -1.357 . . . . 0.0 112.098 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 19.4 tptt 74.24 75.77 0.12 Allowed 'General case' 0 N--CA 1.512 2.667 0 O-C-N 121.038 -1.039 . . . . 0.0 111.742 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.728 ' HE2' HD13 ' A' ' 23' ' ' LEU . 33.0 m-85 -135.42 -63.04 0.69 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.558 -0.714 . . . . 0.0 109.306 179.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.833 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -125.48 -172.99 2.72 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.485 -0.76 . . . . 0.0 109.198 179.165 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.443 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 8.4 t0 -131.24 102.91 6.19 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.057 -1.027 . . . . 0.0 110.524 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -59.41 -39.18 82.62 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.195 -0.941 . . . . 0.0 109.799 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 19.7 tp -59.5 -40.26 86.49 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.127 -0.983 . . . . 0.0 109.772 179.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.636 HD11 HD11 ' A' ' 103' ' ' LEU . 59.5 tp -71.05 -46.77 61.38 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.173 -0.954 . . . . 0.0 108.552 179.001 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 62.8 mt -60.24 -33.52 53.93 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.344 0 C-N-CA 119.406 -0.918 . . . . 0.0 109.047 178.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.67 -46.36 72.56 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.043 -1.035 . . . . 0.0 109.292 178.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.49 ' HD3' HD23 ' A' ' 106' ' ' LEU . 12.2 mttp -57.48 -40.81 79.39 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.092 -1.005 . . . . 0.0 110.146 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 3.0 m0 -60.77 -26.85 67.55 Favored 'General case' 0 N--CA 1.508 2.468 0 C-N-CA 119.188 -1.005 . . . . 0.0 110.668 179.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.56 -35.8 22.55 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 120.796 -1.19 . . . . 0.0 110.448 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -52.23 178.86 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.76 0 O-C-N 121.022 -1.049 . . . . 0.0 110.764 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -103.4 138.2 40.47 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.259 -0.9 . . . . 0.0 109.22 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 102.85 -27.49 19.98 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 109.948 -1.261 . . . . 0.0 109.948 -178.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.6 ' HB3' HD23 ' A' ' 103' ' ' LEU . 73.3 m-85 -92.32 58.78 3.31 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.885 -1.362 . . . . 0.0 109.808 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -85.56 -35.0 21.34 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.068 -1.02 . . . . 0.0 110.475 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.412 ' HB2' ' OG ' ' A' ' 155' ' ' SER . 0.0 OUTLIER -117.49 62.34 0.74 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.987 -1.071 . . . . 0.0 110.586 -179.827 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.636 HD11 HD11 ' A' ' 91' ' ' LEU . 0.9 OUTLIER -107.29 152.33 24.27 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.003 -1.06 . . . . 0.0 109.847 179.506 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.446 ' N ' HD12 ' A' ' 103' ' ' LEU . 26.8 p -113.75 -29.33 7.13 Favored 'General case' 0 N--CA 1.501 2.121 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -179.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.659 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.8 m -143.87 -168.12 2.77 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 120.109 -1.619 . . . . 0.0 110.019 179.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.512 HD21 ' HA ' ' A' ' 91' ' ' LEU . 16.7 mt -96.35 -38.87 9.89 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.218 -0.926 . . . . 0.0 110.128 179.02 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -102.1 30.3 4.56 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 120.999 -1.063 . . . . 0.0 109.866 178.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.659 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.7 t -127.37 17.18 7.08 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.043 -1.035 . . . . 0.0 108.833 -179.545 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.469 HG23 ' O ' ' A' ' 108' ' ' CYS . 1.1 pt -158.99 38.91 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 O-C-N 120.957 -1.09 . . . . 0.0 110.24 -178.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.752 ' C ' HG23 ' A' ' 119' ' ' THR . 7.3 tt0 . . . . . 0 N--CA 1.503 2.22 0 O-C-N 120.868 -1.145 . . . . 0.0 111.201 -178.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.752 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.1 m . . . . . 0 N--CA 1.494 1.741 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.438 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 49.6 t -103.87 154.93 19.05 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.26 -0.9 . . . . 0.0 109.207 178.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.967 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -75.34 -30.7 22.89 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 O-C-N 121.158 -0.964 . . . . 0.0 111.62 -179.033 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.484 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.3 p -58.58 -35.72 72.85 Favored 'General case' 0 N--CA 1.511 2.608 0 O-C-N 120.705 -1.247 . . . . 0.0 110.765 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.06 -33.24 64.81 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 120.937 -1.102 . . . . 0.0 109.964 178.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 58.3 t -81.29 124.28 80.78 Favored Pre-proline 0 N--CA 1.504 2.228 0 O-C-N 121.16 -0.963 . . . . 0.0 109.863 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -66.73 173.48 7.95 Favored 'Trans proline' 0 N--CA 1.488 1.163 0 O-C-N 123.187 1.098 . . . . 0.0 110.874 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.9 tpp85 -75.19 -37.66 61.1 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.292 -0.88 . . . . 0.0 110.421 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.89 -40.96 81.57 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.004 -1.06 . . . . 0.0 110.039 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -69.41 -41.8 75.91 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 119.312 -0.955 . . . . 0.0 109.249 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.604 ' O ' HG11 ' A' ' 140' ' ' VAL . 21.1 mt -65.39 -38.6 90.49 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.215 -0.928 . . . . 0.0 109.558 179.083 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -60.99 -39.88 91.34 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.132 -0.98 . . . . 0.0 109.877 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -60.37 -39.62 87.86 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.147 -0.97 . . . . 0.0 110.082 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -60.85 -41.01 95.0 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.244 -0.91 . . . . 0.0 109.941 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.3 -41.88 94.35 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.15 -0.969 . . . . 0.0 110.06 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 20.8 ttt85 -58.97 -38.44 79.09 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.088 -1.007 . . . . 0.0 109.908 179.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -57.87 -35.99 71.73 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.12 -0.987 . . . . 0.0 110.549 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -106.55 18.5 21.84 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.022 -1.049 . . . . 0.0 111.987 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 56.2 44.61 88.94 Favored Glycine 0 N--CA 1.497 2.729 0 O-C-N 120.612 -1.305 . . . . 0.0 110.327 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.7 t -133.75 -163.31 1.34 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.188 -1.184 . . . . 0.0 109.948 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 10.2 mp0 -139.64 144.43 37.66 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.155 -0.965 . . . . 0.0 110.344 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.604 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.6 p -132.1 161.4 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.284 -0.885 . . . . 0.0 110.018 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 38.4 t -166.78 100.07 0.56 Allowed 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.231 -0.918 . . . . 0.0 111.104 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.967 ' CD1' HD12 ' A' ' 121' ' ' ILE . 77.1 t80 -102.58 160.08 14.88 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.336 -0.852 . . . . 0.0 110.639 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 58.7 m-70 -137.83 -61.63 0.62 Allowed 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 178.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.56 150.75 44.07 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.536 -0.727 . . . . 0.0 109.278 178.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . 0.422 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.4 p -93.56 154.82 17.66 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.016 -1.053 . . . . 0.0 110.986 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.7 p -73.62 -25.14 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.569 0 O-C-N 121.334 -0.854 . . . . 0.0 111.598 -179.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -49.44 -59.06 4.07 Favored 'General case' 0 N--CA 1.517 2.879 0 O-C-N 120.873 -1.142 . . . . 0.0 110.167 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.509 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.9 p -127.65 -164.39 1.36 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.192 -0.942 . . . . 0.0 110.369 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . 0.426 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.93 63.38 0.56 Allowed Glycine 0 N--CA 1.492 2.381 0 N-CA-C 107.936 -2.066 . . . . 0.0 107.936 178.422 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 32.8 t -101.83 142.18 33.54 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.332 -1.099 . . . . 0.0 109.797 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 9.3 ttt85 -100.0 46.32 0.96 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.262 -0.899 . . . . 0.0 109.638 179.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 76.38 96.16 0.17 Allowed Glycine 0 N--CA 1.486 2.011 0 N-CA-C 109.883 -1.287 . . . . 0.0 109.883 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.4 p -108.25 126.01 52.33 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.333 -1.098 . . . . 0.0 110.161 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -146.65 148.93 32.57 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.153 -0.967 . . . . 0.0 110.308 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . 0.412 ' OG ' ' HB2' ' A' ' 102' ' ' LYS . 1.5 m . . . . . 0 N--CA 1.496 1.842 0 O-C-N 121.291 -0.88 . . . . 0.0 110.695 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.724 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.504 2.233 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.407 ' HG2' HD13 ' A' ' 77' ' ' LEU . 44.1 Cg_endo -70.14 162.83 40.82 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.411 1.216 . . . . 0.0 110.919 -179.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -47.62 -32.34 5.45 Favored 'General case' 0 N--CA 1.515 2.796 0 O-C-N 121.431 -0.793 . . . . 0.0 111.596 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.99 -34.73 39.11 Favored Glycine 0 N--CA 1.5 2.918 0 O-C-N 121.039 -1.038 . . . . 0.0 110.514 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.7 t80 -55.84 -32.29 63.47 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.061 -1.258 . . . . 0.0 110.695 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -54.32 -38.65 66.24 Favored 'General case' 0 N--CA 1.513 2.71 0 O-C-N 120.913 -1.117 . . . . 0.0 110.147 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.22 -36.14 72.73 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.209 -0.932 . . . . 0.0 110.164 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.641 ' O ' HD12 ' A' ' 23' ' ' LEU . 3.0 pt -115.34 36.12 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 O-C-N 121.204 -0.935 . . . . 0.0 110.373 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.434 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.3 OUTLIER -84.06 -43.41 0.77 Allowed Pre-proline 0 N--CA 1.509 2.519 0 O-C-N 121.073 -1.017 . . . . 0.0 113.217 -179.187 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.434 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.2 Cg_endo -75.58 -36.39 2.25 Favored 'Trans proline' 0 N--CA 1.486 1.083 0 O-C-N 122.62 0.8 . . . . 0.0 111.634 -178.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.872 HG21 ' CE2' ' A' ' 62' ' ' TYR . 85.5 m -61.54 -46.65 89.04 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 120.938 -1.101 . . . . 0.0 109.756 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.692 HD13 ' HE2' ' A' ' 86' ' ' TYR . 4.9 mt -61.81 -39.22 90.99 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.48 -0.888 . . . . 0.0 109.632 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.421 ' O ' HD12 ' A' ' 28' ' ' ILE . 6.5 m -57.2 -35.7 69.95 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.137 -0.977 . . . . 0.0 110.295 179.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -57.63 -37.95 74.18 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.068 -1.02 . . . . 0.0 110.248 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.608 ' CD2' HD22 ' A' ' 55' ' ' LEU . 14.2 m-85 -59.0 -38.53 79.43 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.126 -0.984 . . . . 0.0 110.391 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -58.31 -39.36 79.17 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.175 -0.953 . . . . 0.0 110.309 -179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.437 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.4 mp -67.97 -41.19 84.41 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.279 0 C-N-CA 119.225 -0.99 . . . . 0.0 108.734 179.284 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.424 ' HB3' HD11 ' A' ' 55' ' ' LEU . 0.5 OUTLIER -66.74 -49.03 67.3 Favored 'General case' 0 N--CA 1.506 2.329 0 C-N-CA 119.177 -1.009 . . . . 0.0 108.341 178.565 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.085 HD11 HG23 ' A' ' 52' ' ' ILE . 4.3 tp -63.1 -36.21 82.82 Favored 'General case' 0 N--CA 1.508 2.434 0 C-N-CA 119.39 -0.924 . . . . 0.0 108.921 178.289 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.7 -38.03 74.51 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.117 -0.989 . . . . 0.0 110.298 179.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -64.56 -50.55 66.85 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.094 -1.004 . . . . 0.0 109.728 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.482 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -70.78 -36.57 73.12 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 119.202 -0.999 . . . . 0.0 109.48 179.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -72.2 -30.83 65.33 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.127 -0.983 . . . . 0.0 110.281 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.8 mmtt -95.11 -32.72 12.96 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 120.952 -1.093 . . . . 0.0 111.12 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.6 t0 . . . . . 0 N--CA 1.508 2.439 0 O-C-N 121.02 -1.05 . . . . 0.0 109.994 -179.955 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.496 1.831 0 N-CA-C 110.07 -0.345 . . . . 0.0 110.07 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.406 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 15.4 m120 -58.4 -41.79 85.71 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.235 -0.916 . . . . 0.0 109.624 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -62.25 -37.4 85.29 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.297 -0.877 . . . . 0.0 109.988 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -66.04 -43.2 88.21 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.12 -0.988 . . . . 0.0 109.558 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.422 HD23 ' HA ' ' A' ' 49' ' ' LEU . 43.6 mt -64.47 -34.01 77.21 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.258 -0.901 . . . . 0.0 110.321 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.498 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 46.9 m0 -57.76 -40.73 80.45 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 120.929 -1.107 . . . . 0.0 109.724 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -59.73 -35.05 73.77 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.359 -0.937 . . . . 0.0 109.957 179.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 1.085 HG23 HD11 ' A' ' 30' ' ' LEU . 18.3 mt -72.04 -57.24 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.161 0 O-C-N 121.046 -1.034 . . . . 0.0 109.121 179.229 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 ptm -61.58 -26.9 68.26 Favored 'General case' 0 N--CA 1.507 2.421 0 C-N-CA 118.53 -1.268 . . . . 0.0 110.06 178.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -73.49 -39.78 64.6 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 120.723 -1.235 . . . . 0.0 108.708 177.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.608 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.0 mt -53.38 -30.5 40.16 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.087 -1.008 . . . . 0.0 110.303 178.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.48 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 15.9 t60 -57.73 -39.92 78.42 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.943 -1.098 . . . . 0.0 110.111 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.413 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 6.8 m170 -60.51 -46.95 88.25 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.172 -0.955 . . . . 0.0 109.442 179.23 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -61.17 -37.38 82.72 Favored 'General case' 0 N--CA 1.505 2.3 0 C-N-CA 119.463 -0.895 . . . . 0.0 109.57 179.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.447 ' HD3' ' CD1' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -67.16 -48.35 68.25 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.097 -1.002 . . . . 0.0 109.31 179.176 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.2 p -61.68 -38.46 87.87 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.185 -0.947 . . . . 0.0 109.383 179.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -37.71 88.5 Favored 'General case' 0 N--CA 1.507 2.401 0 C-N-CA 119.261 -0.975 . . . . 0.0 109.464 179.176 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.872 ' CE2' HG21 ' A' ' 22' ' ' THR . 42.2 t80 -61.1 -48.69 80.49 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.118 -0.989 . . . . 0.0 109.454 179.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.515 HD12 ' HB2' ' A' ' 87' ' ' ALA . 84.0 mt -76.25 -43.25 37.21 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 O-C-N 121.189 -0.944 . . . . 0.0 108.854 179.09 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.437 ' CE1' HG23 ' A' ' 92' ' ' ILE . 40.7 t80 -59.75 -24.94 64.46 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.408 -0.808 . . . . 0.0 110.39 178.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.417 HG23 ' HD3' ' A' ' 69' ' ' LYS . 85.5 m -88.35 -34.99 17.42 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.692 -1.255 . . . . 0.0 110.441 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.566 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.6 pp -82.88 -32.95 27.11 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 120.806 -1.184 . . . . 0.0 112.025 -179.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.506 ' N ' HD12 ' A' ' 66' ' ' LEU . 33.3 t80 -86.45 -37.16 18.59 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 120.714 -1.241 . . . . 0.0 111.835 -179.317 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.404 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 16.8 m-85 -93.22 -19.58 21.29 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 120.897 -1.127 . . . . 0.0 113.086 -178.116 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.417 ' HD3' HG23 ' A' ' 65' ' ' THR . 15.5 mtpt -116.54 -58.6 2.07 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.518 -1.364 . . . . 0.0 110.97 -179.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.406 ' HB2' ' HA ' ' A' ' 66' ' ' LEU . 0.8 OUTLIER -68.67 -29.21 67.63 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.082 -1.011 . . . . 0.0 110.873 -179.54 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.6 tttt 58.53 42.84 20.22 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.796 -1.19 . . . . 0.0 109.957 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.72 34.32 4.05 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.447 -0.783 . . . . 0.0 109.949 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.781 HG13 HD23 ' A' ' 77' ' ' LEU . 14.1 tt -153.41 162.41 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.156 -0.965 . . . . 0.0 109.728 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 49.7 m -107.93 148.35 29.76 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.056 -1.027 . . . . 0.0 110.406 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.0 ttmm -46.81 -32.34 3.63 Favored 'General case' 0 N--CA 1.514 2.763 0 O-C-N 121.262 -0.898 . . . . 0.0 111.417 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -62.27 -51.15 68.86 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 120.976 -1.078 . . . . 0.0 109.29 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.781 HD23 HG13 ' A' ' 73' ' ' ILE . 35.0 tp -65.94 -43.84 86.85 Favored 'General case' 0 N--CA 1.506 2.351 0 C-N-CA 119.202 -0.999 . . . . 0.0 108.528 178.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.418 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 19.3 t80 -60.73 -39.94 90.53 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.279 -0.888 . . . . 0.0 109.335 179.1 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -71.62 -42.22 67.91 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.11 -0.994 . . . . 0.0 108.823 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.724 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 81.7 t90 -56.76 -36.99 70.44 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 121.301 -0.874 . . . . 0.0 109.687 179.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.701 HD22 ' CD2' ' A' ' 86' ' ' TYR . 51.9 mt -68.85 -47.28 66.36 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.22 -0.925 . . . . 0.0 109.122 179.156 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 37.0 mm -57.77 -33.3 45.02 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.535 0 O-C-N 121.258 -0.901 . . . . 0.0 110.032 179.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.6 tmtt? -89.32 -11.77 42.47 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.965 -1.084 . . . . 0.0 112.48 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.449 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 71.5 mm-40 -108.52 22.68 15.6 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 120.475 -1.39 . . . . 0.0 112.206 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 15.8 tttt 74.96 73.99 0.1 Allowed 'General case' 0 N--CA 1.512 2.672 0 O-C-N 121.102 -0.998 . . . . 0.0 111.799 179.113 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.701 ' CD2' HD22 ' A' ' 81' ' ' LEU . 34.1 m-85 -134.54 -62.51 0.74 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.449 -0.782 . . . . 0.0 109.196 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.515 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -132.59 160.85 35.42 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.402 -0.811 . . . . 0.0 109.257 179.038 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.48 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.4 t70 -105.65 119.1 38.27 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.047 -1.033 . . . . 0.0 110.421 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.1 mmtt -60.87 -38.08 84.36 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 119.478 -0.889 . . . . 0.0 109.825 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.467 HD12 ' HA ' ' A' ' 90' ' ' LEU . 8.3 tp -60.29 -37.93 82.02 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.096 -1.003 . . . . 0.0 109.707 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.684 HD12 ' CZ3' ' A' ' 95' ' ' TRP . 0.2 OUTLIER -65.81 -55.82 15.15 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.096 -1.003 . . . . 0.0 108.895 179.21 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.437 HG23 ' CE1' ' A' ' 64' ' ' TYR . 39.6 mt -61.75 -36.02 71.11 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.475 0 C-N-CA 119.342 -0.943 . . . . 0.0 108.888 178.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.92 -39.95 91.02 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.09 -1.006 . . . . 0.0 109.354 178.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.427 ' HD2' ' CE1' ' A' ' 100' ' ' TYR . 10.8 mmtm -58.68 -44.25 90.2 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 121.154 -0.966 . . . . 0.0 109.501 179.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.684 ' CZ3' HD12 ' A' ' 91' ' ' LEU . 2.6 m0 -62.58 -34.97 78.04 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.192 -0.942 . . . . 0.0 110.153 179.378 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.41 ' NH1' ' OH ' ' A' ' 64' ' ' TYR . 0.3 OUTLIER -81.25 -31.9 33.54 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.02 -1.05 . . . . 0.0 110.79 179.757 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 23.6 mmtt -53.91 -176.73 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.711 0 O-C-N 120.899 -1.126 . . . . 0.0 110.582 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -103.38 134.52 46.62 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.241 -0.912 . . . . 0.0 109.808 179.201 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.42 14.2 45.36 Favored Glycine 0 N--CA 1.493 2.494 0 C-N-CA 120.2 -1.0 . . . . 0.0 110.863 -179.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.526 ' HB3' HD23 ' A' ' 103' ' ' LEU . 51.3 m-85 -123.03 72.49 1.1 Allowed 'General case' 0 N--CA 1.493 1.676 0 CA-C-N 119.43 1.615 . . . . 0.0 109.983 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.12 -36.46 12.65 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.159 -0.963 . . . . 0.0 110.468 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.77 77.21 1.74 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.006 -1.059 . . . . 0.0 110.565 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.526 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.0 OUTLIER -120.85 150.54 40.88 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.036 -1.04 . . . . 0.0 110.059 179.632 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.413 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.7 p -111.91 -32.59 6.55 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.173 -0.954 . . . . 0.0 112.98 -179.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.628 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.0 m -142.05 -168.5 2.71 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.204 -1.56 . . . . 0.0 110.156 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 62.1 mt -96.73 -38.46 9.9 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.252 -0.905 . . . . 0.0 110.122 178.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 22.9 ttt-85 -101.27 28.9 5.05 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 120.952 -1.093 . . . . 0.0 109.943 178.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.628 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.308 1.8 t -127.05 17.29 7.24 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.065 -1.022 . . . . 0.0 108.623 -179.801 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.47 HG23 ' C ' ' A' ' 108' ' ' CYS . 2.0 pt -156.35 34.38 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.062 0 O-C-N 120.806 -1.184 . . . . 0.0 111.05 -178.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.587 ' C ' HG23 ' A' ' 119' ' ' THR . 1.6 mt-30 . . . . . 0 N--CA 1.499 2.021 0 O-C-N 120.711 -1.243 . . . . 0.0 111.147 -178.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.587 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.2 OUTLIER . . . . . 0 N--CA 1.501 2.113 0 CA-C-O 120.716 0.293 . . . . 0.0 110.373 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 42.7 t -86.9 153.58 21.5 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.12 -0.988 . . . . 0.0 108.661 178.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.948 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -72.5 -30.89 35.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.378 0 O-C-N 121.079 -1.013 . . . . 0.0 111.627 -178.695 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.49 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.8 p -60.0 -35.73 75.67 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 120.593 -1.317 . . . . 0.0 110.396 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 7.0 ttt-85 -57.2 -32.85 66.91 Favored 'General case' 0 N--CA 1.512 2.626 0 O-C-N 121.077 -1.014 . . . . 0.0 109.925 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 61.9 t -79.99 124.4 83.07 Favored Pre-proline 0 N--CA 1.506 2.333 0 O-C-N 121.056 -1.028 . . . . 0.0 109.913 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -67.56 -179.73 2.12 Favored 'Trans proline' 0 N--CA 1.488 1.153 0 O-C-N 123.112 1.059 . . . . 0.0 110.87 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.19 -37.85 61.02 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.22 -0.925 . . . . 0.0 110.419 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.97 -40.83 81.57 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.025 -1.047 . . . . 0.0 110.092 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 22.7 tp60 -69.19 -41.54 77.01 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.339 -0.944 . . . . 0.0 109.238 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.608 HD11 HD11 ' A' ' 121' ' ' ILE . 9.4 mt -66.01 -38.73 89.19 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 121.21 -0.931 . . . . 0.0 109.517 179.023 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -60.61 -38.81 85.93 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.184 -0.947 . . . . 0.0 109.907 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -58.76 -37.9 77.27 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.141 -0.974 . . . . 0.0 110.382 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -64.35 -40.47 95.93 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.094 -1.004 . . . . 0.0 110.098 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.404 ' HA ' HG23 ' A' ' 138' ' ' THR . . . -66.48 -41.33 89.13 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.067 -1.021 . . . . 0.0 109.675 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 11.3 mmp_? -63.89 -34.81 78.8 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.227 -0.921 . . . . 0.0 110.254 179.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 9.9 mmmt -74.41 -31.81 62.46 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 120.958 -1.089 . . . . 0.0 110.956 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 29.2 mttm -99.76 22.28 11.25 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 120.882 -1.136 . . . . 0.0 111.804 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.0 46.42 55.71 Favored Glycine 0 N--CA 1.499 2.884 0 O-C-N 120.607 -1.308 . . . . 0.0 110.743 179.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.404 HG23 ' HA ' ' A' ' 133' ' ' ALA . 9.7 t -145.68 -163.79 1.8 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.145 -1.209 . . . . 0.0 110.32 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 12.6 mt-30 -131.85 171.44 13.54 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.132 -0.98 . . . . 0.0 110.213 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.7 p -159.18 160.96 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.209 -0.932 . . . . 0.0 110.859 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 30.3 t -168.63 96.87 0.39 Allowed 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.319 -0.863 . . . . 0.0 110.924 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.948 ' CD1' HD12 ' A' ' 121' ' ' ILE . 73.4 t80 -97.16 159.6 14.82 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.202 -0.936 . . . . 0.0 110.518 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 17.7 m170 -138.3 -61.24 0.6 Allowed 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 178.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -139.48 151.13 45.94 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.526 -0.734 . . . . 0.0 109.264 178.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . 0.416 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.0 p -92.52 155.71 17.63 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.065 -1.022 . . . . 0.0 111.024 -179.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.4 p -74.78 -23.09 17.51 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.435 -0.79 . . . . 0.0 111.7 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -51.72 -57.24 9.8 Favored 'General case' 0 N--CA 1.514 2.751 0 O-C-N 120.81 -1.181 . . . . 0.0 110.002 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.498 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.2 p -128.91 -164.15 1.36 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.281 -0.887 . . . . 0.0 110.385 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -102.11 62.43 0.51 Allowed Glycine 0 N--CA 1.493 2.459 0 N-CA-C 107.81 -2.116 . . . . 0.0 107.81 178.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 21.6 t -99.54 146.01 26.88 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.32 -1.106 . . . . 0.0 109.792 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 11.1 mtt85 -100.92 44.14 1.03 Allowed 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.219 -0.926 . . . . 0.0 109.689 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 76.67 97.18 0.17 Allowed Glycine 0 N--CA 1.486 2.033 0 N-CA-C 109.846 -1.302 . . . . 0.0 109.846 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.4 p -110.39 125.78 53.58 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.344 -1.092 . . . . 0.0 110.202 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -142.16 137.34 30.8 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.13 -0.981 . . . . 0.0 109.949 -179.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.497 1.889 0 O-C-N 121.137 -0.977 . . . . 0.0 109.689 179.612 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.758 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.503 2.222 0 CA-C-O 120.459 0.171 . . . . 0.0 110.636 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.12 163.95 37.15 Favored 'Trans proline' 0 C--N 1.318 -1.059 0 O-C-N 123.307 1.162 . . . . 0.0 110.652 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -48.46 -32.23 7.48 Favored 'General case' 0 N--CA 1.515 2.801 0 O-C-N 121.483 -0.761 . . . . 0.0 111.375 -179.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.86 -34.12 50.84 Favored Glycine 0 N--CA 1.498 2.779 0 O-C-N 121.018 -1.051 . . . . 0.0 110.502 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.43 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 28.6 t80 -54.63 -32.55 59.16 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 120.999 -1.295 . . . . 0.0 110.76 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 -54.18 -37.9 65.0 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 121.006 -1.059 . . . . 0.0 110.18 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.0 mptt -58.63 -36.52 74.21 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.179 -0.951 . . . . 0.0 110.25 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.718 ' O ' HD12 ' A' ' 23' ' ' LEU . 3.3 pt -117.06 35.69 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.152 -0.968 . . . . 0.0 110.514 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.421 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 6.6 tmtt? -84.64 -43.21 0.71 Allowed Pre-proline 0 N--CA 1.508 2.451 0 O-C-N 121.093 -1.004 . . . . 0.0 113.265 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.421 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.8 Cg_endo -76.44 -38.01 1.17 Allowed 'Trans proline' 0 N--CA 1.487 1.134 0 O-C-N 122.603 0.791 . . . . 0.0 111.582 -178.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.781 HG21 ' CE2' ' A' ' 62' ' ' TYR . 86.0 m -59.73 -43.18 94.3 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 120.86 -1.15 . . . . 0.0 109.992 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.718 HD12 ' O ' ' A' ' 19' ' ' ILE . 1.6 mt -63.12 -37.98 89.35 Favored 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 119.487 -0.885 . . . . 0.0 109.772 179.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.439 ' O ' HD12 ' A' ' 28' ' ' ILE . 0.6 OUTLIER -57.6 -36.63 72.01 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.091 -1.005 . . . . 0.0 110.394 179.652 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -57.26 -37.38 72.25 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.091 -1.005 . . . . 0.0 110.256 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.752 ' CD2' HD22 ' A' ' 55' ' ' LEU . 13.3 m-85 -58.42 -38.98 78.54 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.091 -1.006 . . . . 0.0 110.556 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -60.84 -38.91 87.11 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.233 -0.917 . . . . 0.0 110.864 -179.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.439 HD12 ' O ' ' A' ' 24' ' ' THR . 3.2 mp -65.71 -39.23 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.415 0 C-N-CA 119.119 -1.032 . . . . 0.0 109.591 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.8 tt0 -72.16 -46.0 58.19 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.034 -1.041 . . . . 0.0 108.831 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.698 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -65.29 -33.76 76.75 Favored 'General case' 0 N--CA 1.508 2.44 0 C-N-CA 119.27 -0.972 . . . . 0.0 108.902 178.231 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -57.17 -39.51 75.46 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 120.994 -1.066 . . . . 0.0 110.011 179.349 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.83 -49.86 73.25 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.25 -0.98 . . . . 0.0 109.605 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.601 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -69.33 -39.39 78.23 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.18 -0.95 . . . . 0.0 109.352 179.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.642 ' HG3' HD23 ' A' ' 30' ' ' LEU . 10.8 mm-40 -69.73 -30.8 68.5 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.231 -0.918 . . . . 0.0 110.446 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -94.79 -31.24 13.84 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.85 -1.156 . . . . 0.0 111.261 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 . . . . . 0 N--CA 1.511 2.602 0 O-C-N 120.873 -1.142 . . . . 0.0 110.282 179.936 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.495 1.777 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -55.47 -38.41 69.06 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.202 -0.936 . . . . 0.0 109.821 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -58.0 -34.67 70.25 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.229 -0.919 . . . . 0.0 110.166 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -57.46 -41.02 79.77 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 120.948 -1.095 . . . . 0.0 109.953 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 93.4 mt -64.71 -38.62 91.6 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.254 -0.904 . . . . 0.0 109.885 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.502 ' O ' ' HE3' ' A' ' 53' ' ' MET . 39.9 m0 -58.18 -32.13 67.95 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.151 -0.968 . . . . 0.0 109.865 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -69.37 -33.33 72.9 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.643 -1.286 . . . . 0.0 109.624 178.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.698 HG23 ' CG ' ' A' ' 30' ' ' LEU . 68.4 mt -72.54 -51.1 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.298 0 O-C-N 120.904 -1.122 . . . . 0.0 109.39 179.305 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.502 ' HE3' ' O ' ' A' ' 50' ' ' TRP . 0.0 OUTLIER -61.02 -33.31 73.07 Favored 'General case' 0 N--CA 1.508 2.464 0 C-N-CA 118.799 -1.16 . . . . 0.0 109.648 179.07 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -62.48 -38.16 88.78 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.93 -1.106 . . . . 0.0 109.608 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.752 HD22 ' CD2' ' A' ' 26' ' ' PHE . 19.6 mt -53.79 -35.16 61.06 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.113 -0.992 . . . . 0.0 110.017 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.466 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 38.5 t60 -56.19 -38.81 71.47 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 120.98 -1.075 . . . . 0.0 109.881 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.428 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 10.4 m170 -61.42 -50.39 73.0 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.224 -0.923 . . . . 0.0 109.051 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -60.93 -38.7 86.72 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 119.468 -0.893 . . . . 0.0 109.271 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.415 ' HG3' ' CE2' ' A' ' 26' ' ' PHE . 5.2 mtt180 -62.23 -48.06 81.65 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.164 -0.96 . . . . 0.0 109.33 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 94.6 p -65.44 -39.09 91.65 Favored 'General case' 0 N--CA 1.503 2.204 0 C-N-CA 119.306 -0.958 . . . . 0.0 109.159 179.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 34.9 ttt85 -65.52 -39.82 92.24 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.111 -0.993 . . . . 0.0 109.134 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.781 ' CE2' HG21 ' A' ' 22' ' ' THR . 28.4 t80 -62.46 -50.41 71.59 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.119 -0.988 . . . . 0.0 109.344 179.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.563 HD12 ' HB2' ' A' ' 87' ' ' ALA . 91.6 mt -71.8 -39.49 68.15 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 O-C-N 121.221 -0.924 . . . . 0.0 109.255 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.454 ' HD2' HD13 ' A' ' 92' ' ' ILE . 13.5 t80 -65.15 -42.58 93.63 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.214 -0.929 . . . . 0.0 109.036 179.216 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 95.6 m -61.67 -41.45 97.57 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.134 -0.979 . . . . 0.0 110.389 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.554 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.17 -32.28 26.69 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 120.874 -1.141 . . . . 0.0 112.391 -178.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.451 ' N ' HD12 ' A' ' 66' ' ' LEU . 40.3 t80 -86.27 -32.24 21.22 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 120.755 -1.216 . . . . 0.0 111.714 -179.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -98.01 -19.42 18.02 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 120.806 -1.184 . . . . 0.0 112.487 -178.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.4 mttm -119.4 -58.5 1.91 Allowed 'General case' 0 N--CA 1.503 2.207 0 O-C-N 120.509 -1.369 . . . . 0.0 110.621 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 23.9 ttt-85 -65.14 -31.26 72.37 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.112 -0.992 . . . . 0.0 110.878 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.1 tptt 57.44 42.18 25.01 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.897 -1.127 . . . . 0.0 110.036 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.88 35.02 3.68 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.356 -0.84 . . . . 0.0 109.817 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.785 HG13 HD23 ' A' ' 77' ' ' LEU . 13.8 tt -154.14 162.53 2.0 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.235 -0.915 . . . . 0.0 109.84 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.1 t -108.85 147.44 32.11 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.13 -0.981 . . . . 0.0 110.299 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.7 ttmt -45.79 -31.96 2.31 Favored 'General case' 0 N--CA 1.516 2.837 0 O-C-N 121.289 -0.882 . . . . 0.0 111.604 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -62.35 -51.23 68.46 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 120.956 -1.09 . . . . 0.0 109.234 179.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.785 HD23 HG13 ' A' ' 73' ' ' ILE . 46.5 tp -66.25 -42.96 87.83 Favored 'General case' 0 N--CA 1.506 2.334 0 C-N-CA 119.274 -0.971 . . . . 0.0 108.52 178.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.547 ' HA ' HD12 ' A' ' 81' ' ' LEU . 17.0 t80 -61.41 -39.71 91.75 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 121.341 -0.849 . . . . 0.0 109.3 179.229 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -71.42 -42.45 68.27 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.059 -1.026 . . . . 0.0 108.724 178.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.758 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 80.9 t90 -56.34 -36.42 68.74 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.307 -0.871 . . . . 0.0 109.725 178.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.547 HD12 ' HA ' ' A' ' 78' ' ' TYR . 18.3 mt -69.04 -49.95 53.0 Favored 'General case' 0 N--CA 1.505 2.299 0 C-N-CA 119.393 -0.923 . . . . 0.0 108.916 179.029 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.1 mm -56.59 -32.86 38.28 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.584 0 O-C-N 121.202 -0.937 . . . . 0.0 109.954 179.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.9 mtpp -89.34 -14.89 34.64 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 120.877 -1.139 . . . . 0.0 112.208 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.441 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 5.6 mm-40 -105.73 22.36 15.68 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.593 -1.317 . . . . 0.0 112.069 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt 75.43 71.59 0.09 Allowed 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.041 -1.037 . . . . 0.0 111.916 179.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.636 ' HE2' HD13 ' A' ' 23' ' ' LEU . 32.6 m-85 -133.63 -62.77 0.77 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.488 -0.757 . . . . 0.0 108.977 179.272 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.563 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -134.03 163.02 30.48 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.451 -0.781 . . . . 0.0 109.202 179.215 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.466 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 16.4 t0 -112.19 111.53 22.49 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.088 -1.008 . . . . 0.0 110.482 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 28.0 mttt -57.94 -37.0 73.33 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.245 -0.909 . . . . 0.0 110.114 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.443 HD23 HD13 ' A' ' 106' ' ' LEU . 18.2 tp -57.88 -37.46 73.99 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.091 -1.006 . . . . 0.0 110.192 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.546 ' HA ' HD21 ' A' ' 106' ' ' LEU . 64.2 tp -72.79 -47.62 45.05 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.052 -1.03 . . . . 0.0 108.512 179.065 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.454 HD13 ' HD2' ' A' ' 64' ' ' TYR . 54.5 mt -60.55 -36.55 70.74 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.38 0 O-C-N 121.184 -0.947 . . . . 0.0 108.641 178.291 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.74 -39.27 84.23 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.086 -1.009 . . . . 0.0 109.275 178.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.408 ' HB3' ' CD2' ' A' ' 103' ' ' LEU . 8.7 mmtt -58.24 -42.65 86.82 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.062 -1.024 . . . . 0.0 109.434 179.344 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 6.9 m0 -68.29 -38.64 81.87 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.28 -0.888 . . . . 0.0 109.875 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.78 -31.94 67.13 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.225 -0.922 . . . . 0.0 110.476 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.0 mmtm -54.37 -176.56 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.671 0 O-C-N 120.927 -1.108 . . . . 0.0 110.498 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -104.76 134.24 48.24 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.184 -0.947 . . . . 0.0 109.823 179.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.69 10.19 55.64 Favored Glycine 0 N--CA 1.493 2.458 0 C-N-CA 120.19 -1.005 . . . . 0.0 111.129 -179.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -114.13 68.72 0.7 Allowed 'General case' 0 N--CA 1.495 1.808 0 CA-C-N 119.485 1.643 . . . . 0.0 110.044 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -90.22 -38.61 13.33 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.15 -0.969 . . . . 0.0 109.963 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.37 84.25 1.94 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.159 -0.963 . . . . 0.0 109.728 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.949 HD13 HD13 ' A' ' 109' ' ' ILE . 9.0 tp -125.86 137.13 53.73 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.373 -0.829 . . . . 0.0 109.881 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.428 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.6 p -111.37 -38.97 4.82 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.211 -0.931 . . . . 0.0 112.434 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.83 ' O ' HD11 ' A' ' 103' ' ' LEU . 5.9 m -138.75 -168.16 2.35 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 120.213 -1.554 . . . . 0.0 109.678 179.04 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.546 HD21 ' HA ' ' A' ' 91' ' ' LEU . 13.3 mt -97.99 -38.12 9.51 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 120.973 -1.079 . . . . 0.0 110.541 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 11.8 tpt85 -101.97 32.2 3.56 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 120.991 -1.068 . . . . 0.0 109.498 178.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.667 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.306 1.7 t -127.05 15.31 7.34 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.19 -0.944 . . . . 0.0 109.216 -179.289 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.949 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -158.26 36.91 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.333 0 O-C-N 120.842 -1.161 . . . . 0.0 110.658 -178.494 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.586 ' O ' HG23 ' A' ' 119' ' ' THR . 5.6 mm-40 . . . . . 0 N--CA 1.499 2.009 0 O-C-N 120.748 -1.22 . . . . 0.0 111.68 -178.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.586 HG23 ' O ' ' A' ' 110' ' ' GLN . 5.4 m . . . . . 0 N--CA 1.495 1.788 0 N-CA-C 110.316 -0.253 . . . . 0.0 110.316 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.441 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 45.8 t -82.44 154.02 25.37 Favored 'General case' 0 N--CA 1.5 2.067 0 C-N-CA 119.374 -0.93 . . . . 0.0 109.084 178.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.787 HD12 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -72.75 -37.16 54.68 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 O-C-N 121.082 -1.011 . . . . 0.0 110.796 -179.389 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.437 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 4.5 p -54.18 -32.74 56.36 Favored 'General case' 0 N--CA 1.512 2.671 0 O-C-N 120.727 -1.233 . . . . 0.0 111.021 -179.08 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.488 ' HG3' HG22 ' A' ' 109' ' ' ILE . 7.3 ttp85 -57.93 -34.06 69.46 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 120.909 -1.12 . . . . 0.0 109.641 178.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 62.0 t -81.42 125.09 79.68 Favored Pre-proline 0 N--CA 1.504 2.229 0 O-C-N 121.137 -0.977 . . . . 0.0 109.725 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.518 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.4 Cg_endo -65.77 172.87 7.61 Favored 'Trans proline' 0 N--CA 1.488 1.16 0 O-C-N 123.142 1.075 . . . . 0.0 110.772 179.604 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 2.0 tpt180 -75.07 -36.42 61.78 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.188 -0.945 . . . . 0.0 110.901 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.88 -44.01 91.06 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 120.943 -1.098 . . . . 0.0 109.985 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -65.27 -40.71 94.26 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.191 -0.943 . . . . 0.0 109.385 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.518 HD12 ' O ' ' A' ' 125' ' ' PRO . 1.4 mt -61.82 -40.85 96.7 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.199 -0.938 . . . . 0.0 109.757 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -58.18 -39.93 80.16 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.158 -0.964 . . . . 0.0 109.988 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -60.36 -36.8 78.86 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.19 -0.943 . . . . 0.0 110.056 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -62.75 -47.15 84.79 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.158 -0.964 . . . . 0.0 109.946 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.443 ' HA ' HG23 ' A' ' 138' ' ' THR . . . -63.29 -41.19 98.96 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.14 -0.975 . . . . 0.0 109.788 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 6.8 ttt85 -65.06 -32.59 74.38 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.226 -0.921 . . . . 0.0 110.378 179.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 31.7 mttt -81.78 -29.79 32.59 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 120.86 -1.15 . . . . 0.0 111.077 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 36.3 mttt -98.71 24.35 7.66 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 120.82 -1.175 . . . . 0.0 111.712 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.15 46.94 42.56 Favored Glycine 0 N--CA 1.5 2.951 0 O-C-N 120.772 -1.205 . . . . 0.0 111.119 179.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.443 HG23 ' HA ' ' A' ' 133' ' ' ALA . 9.3 t -148.35 -164.76 2.09 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.114 -1.227 . . . . 0.0 110.422 179.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . 0.408 ' HA ' ' HB1' ' A' ' 133' ' ' ALA . 58.6 mt-30 -132.65 159.57 39.22 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.185 -0.947 . . . . 0.0 110.283 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.8 p -147.34 161.01 8.3 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.227 -0.921 . . . . 0.0 110.24 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 25.5 t -170.57 83.51 0.1 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.188 -0.945 . . . . 0.0 111.167 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.787 ' CG ' HD12 ' A' ' 121' ' ' ILE . 52.0 t80 -95.02 159.07 15.19 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.139 -0.976 . . . . 0.0 110.263 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -135.81 -60.37 0.74 Allowed 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -138.71 151.9 47.54 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.401 -0.812 . . . . 0.0 109.518 179.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 26.5 p -93.6 156.1 16.92 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.157 -0.964 . . . . 0.0 110.891 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.8 p -74.55 -25.09 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 121.314 -0.866 . . . . 0.0 111.637 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 -50.88 -45.84 60.17 Favored 'General case' 0 N--CA 1.517 2.883 0 O-C-N 120.756 -1.215 . . . . 0.0 109.457 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.501 ' HB2' ' CE ' ' A' ' 53' ' ' MET . 29.1 p -143.43 177.52 8.39 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.348 -0.845 . . . . 0.0 110.537 179.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . 0.447 ' CA ' ' CE3' ' A' ' 50' ' ' TRP . . . -87.77 64.26 3.71 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 107.957 -2.057 . . . . 0.0 107.957 178.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 28.1 t -106.18 139.29 40.92 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.306 -1.114 . . . . 0.0 109.694 -179.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 31.1 mtt-85 -92.31 56.63 2.83 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.163 -0.961 . . . . 0.0 109.776 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 61.15 96.13 0.01 OUTLIER Glycine 0 N--CA 1.488 2.149 0 N-CA-C 109.764 -1.335 . . . . 0.0 109.764 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.8 p -105.13 129.21 53.58 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.288 -1.124 . . . . 0.0 110.4 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . 0.47 ' HB1' ' HD3' ' A' ' 125' ' ' PRO . . . -143.7 138.34 28.82 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.15 -0.968 . . . . 0.0 109.926 -179.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.5 2.062 0 O-C-N 121.158 -0.964 . . . . 0.0 110.484 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.721 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.505 2.294 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.78 162.8 41.34 Favored 'Trans proline' 0 C--N 1.315 -1.185 0 O-C-N 123.34 1.179 . . . . 0.0 110.759 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -48.61 -31.87 7.31 Favored 'General case' 0 N--CA 1.514 2.772 0 O-C-N 121.444 -0.785 . . . . 0.0 111.408 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.78 -34.19 36.44 Favored Glycine 0 N--CA 1.5 2.947 0 O-C-N 120.871 -1.143 . . . . 0.0 110.569 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -55.16 -33.4 62.92 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 120.978 -1.307 . . . . 0.0 110.568 179.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -54.12 -37.12 63.99 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.064 -1.022 . . . . 0.0 110.227 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.9 mmtt -57.81 -35.63 71.1 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.155 -0.966 . . . . 0.0 110.27 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.868 HD12 HD11 ' A' ' 23' ' ' LEU . 3.7 pt -116.23 36.68 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.138 -0.976 . . . . 0.0 110.454 179.587 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.431 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.2 OUTLIER -84.68 -43.49 0.7 Allowed Pre-proline 0 N--CA 1.508 2.442 0 O-C-N 121.038 -1.039 . . . . 0.0 113.392 -179.21 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.2 Cg_endo -76.13 -38.33 1.19 Allowed 'Trans proline' 0 N--CA 1.488 1.149 0 O-C-N 122.51 0.742 . . . . 0.0 111.922 -178.037 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.675 HG21 ' CE2' ' A' ' 62' ' ' TYR . 85.0 m -59.56 -42.95 93.61 Favored 'General case' 0 N--CA 1.512 2.654 0 O-C-N 120.925 -1.11 . . . . 0.0 109.952 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.868 HD11 HD12 ' A' ' 19' ' ' ILE . 45.2 mt -65.55 -38.75 90.52 Favored 'General case' 0 N--CA 1.506 2.347 0 C-N-CA 119.404 -0.919 . . . . 0.0 109.31 179.296 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.0 m -57.7 -34.93 69.97 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.143 -0.973 . . . . 0.0 110.227 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -56.16 -36.87 68.81 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 121.015 -1.053 . . . . 0.0 110.235 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.624 ' CD1' HD22 ' A' ' 55' ' ' LEU . 15.4 m-85 -55.89 -36.79 68.02 Favored 'General case' 0 N--CA 1.511 2.621 0 O-C-N 121.108 -0.995 . . . . 0.0 110.256 179.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -57.13 -27.74 62.09 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.184 -0.947 . . . . 0.0 111.001 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.477 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.7 mp -76.67 -37.37 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 O-C-N 121.001 -1.062 . . . . 0.0 109.403 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.454 ' CG ' HD11 ' A' ' 55' ' ' LEU . 34.9 tp60 -79.24 -39.55 32.82 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 120.945 -1.097 . . . . 0.0 108.746 178.46 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.072 HD11 HG23 ' A' ' 52' ' ' ILE . 7.2 tp -70.21 -34.0 72.38 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.491 -0.884 . . . . 0.0 110.399 179.084 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.7 ptm85 -71.85 -36.14 70.07 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 120.824 -1.173 . . . . 0.0 109.746 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.14 -39.49 94.84 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.06 -1.025 . . . . 0.0 109.662 179.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.462 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -74.81 -40.98 60.79 Favored 'General case' 0 N--CA 1.505 2.287 0 C-N-CA 119.162 -1.015 . . . . 0.0 109.15 179.026 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -67.75 -29.97 69.32 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 119.531 -0.868 . . . . 0.0 110.423 179.357 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -87.08 -32.82 19.73 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.777 -1.202 . . . . 0.0 110.89 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.4 t70 . . . . . 0 N--CA 1.512 2.635 0 O-C-N 120.923 -1.111 . . . . 0.0 110.386 -179.943 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 N--CA 1.502 2.134 0 CA-C-O 120.608 0.242 . . . . 0.0 110.579 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.405 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 9.9 m120 -58.82 -40.12 83.21 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.171 -0.956 . . . . 0.0 109.977 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.426 ' HA ' ' CE3' ' A' ' 50' ' ' TRP . 20.7 mt-10 -60.12 -43.53 95.55 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.132 -0.98 . . . . 0.0 109.813 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.404 ' CG ' ' HA ' ' A' ' 33' ' ' ALA . 41.4 tp60 -62.89 -45.02 94.49 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.233 -0.917 . . . . 0.0 109.538 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.442 HD23 HD12 ' A' ' 52' ' ' ILE . 43.8 mt -59.29 -33.81 71.54 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.279 -0.888 . . . . 0.0 110.372 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.501 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 48.3 m0 -57.78 -40.55 80.07 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 120.834 -1.166 . . . . 0.0 109.581 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -62.41 -32.8 73.68 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 119.183 -1.007 . . . . 0.0 109.423 178.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 1.072 HG23 HD11 ' A' ' 30' ' ' LEU . 21.4 mt -71.04 -58.31 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.198 0 O-C-N 121.001 -1.062 . . . . 0.0 109.007 179.161 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 ptm -62.36 -29.11 70.23 Favored 'General case' 0 N--CA 1.508 2.448 0 C-N-CA 118.555 -1.258 . . . . 0.0 109.752 178.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -70.59 -38.75 74.08 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 120.859 -1.15 . . . . 0.0 109.124 178.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.624 HD22 ' CD1' ' A' ' 26' ' ' PHE . 11.0 mt -54.15 -32.87 56.47 Favored 'General case' 0 N--CA 1.513 2.696 0 O-C-N 121.054 -1.029 . . . . 0.0 110.214 178.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.44 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 6.7 t60 -55.94 -36.73 68.08 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.065 -1.022 . . . . 0.0 110.173 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.435 ' NE2' HD21 ' A' ' 91' ' ' LEU . 6.8 m170 -59.04 -47.32 85.65 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 121.023 -1.048 . . . . 0.0 109.544 179.352 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -59.73 -37.18 78.21 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.529 -0.868 . . . . 0.0 109.801 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.438 ' HG2' ' CE1' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -62.66 -48.29 79.99 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.096 -1.003 . . . . 0.0 109.447 179.421 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 26.6 p -62.99 -41.66 99.63 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.103 -0.998 . . . . 0.0 109.301 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.9 ttt85 -62.22 -40.27 95.57 Favored 'General case' 0 N--CA 1.505 2.314 0 C-N-CA 119.381 -0.928 . . . . 0.0 109.291 179.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.675 ' CE2' HG21 ' A' ' 22' ' ' THR . 43.5 t80 -63.3 -51.49 65.86 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.117 -0.989 . . . . 0.0 109.446 179.438 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.998 HD12 ' HB2' ' A' ' 87' ' ' ALA . 71.6 mt -68.99 -36.41 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.384 0 C-N-CA 119.303 -0.959 . . . . 0.0 109.422 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.45 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 10.3 t80 -67.54 -41.81 83.68 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.044 -1.035 . . . . 0.0 108.97 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 91.5 m -60.75 -40.97 94.45 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.071 -1.018 . . . . 0.0 110.143 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.632 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.8 pp -83.26 -36.36 24.61 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 120.966 -1.084 . . . . 0.0 112.411 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.607 ' N ' HD12 ' A' ' 66' ' ' LEU . 55.3 t80 -86.63 -35.26 19.49 Favored 'General case' 0 N--CA 1.512 2.641 0 O-C-N 120.608 -1.308 . . . . 0.0 111.826 -179.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.45 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 6.9 m-85 -98.36 -3.4 37.11 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 120.904 -1.123 . . . . 0.0 113.219 -178.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.79 -58.73 0.61 Allowed 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.352 -1.468 . . . . 0.0 110.8 179.437 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.412 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 11.7 tpt85 -62.52 -29.55 70.64 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 121.03 -1.043 . . . . 0.0 110.696 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 ttmm 59.72 44.26 14.4 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.819 -1.175 . . . . 0.0 110.021 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -118.2 37.73 3.92 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.389 -0.819 . . . . 0.0 109.87 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.72 HG13 HD23 ' A' ' 77' ' ' LEU . 14.8 tt -156.46 162.74 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.198 -0.939 . . . . 0.0 110.154 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 63.3 m -110.18 147.39 33.83 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.204 -0.935 . . . . 0.0 110.153 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.4 tttt -46.02 -32.21 2.69 Favored 'General case' 0 N--CA 1.516 2.864 0 O-C-N 121.328 -0.858 . . . . 0.0 111.606 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -62.11 -49.82 74.38 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.037 -1.039 . . . . 0.0 109.511 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.72 HD23 HG13 ' A' ' 73' ' ' ILE . 27.8 tp -67.39 -43.73 80.61 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 119.161 -1.016 . . . . 0.0 108.712 178.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.487 ' HA ' HD12 ' A' ' 81' ' ' LEU . 18.2 t80 -61.9 -38.13 87.21 Favored 'General case' 0 N--CA 1.506 2.327 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.325 179.135 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -73.73 -42.51 61.05 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.123 -0.986 . . . . 0.0 108.802 178.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.721 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 85.8 t90 -57.52 -37.01 72.32 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.31 -0.869 . . . . 0.0 109.712 178.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.541 HD22 ' CD2' ' A' ' 86' ' ' TYR . 14.6 mt -69.23 -48.57 61.6 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.21 -0.932 . . . . 0.0 108.897 179.089 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.497 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 32.4 mm -56.72 -31.74 35.95 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.614 0 O-C-N 121.124 -0.985 . . . . 0.0 109.911 179.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.7 mttt -86.67 -22.62 25.99 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 120.918 -1.114 . . . . 0.0 111.611 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.449 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 76.3 mm-40 -99.18 20.49 13.4 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 120.756 -1.215 . . . . 0.0 112.015 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.401 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 0.3 OUTLIER 74.03 77.22 0.12 Allowed 'General case' 0 N--CA 1.511 2.599 0 O-C-N 121.01 -1.056 . . . . 0.0 111.484 179.257 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.602 ' HE2' HD13 ' A' ' 23' ' ' LEU . 30.3 m-85 -135.69 -65.04 0.61 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.539 -0.726 . . . . 0.0 109.642 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.998 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -118.03 174.53 6.15 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.276 -0.89 . . . . 0.0 109.653 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.44 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 12.6 t0 -114.42 102.77 10.4 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.261 -0.899 . . . . 0.0 109.962 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.494 ' HG3' HD12 ' A' ' 82' ' ' ILE . 16.7 mttt -66.8 -40.21 88.02 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.303 -0.873 . . . . 0.0 109.886 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.759 HD23 HD13 ' A' ' 106' ' ' LEU . 60.7 tp -61.85 -40.3 94.85 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.188 -0.945 . . . . 0.0 109.735 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.657 ' N ' HD11 ' A' ' 106' ' ' LEU . 59.6 tp -71.93 -43.44 65.28 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.097 -1.002 . . . . 0.0 108.674 179.229 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 54.2 mt -58.36 -35.75 55.31 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.479 0 O-C-N 121.206 -0.934 . . . . 0.0 108.702 178.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.85 -39.52 83.8 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.17 -0.956 . . . . 0.0 109.091 178.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.432 ' CD ' ' CZ ' ' A' ' 100' ' ' TYR . 8.1 mmtm -57.17 -42.57 81.36 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.031 -1.043 . . . . 0.0 109.484 179.186 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.41 ' CZ3' ' HG ' ' A' ' 91' ' ' LEU . 2.7 m0 -65.36 -35.79 82.04 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.342 -0.849 . . . . 0.0 110.053 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.23 -31.78 38.49 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.125 -0.985 . . . . 0.0 110.655 179.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 20.4 mmtm -53.64 -176.86 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.706 0 O-C-N 120.996 -1.065 . . . . 0.0 110.745 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -104.62 135.46 45.99 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.211 -0.931 . . . . 0.0 109.765 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.04 11.94 53.52 Favored Glycine 0 N--CA 1.492 2.428 0 C-N-CA 120.262 -0.971 . . . . 0.0 110.993 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.563 ' HB3' HD23 ' A' ' 103' ' ' LEU . 48.4 m-85 -119.95 72.15 0.92 Allowed 'General case' 0 N--CA 1.492 1.664 0 CA-C-N 119.435 1.617 . . . . 0.0 109.973 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -93.69 -35.82 12.63 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.094 -1.004 . . . . 0.0 110.491 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -123.86 80.14 1.78 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.979 -1.075 . . . . 0.0 110.662 -179.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.563 HD23 ' HB3' ' A' ' 100' ' ' TYR . 2.8 pp -124.55 146.38 49.04 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.107 -0.996 . . . . 0.0 110.033 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.426 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.6 p -109.94 -30.87 7.61 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.154 -0.966 . . . . 0.0 112.967 -179.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.705 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.4 m -145.15 -169.79 3.28 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 120.194 -1.566 . . . . 0.0 110.098 179.39 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.759 HD13 HD23 ' A' ' 90' ' ' LEU . 16.7 mt -99.76 -35.99 9.61 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.295 -0.878 . . . . 0.0 110.227 178.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 3.3 ttt85 -103.06 33.69 3.17 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.869 -1.145 . . . . 0.0 109.653 178.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.705 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.276 1.6 t -124.82 -60.75 1.35 Allowed 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 105.18 -2.155 . . . . 0.0 105.18 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.718 ' O ' HG21 ' A' ' 119' ' ' THR . 4.2 pt -69.01 -21.95 25.9 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.671 0 O-C-N 120.879 -1.138 . . . . 0.0 110.784 176.47 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 . . . . . 0 N--CA 1.492 1.655 0 O-C-N 120.837 -1.164 . . . . 0.0 109.756 -179.628 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.718 HG21 ' O ' ' A' ' 109' ' ' ILE . 0.4 OUTLIER . . . . . 0 N--CA 1.5 2.036 0 CA-C-O 120.495 0.188 . . . . 0.0 110.548 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 34.2 t -59.35 154.97 15.59 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.137 -0.977 . . . . 0.0 109.485 179.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.956 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -76.84 -30.11 18.2 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.384 0 O-C-N 121.066 -1.021 . . . . 0.0 111.63 -179.013 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.48 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.7 p -58.67 -35.81 73.17 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 120.684 -1.26 . . . . 0.0 110.861 -178.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.18 -30.3 64.4 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 120.914 -1.116 . . . . 0.0 110.196 178.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.6 t -83.55 122.66 76.9 Favored Pre-proline 0 N--CA 1.505 2.303 0 O-C-N 120.976 -1.078 . . . . 0.0 110.217 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -66.08 179.2 2.0 Favored 'Trans proline' 0 N--CA 1.49 1.277 0 O-C-N 123.175 1.092 . . . . 0.0 110.94 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.26 -37.68 60.84 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.256 -0.902 . . . . 0.0 110.511 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.29 -40.62 78.19 Favored 'General case' 0 N--CA 1.511 2.622 0 O-C-N 121.047 -1.033 . . . . 0.0 110.057 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -70.41 -41.7 72.62 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 119.346 -0.941 . . . . 0.0 109.113 179.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.546 ' O ' HG11 ' A' ' 140' ' ' VAL . 4.3 mt -66.02 -38.77 89.27 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 121.288 -0.882 . . . . 0.0 109.402 178.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -59.95 -38.11 81.51 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.113 -0.992 . . . . 0.0 109.958 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -58.58 -37.75 76.46 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.064 -1.022 . . . . 0.0 110.379 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -63.84 -45.72 88.3 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.139 -0.976 . . . . 0.0 109.807 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.421 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -61.68 -40.97 96.84 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.169 -0.957 . . . . 0.0 109.776 179.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 34.7 mtt-85 -59.88 -36.12 76.25 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.245 -0.909 . . . . 0.0 110.121 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 20.7 mttm -70.54 -32.91 70.54 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.042 -1.036 . . . . 0.0 110.879 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 2.1 ttmm -100.59 22.01 12.48 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 120.97 -1.081 . . . . 0.0 111.713 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.18 45.98 57.04 Favored Glycine 0 N--CA 1.499 2.87 0 O-C-N 120.592 -1.318 . . . . 0.0 110.688 179.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.421 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.3 t -143.04 -165.46 2.07 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.186 -1.185 . . . . 0.0 110.164 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -134.35 149.48 50.85 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.147 -0.971 . . . . 0.0 110.302 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.546 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.7 p -130.98 161.34 41.17 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 121.241 -0.912 . . . . 0.0 109.954 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 30.3 t -166.17 100.2 0.63 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.187 -0.946 . . . . 0.0 111.19 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.956 ' CD1' HD12 ' A' ' 121' ' ' ILE . 74.3 t80 -101.31 160.54 14.32 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.311 -0.868 . . . . 0.0 110.371 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -138.44 -60.88 0.6 Allowed 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.05 149.25 41.43 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.392 -0.817 . . . . 0.0 109.419 179.122 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . 0.453 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.7 p -91.65 157.96 16.67 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 120.992 -1.067 . . . . 0.0 110.765 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 12.5 p -78.42 -23.06 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 O-C-N 121.29 -0.881 . . . . 0.0 111.906 -179.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -51.77 -57.92 7.88 Favored 'General case' 0 N--CA 1.515 2.825 0 O-C-N 120.725 -1.234 . . . . 0.0 109.956 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.501 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 24.2 p -126.78 -165.49 1.46 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.296 -0.878 . . . . 0.0 110.387 179.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . 0.416 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.42 65.07 0.58 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 107.891 -2.084 . . . . 0.0 107.891 178.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 33.6 t -101.72 141.76 34.09 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.344 -1.092 . . . . 0.0 109.813 -179.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 66.0 mtm-85 -100.38 43.56 1.05 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.18 -0.95 . . . . 0.0 109.772 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 80.61 95.55 0.39 Allowed Glycine 0 N--CA 1.486 2.002 0 N-CA-C 109.99 -1.244 . . . . 0.0 109.99 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.6 p -109.31 126.97 53.93 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.202 -1.176 . . . . 0.0 110.136 179.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -154.32 147.6 24.88 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.118 -0.989 . . . . 0.0 110.415 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.501 2.101 0 O-C-N 121.228 -0.92 . . . . 0.0 110.542 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.685 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.499 1.988 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.435 ' HG2' HD13 ' A' ' 77' ' ' LEU . 43.7 Cg_endo -69.72 162.76 40.82 Favored 'Trans proline' 0 C--N 1.314 -1.238 0 O-C-N 123.435 1.229 . . . . 0.0 110.84 -179.66 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -48.61 -31.43 6.63 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.417 -0.802 . . . . 0.0 111.532 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.41 -35.73 36.54 Favored Glycine 0 N--CA 1.499 2.881 0 O-C-N 120.958 -1.089 . . . . 0.0 110.6 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.427 ' CE2' ' HG2' ' A' ' 20' ' ' LYS . 22.7 t80 -56.98 -33.48 67.14 Favored 'General case' 0 N--CA 1.511 2.617 0 O-C-N 121.034 -1.274 . . . . 0.0 110.579 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -53.78 -38.71 64.76 Favored 'General case' 0 N--CA 1.512 2.647 0 O-C-N 120.991 -1.068 . . . . 0.0 110.166 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 79.6 mttt -60.73 -36.59 79.25 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.366 -0.833 . . . . 0.0 110.081 179.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.694 HD12 HD11 ' A' ' 23' ' ' LEU . 1.8 pt -114.32 33.49 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 O-C-N 121.247 -0.908 . . . . 0.0 110.757 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.427 ' HG2' ' CE2' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -83.99 -45.54 0.76 Allowed Pre-proline 0 N--CA 1.51 2.525 0 O-C-N 121.056 -1.027 . . . . 0.0 112.872 -179.279 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.412 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.3 Cg_endo -76.78 -36.45 1.55 Allowed 'Trans proline' 0 N--CA 1.485 1.017 0 O-C-N 122.688 0.836 . . . . 0.0 111.46 -178.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.789 HG21 ' CE2' ' A' ' 62' ' ' TYR . 87.1 m -59.08 -42.64 90.89 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 120.935 -1.103 . . . . 0.0 109.893 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.694 HD11 HD12 ' A' ' 19' ' ' ILE . 93.6 mt -66.11 -39.95 90.33 Favored 'General case' 0 N--CA 1.505 2.302 0 C-N-CA 119.442 -0.903 . . . . 0.0 109.468 179.314 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.9 m -57.95 -34.5 69.97 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.167 -0.958 . . . . 0.0 110.072 179.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -55.84 -35.14 66.07 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 121.018 -1.051 . . . . 0.0 110.332 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.724 ' CD2' HD22 ' A' ' 55' ' ' LEU . 15.0 m-85 -57.67 -39.45 77.12 Favored 'General case' 0 N--CA 1.51 2.526 0 O-C-N 121.006 -1.059 . . . . 0.0 110.486 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -59.99 -34.36 73.21 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.238 -0.914 . . . . 0.0 111.022 -179.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.4 mp -71.43 -39.62 71.53 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.369 0 O-C-N 121.017 -1.052 . . . . 0.0 109.265 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 -70.52 -43.77 68.94 Favored 'General case' 0 N--CA 1.507 2.378 0 C-N-CA 119.199 -1.0 . . . . 0.0 108.725 178.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.707 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -66.35 -34.92 79.06 Favored 'General case' 0 N--CA 1.506 2.357 0 C-N-CA 119.366 -0.933 . . . . 0.0 108.974 178.286 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -57.62 -40.61 79.53 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.102 -0.999 . . . . 0.0 109.962 179.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.95 -46.37 88.06 Favored 'General case' 0 N--CA 1.506 2.371 0 C-N-CA 119.301 -0.96 . . . . 0.0 109.829 -179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.549 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -67.89 -40.43 83.51 Favored 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 119.237 -0.985 . . . . 0.0 109.215 179.081 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -59.62 -35.06 73.62 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.249 -0.907 . . . . 0.0 110.346 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 46.4 mmtt -95.29 -38.49 10.51 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 120.992 -1.067 . . . . 0.0 110.641 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.6 t70 . . . . . 0 N--CA 1.509 2.524 0 O-C-N 121.059 -1.025 . . . . 0.0 110.099 179.892 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.423 ' OG ' ' N ' ' A' ' 46' ' ' ASN . 5.7 p . . . . . 0 N--CA 1.498 1.925 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.423 ' N ' ' OG ' ' A' ' 45' ' ' SER . 3.1 m120 -57.09 -38.55 73.51 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.256 -0.902 . . . . 0.0 109.967 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.421 ' HA ' ' CE3' ' A' ' 50' ' ' TRP . 20.0 mt-10 -63.24 -41.09 99.04 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.155 -0.966 . . . . 0.0 109.797 179.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.0 tp60 -61.87 -39.99 93.83 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.141 -0.974 . . . . 0.0 109.782 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.675 HD23 HD12 ' A' ' 52' ' ' ILE . 12.5 mt -62.66 -36.87 84.24 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.188 -0.945 . . . . 0.0 110.283 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.514 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.9 m0 -54.41 -39.57 67.43 Favored 'General case' 0 N--CA 1.512 2.639 0 O-C-N 120.909 -1.119 . . . . 0.0 109.724 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -63.45 -38.08 89.77 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.258 -0.901 . . . . 0.0 109.635 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.707 HG23 ' CG ' ' A' ' 30' ' ' LEU . 78.8 mt -64.86 -44.96 96.23 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.394 0 O-C-N 121.135 -0.978 . . . . 0.0 109.173 179.632 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.463 ' CE ' ' HB3' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -68.17 -30.55 69.69 Favored 'General case' 0 N--CA 1.501 2.101 0 C-N-CA 118.889 -1.124 . . . . 0.0 109.743 178.999 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.446 ' N ' ' HG3' ' A' ' 53' ' ' MET . 48.1 mt-30 -67.39 -37.4 83.08 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.898 -1.126 . . . . 0.0 109.111 178.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.724 HD22 ' CD2' ' A' ' 26' ' ' PHE . 13.6 mt -52.35 -32.33 37.76 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.115 -0.99 . . . . 0.0 109.917 178.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.453 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 13.3 t60 -56.92 -40.27 76.01 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.023 -1.048 . . . . 0.0 109.389 179.024 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.423 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 8.0 m170 -60.44 -49.16 78.67 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.154 -0.966 . . . . 0.0 109.137 178.583 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -59.59 -39.45 84.19 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.343 -0.848 . . . . 0.0 109.365 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.426 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -62.42 -48.13 81.06 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.138 -0.976 . . . . 0.0 108.928 178.955 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 12.6 p -66.81 -40.57 88.09 Favored 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 119.384 -0.926 . . . . 0.0 108.699 178.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.8 ttt85 -63.01 -37.52 87.53 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.13 -0.981 . . . . 0.0 109.413 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.789 ' CE2' HG21 ' A' ' 22' ' ' THR . 44.5 t80 -61.1 -50.83 71.67 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.124 -0.985 . . . . 0.0 109.293 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.675 HD12 ' HB2' ' A' ' 87' ' ' ALA . 88.6 mt -73.33 -42.01 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.344 0 C-N-CA 119.37 -0.932 . . . . 0.0 108.855 179.06 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.507 ' CE1' HG23 ' A' ' 92' ' ' ILE . 47.7 t80 -57.85 -32.56 67.76 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.331 -0.855 . . . . 0.0 110.235 178.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 61.9 m -80.78 -36.97 31.08 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 120.881 -1.137 . . . . 0.0 110.59 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.622 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -82.93 -32.05 27.4 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 120.954 -1.092 . . . . 0.0 112.25 -179.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.503 ' HD1' HG23 ' A' ' 73' ' ' ILE . 90.3 t80 -86.47 -36.16 19.21 Favored 'General case' 0 N--CA 1.512 2.655 0 O-C-N 120.658 -1.277 . . . . 0.0 111.731 -179.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -98.56 -20.6 16.95 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 120.896 -1.128 . . . . 0.0 112.951 -178.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -119.27 -56.45 2.07 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 120.48 -1.387 . . . . 0.0 111.637 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.425 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 8.4 ttt-85 -66.76 -29.72 69.76 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.056 -1.027 . . . . 0.0 110.805 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 59.5 44.6 14.6 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.822 -1.174 . . . . 0.0 110.042 -179.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.52 37.17 3.3 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.336 -0.853 . . . . 0.0 109.523 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.774 HG13 HD23 ' A' ' 77' ' ' LEU . 13.6 tt -160.43 162.69 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 121.243 -0.911 . . . . 0.0 110.139 -179.583 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.8 p -108.26 148.83 29.43 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.135 -0.978 . . . . 0.0 110.024 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.8 tttt -46.71 -32.2 3.43 Favored 'General case' 0 N--CA 1.515 2.799 0 O-C-N 121.271 -0.893 . . . . 0.0 111.556 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -61.69 -50.32 72.94 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.917 -1.114 . . . . 0.0 109.337 179.542 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.774 HD23 HG13 ' A' ' 73' ' ' ILE . 34.8 tp -67.33 -42.16 84.04 Favored 'General case' 0 N--CA 1.504 2.235 0 C-N-CA 119.118 -1.033 . . . . 0.0 108.657 178.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.643 ' HA ' HD12 ' A' ' 81' ' ' LEU . 19.1 t80 -61.6 -39.71 92.19 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.227 -0.921 . . . . 0.0 109.194 178.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -70.36 -42.44 71.8 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.142 -0.974 . . . . 0.0 108.728 178.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.685 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 68.3 t90 -56.95 -35.16 68.79 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.215 -0.928 . . . . 0.0 109.859 178.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.643 HD12 ' HA ' ' A' ' 78' ' ' TYR . 13.2 mt -70.37 -49.82 45.24 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.077 -1.015 . . . . 0.0 108.902 179.116 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 36.1 mm -58.37 -32.52 45.36 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.567 0 O-C-N 121.26 -0.9 . . . . 0.0 110.032 179.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.9 mttm -89.27 -15.74 32.81 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 120.894 -1.128 . . . . 0.0 112.108 -179.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.426 ' HB2' ' CE1' ' A' ' 86' ' ' TYR . 26.3 mm-40 -105.36 20.64 18.54 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 120.581 -1.324 . . . . 0.0 112.063 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt 73.85 77.36 0.13 Allowed 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.05 -1.031 . . . . 0.0 111.578 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.466 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 28.6 m-85 -135.01 -63.45 0.69 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.531 -0.73 . . . . 0.0 109.711 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.675 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -120.23 -174.48 2.79 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.377 -0.827 . . . . 0.0 109.894 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.453 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.7 t0 -124.04 112.78 17.56 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.134 -0.979 . . . . 0.0 110.435 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -63.74 -40.74 97.46 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.117 -0.989 . . . . 0.0 109.395 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.488 ' HB3' HD13 ' A' ' 106' ' ' LEU . 13.0 tp -59.59 -40.64 88.11 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.126 -0.984 . . . . 0.0 109.596 179.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.688 HD12 ' CZ3' ' A' ' 95' ' ' TRP . 0.2 OUTLIER -65.22 -53.24 47.57 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.188 -0.945 . . . . 0.0 109.012 179.368 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.507 HG23 ' CE1' ' A' ' 64' ' ' TYR . 55.8 mt -62.32 -34.71 65.64 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.313 0 O-C-N 121.228 -0.92 . . . . 0.0 109.127 178.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.93 -40.07 91.08 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.052 -1.03 . . . . 0.0 109.9 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.652 ' HB3' HD22 ' A' ' 103' ' ' LEU . 9.4 mttp -64.98 -42.53 94.47 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.026 -1.047 . . . . 0.0 110.267 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.688 ' CZ3' HD12 ' A' ' 91' ' ' LEU . 3.1 m0 -62.15 -33.5 74.62 Favored 'General case' 0 N--CA 1.51 2.553 0 C-N-CA 118.983 -1.087 . . . . 0.0 110.107 178.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.12 -35.3 36.97 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 120.963 -1.086 . . . . 0.0 110.452 179.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.6 mmtp -53.13 -179.31 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.652 0 O-C-N 121.009 -1.057 . . . . 0.0 110.718 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.1 m -106.6 140.46 39.44 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.289 -0.882 . . . . 0.0 109.544 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 101.23 -24.53 31.5 Favored Glycine 0 N--CA 1.492 2.408 0 C-N-CA 119.834 -1.174 . . . . 0.0 110.45 -179.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.59 ' HB3' HD23 ' A' ' 103' ' ' LEU . 63.4 m-85 -91.95 58.56 3.41 Favored 'General case' 0 N--CA 1.503 2.224 0 CA-C-N 119.083 1.441 . . . . 0.0 110.047 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -71.18 -37.46 72.16 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.018 -1.051 . . . . 0.0 110.208 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.62 84.86 2.33 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.046 -1.034 . . . . 0.0 110.617 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.84 ' HB2' HD13 ' A' ' 109' ' ' ILE . 2.3 pp -120.54 140.83 50.9 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.086 -1.009 . . . . 0.0 110.303 179.583 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.423 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.5 p -108.03 -28.82 9.33 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.235 -0.916 . . . . 0.0 112.598 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.715 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 10.6 m -146.68 -169.83 3.37 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 120.366 -1.459 . . . . 0.0 110.005 179.314 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.661 HD21 ' HA ' ' A' ' 91' ' ' LEU . 93.9 mt -100.09 -35.1 9.8 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.211 -0.931 . . . . 0.0 110.583 178.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.92 36.67 2.37 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.757 -1.215 . . . . 0.0 109.187 178.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.715 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.284 1.6 t -127.72 -59.01 1.22 Allowed 'General case' 0 N--CA 1.498 1.946 0 N-CA-C 105.788 -1.931 . . . . 0.0 105.788 -179.411 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.84 HD13 ' HB2' ' A' ' 103' ' ' LEU . 18.8 pt -69.15 -26.22 31.49 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.617 0 O-C-N 121.001 -1.062 . . . . 0.0 110.741 177.034 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.414 ' N ' HG13 ' A' ' 109' ' ' ILE . 47.2 tt0 . . . . . 0 N--CA 1.493 1.683 0 O-C-N 120.865 -1.147 . . . . 0.0 110.175 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.759 HG21 ' O ' ' A' ' 109' ' ' ILE . 0.9 OUTLIER . . . . . 0 N--CA 1.495 1.789 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 35.1 t -55.48 153.68 7.28 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.047 -1.033 . . . . 0.0 110.047 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.801 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -74.22 -36.17 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.469 0 O-C-N 121.144 -0.973 . . . . 0.0 111.279 -179.07 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.483 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 10.7 p -52.72 -30.72 33.93 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.75 -1.219 . . . . 0.0 111.723 -178.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 1.5 ttt85 -61.61 -37.01 82.35 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 120.873 -1.142 . . . . 0.0 109.531 178.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 50.5 t -76.12 124.16 88.24 Favored Pre-proline 0 N--CA 1.505 2.286 0 O-C-N 121.109 -0.994 . . . . 0.0 110.031 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -66.09 172.83 8.07 Favored 'Trans proline' 0 N--CA 1.488 1.201 0 O-C-N 123.241 1.127 . . . . 0.0 110.707 179.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 27.1 mmm-85 -75.04 -36.2 61.88 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 121.19 -0.944 . . . . 0.0 110.675 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.05 -40.8 77.53 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 120.974 -1.079 . . . . 0.0 110.123 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -68.69 -41.6 78.93 Favored 'General case' 0 N--CA 1.506 2.348 0 C-N-CA 119.349 -0.94 . . . . 0.0 109.276 179.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.612 HD11 HD11 ' A' ' 121' ' ' ILE . 1.6 mt -64.53 -39.39 93.69 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.263 -0.898 . . . . 0.0 109.501 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -59.0 -37.82 77.75 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.181 -0.949 . . . . 0.0 110.13 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -58.15 -37.15 74.09 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.046 -1.034 . . . . 0.0 110.454 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.16 -47.67 81.69 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.237 -0.915 . . . . 0.0 109.892 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.582 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -61.2 -39.86 91.78 Favored 'General case' 0 N--CA 1.508 2.456 0 C-N-CA 119.33 -0.948 . . . . 0.0 109.787 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -37.33 79.63 Favored 'General case' 0 N--CA 1.512 2.631 0 O-C-N 121.174 -0.954 . . . . 0.0 110.149 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 13.5 mmtm -87.06 -38.86 16.14 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.084 -1.01 . . . . 0.0 110.261 179.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . 0.451 ' HB3' HG22 ' A' ' 138' ' ' THR . 0.1 OUTLIER -70.28 -26.71 63.93 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.14 -0.975 . . . . 0.0 111.158 179.668 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 91.69 32.28 8.73 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 110.006 -1.238 . . . . 0.0 110.006 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.582 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.6 t -139.96 -159.67 0.98 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.981 -1.305 . . . . 0.0 109.725 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -134.41 134.73 41.98 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.045 -1.034 . . . . 0.0 110.228 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 13.2 p -120.42 160.55 20.92 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.258 -0.902 . . . . 0.0 110.116 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 35.6 t -168.92 80.51 0.13 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.165 -0.959 . . . . 0.0 111.327 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.777 ' CG ' HD12 ' A' ' 121' ' ' ILE . 40.1 t80 -87.72 160.34 18.13 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.163 -0.961 . . . . 0.0 109.679 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -136.77 -61.26 0.68 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.515 -0.741 . . . . 0.0 109.092 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -135.57 153.25 51.75 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.435 -0.79 . . . . 0.0 109.504 179.184 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . 0.405 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.0 p -95.3 155.76 16.6 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.137 -0.977 . . . . 0.0 110.92 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.6 m -73.96 -25.85 20.66 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.522 0 O-C-N 121.271 -0.893 . . . . 0.0 111.814 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -51.64 -48.0 63.52 Favored 'General case' 0 N--CA 1.515 2.815 0 O-C-N 120.835 -1.166 . . . . 0.0 110.04 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.514 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 30.9 p -137.85 -168.87 2.43 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.161 -0.962 . . . . 0.0 111.01 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -98.85 57.41 0.93 Allowed Glycine 0 N--CA 1.492 2.429 0 N-CA-C 107.633 -2.187 . . . . 0.0 107.633 178.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 19.8 t -97.51 141.2 30.85 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.421 -1.046 . . . . 0.0 109.744 -179.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.21 51.74 1.11 Allowed 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.312 -0.868 . . . . 0.0 109.506 179.356 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 68.77 98.16 0.04 OUTLIER Glycine 0 N--CA 1.488 2.1 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.8 p -109.6 129.42 55.59 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.213 -1.169 . . . . 0.0 110.332 179.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -145.51 147.65 32.36 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.18 -0.95 . . . . 0.0 110.212 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.498 1.968 0 O-C-N 121.206 -0.933 . . . . 0.0 110.735 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.75 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.501 2.124 0 CA-C-O 120.461 0.172 . . . . 0.0 110.573 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -71.15 163.46 39.12 Favored 'Trans proline' 0 C--N 1.317 -1.113 0 O-C-N 123.309 1.162 . . . . 0.0 110.734 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -48.18 -32.51 7.14 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 121.479 -0.763 . . . . 0.0 111.358 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -54.37 -34.16 54.02 Favored Glycine 0 N--CA 1.497 2.744 0 O-C-N 120.984 -1.072 . . . . 0.0 110.431 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.471 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 27.5 t80 -54.46 -31.88 56.51 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.985 -1.303 . . . . 0.0 110.843 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.17 -37.73 64.78 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.02 -1.05 . . . . 0.0 110.272 179.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.7 mmmm -58.02 -35.78 71.76 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.232 -0.917 . . . . 0.0 110.342 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.818 HD12 HD11 ' A' ' 23' ' ' LEU . 2.8 pt -117.97 36.37 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.047 0 O-C-N 121.208 -0.933 . . . . 0.0 110.473 179.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.436 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -83.84 -43.64 0.79 Allowed Pre-proline 0 N--CA 1.508 2.448 0 O-C-N 120.998 -1.064 . . . . 0.0 113.132 -179.165 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.436 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.7 Cg_endo -76.66 -35.97 1.81 Allowed 'Trans proline' 0 N--CA 1.486 1.043 0 O-C-N 122.584 0.781 . . . . 0.0 111.869 -178.263 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.817 HG21 ' CE2' ' A' ' 62' ' ' TYR . 61.8 m -61.48 -47.16 86.92 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 120.893 -1.129 . . . . 0.0 110.015 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.818 HD11 HD12 ' A' ' 19' ' ' ILE . 10.9 mt -61.19 -38.07 85.21 Favored 'General case' 0 N--CA 1.509 2.487 0 C-N-CA 119.476 -0.89 . . . . 0.0 109.701 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.7 m -56.88 -35.43 68.93 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.07 -1.018 . . . . 0.0 110.278 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -56.82 -37.64 71.51 Favored 'General case' 0 N--CA 1.512 2.653 0 O-C-N 121.125 -0.985 . . . . 0.0 110.192 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.733 ' CD2' HD22 ' A' ' 55' ' ' LEU . 21.7 m-85 -58.92 -40.28 84.11 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.134 -0.979 . . . . 0.0 110.17 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -60.86 -23.16 64.94 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.269 -0.895 . . . . 0.0 111.471 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.554 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.7 mp -81.14 -34.59 13.65 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.313 0 O-C-N 120.829 -1.169 . . . . 0.0 109.719 179.428 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 57.5 tp60 -81.24 -37.03 29.23 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.898 -1.127 . . . . 0.0 109.211 178.448 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.734 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -73.43 -32.43 64.38 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.115 -0.991 . . . . 0.0 110.12 178.887 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.7 ptm180 -69.92 -36.7 75.57 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 120.842 -1.161 . . . . 0.0 109.742 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -64.82 -39.78 94.14 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.081 -1.012 . . . . 0.0 109.504 179.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.575 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -68.97 -41.7 77.56 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.15 -0.969 . . . . 0.0 109.369 179.18 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 9.2 mm-40 -61.64 -34.34 75.52 Favored 'General case' 0 N--CA 1.506 2.343 0 C-N-CA 119.568 -0.853 . . . . 0.0 110.449 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.2 mttt -94.02 -36.16 12.27 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 120.991 -1.068 . . . . 0.0 110.921 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.0 t70 . . . . . 0 N--CA 1.51 2.56 0 O-C-N 121.031 -1.043 . . . . 0.0 110.238 179.988 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.499 2.023 0 CA-C-O 120.601 0.239 . . . . 0.0 110.576 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.5 m-80 -57.55 -39.0 75.69 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.12 -0.988 . . . . 0.0 110.186 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -64.63 -44.24 91.14 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.141 -0.974 . . . . 0.0 109.61 179.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.8 tp60 -64.17 -41.41 97.15 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.224 -0.923 . . . . 0.0 109.481 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.628 HD23 HD12 ' A' ' 52' ' ' ILE . 12.9 mt -61.08 -36.94 81.0 Favored 'General case' 0 N--CA 1.507 2.412 0 C-N-CA 119.487 -0.885 . . . . 0.0 110.044 179.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.504 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 53.6 m0 -58.51 -38.43 77.67 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 120.993 -1.067 . . . . 0.0 110.105 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -62.17 -30.13 70.84 Favored 'General case' 0 N--CA 1.505 2.315 0 C-N-CA 119.147 -1.021 . . . . 0.0 109.802 178.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.734 HG23 ' CG ' ' A' ' 30' ' ' LEU . 77.6 mt -71.21 -57.58 7.24 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.288 0 O-C-N 120.886 -1.134 . . . . 0.0 109.284 179.41 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 ptm -62.44 -30.0 70.91 Favored 'General case' 0 N--CA 1.508 2.466 0 C-N-CA 118.621 -1.232 . . . . 0.0 109.77 179.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -67.34 -38.34 84.7 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 120.808 -1.182 . . . . 0.0 109.116 178.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.733 HD22 ' CD2' ' A' ' 26' ' ' PHE . 10.9 mt -53.13 -31.02 40.14 Favored 'General case' 0 N--CA 1.511 2.608 0 O-C-N 121.028 -1.045 . . . . 0.0 110.248 179.002 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.467 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 5.3 t60 -56.48 -38.35 71.61 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.007 -1.058 . . . . 0.0 109.965 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.503 ' CD2' HD21 ' A' ' 91' ' ' LEU . 5.4 m170 -60.38 -50.59 73.0 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.122 -0.986 . . . . 0.0 109.284 179.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.6 tp60 -59.38 -34.83 72.9 Favored 'General case' 0 N--CA 1.507 2.394 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.402 178.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.442 ' HD3' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -66.52 -52.04 50.2 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.145 -0.972 . . . . 0.0 109.175 178.912 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.0 p -63.01 -38.37 90.91 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.208 -0.932 . . . . 0.0 109.2 179.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.426 ' O ' ' OG1' ' A' ' 65' ' ' THR . 1.5 ttt85 -64.59 -40.46 95.56 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.134 -0.979 . . . . 0.0 109.046 178.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.817 ' CE2' HG21 ' A' ' 22' ' ' THR . 38.6 t80 -62.19 -51.28 68.44 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.194 -0.941 . . . . 0.0 109.284 179.307 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.804 HD12 ' HB2' ' A' ' 87' ' ' ALA . 78.8 mt -69.41 -39.27 78.56 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.439 0 C-N-CA 119.453 -0.899 . . . . 0.0 109.247 179.304 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.409 ' HD2' HD13 ' A' ' 92' ' ' ILE . 12.6 t80 -65.12 -43.12 93.03 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.249 -0.907 . . . . 0.0 109.162 179.198 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.426 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 88.4 m -60.88 -41.8 96.69 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.083 -1.01 . . . . 0.0 110.468 -179.53 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.572 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.35 -32.59 26.17 Favored 'General case' 0 N--CA 1.503 2.207 0 C-N-CA 118.887 -1.125 . . . . 0.0 112.541 -178.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.455 ' N ' HD12 ' A' ' 66' ' ' LEU . 46.7 t80 -86.38 -32.24 21.06 Favored 'General case' 0 N--CA 1.512 2.666 0 O-C-N 120.605 -1.31 . . . . 0.0 111.851 -179.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.407 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 7.8 m-85 -98.27 -19.09 18.02 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 120.814 -1.179 . . . . 0.0 112.622 -178.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.404 ' HD3' ' HA ' ' A' ' 65' ' ' THR . 7.8 mtpt -121.18 -58.41 1.79 Allowed 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.501 -1.375 . . . . 0.0 110.916 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.411 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 6.9 ttm180 -64.71 -31.13 72.21 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.19 -0.944 . . . . 0.0 110.774 -179.504 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 57.93 43.16 21.82 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.814 -1.179 . . . . 0.0 110.019 -179.607 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.64 35.78 3.71 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.443 -0.785 . . . . 0.0 109.824 179.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.802 HG13 HD23 ' A' ' 77' ' ' LEU . 13.9 tt -154.52 162.67 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.26 -0.9 . . . . 0.0 109.98 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 4.6 t -109.31 146.46 34.29 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.128 -0.982 . . . . 0.0 110.192 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -45.03 -32.69 1.78 Allowed 'General case' 0 N--CA 1.516 2.851 0 O-C-N 121.316 -0.865 . . . . 0.0 111.728 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -61.53 -50.92 70.72 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 120.841 -1.162 . . . . 0.0 109.227 179.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.802 HD23 HG13 ' A' ' 73' ' ' ILE . 40.4 tp -66.8 -43.64 83.35 Favored 'General case' 0 N--CA 1.505 2.309 0 C-N-CA 119.252 -0.979 . . . . 0.0 108.46 178.628 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.433 ' HA ' HD12 ' A' ' 81' ' ' LEU . 16.9 t80 -60.38 -38.0 82.54 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.349 -0.844 . . . . 0.0 109.465 179.038 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.501 ' O ' HG22 ' A' ' 82' ' ' ILE . 34.8 t70 -74.8 -41.91 59.08 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.028 -1.045 . . . . 0.0 108.891 178.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.75 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 88.6 t90 -58.99 -38.92 80.29 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.168 -0.958 . . . . 0.0 109.245 178.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.468 HD23 ' CE2' ' A' ' 86' ' ' TYR . 13.9 mt -65.58 -54.88 21.74 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.226 -0.921 . . . . 0.0 109.244 179.056 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.632 HD12 ' HB3' ' A' ' 87' ' ' ALA . 0.8 OUTLIER -55.81 -27.43 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.512 0 O-C-N 121.077 -1.014 . . . . 0.0 110.751 -179.856 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.6 ttpm? -87.77 -21.99 24.81 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 120.943 -1.098 . . . . 0.0 111.582 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.446 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 27.4 mm-40 -99.87 23.44 9.73 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.684 -1.26 . . . . 0.0 111.866 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.412 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 7.8 ttpt 75.99 72.49 0.08 Allowed 'General case' 0 N--CA 1.512 2.64 0 O-C-N 121.177 -0.952 . . . . 0.0 111.743 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.751 ' HE2' HD13 ' A' ' 23' ' ' LEU . 32.0 m-85 -134.54 -62.55 0.74 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.516 -0.74 . . . . 0.0 109.218 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.804 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -129.67 -179.7 5.33 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.424 -0.798 . . . . 0.0 109.6 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.467 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 7.3 t0 -131.09 127.82 38.95 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.075 -1.016 . . . . 0.0 110.627 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 8.9 mttp -75.09 -37.44 61.54 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.242 -0.911 . . . . 0.0 109.835 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.444 HD12 ' HA ' ' A' ' 90' ' ' LEU . 13.8 tp -60.27 -42.33 95.18 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.079 -1.013 . . . . 0.0 109.932 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.503 HD21 ' CD2' ' A' ' 57' ' ' HIS . 53.6 tp -69.02 -50.05 52.2 Favored 'General case' 0 N--CA 1.505 2.277 0 C-N-CA 119.151 -1.02 . . . . 0.0 108.849 179.24 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.459 HG22 ' HD2' ' A' ' 96' ' ' ARG . 60.7 mt -59.37 -36.56 64.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.426 0 C-N-CA 119.142 -1.023 . . . . 0.0 108.693 178.282 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.88 -39.32 90.58 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.145 -0.972 . . . . 0.0 109.068 178.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.419 ' HD2' ' CE1' ' A' ' 100' ' ' TYR . 9.8 mmtm -57.1 -45.3 83.49 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.105 -0.997 . . . . 0.0 109.268 179.142 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.7 m0 -62.62 -36.68 83.57 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.402 -0.811 . . . . 0.0 110.003 179.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.459 ' HD2' HG22 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -75.59 -33.4 60.58 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.063 -1.023 . . . . 0.0 110.649 179.736 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.6 mmtt -53.65 -176.99 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.743 0 O-C-N 121.032 -1.042 . . . . 0.0 110.613 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 31.2 m -103.14 133.52 48.11 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.26 -0.9 . . . . 0.0 109.748 179.202 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.84 11.29 53.71 Favored Glycine 0 N--CA 1.494 2.52 0 C-N-CA 120.233 -0.984 . . . . 0.0 111.043 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.559 ' HB3' HD23 ' A' ' 103' ' ' LEU . 53.6 m-85 -118.71 71.02 0.83 Allowed 'General case' 0 N--CA 1.494 1.731 0 CA-C-N 119.463 1.631 . . . . 0.0 109.68 179.6 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -98.23 -33.87 10.94 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.065 -1.022 . . . . 0.0 111.336 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.58 60.59 1.08 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.99 -1.069 . . . . 0.0 111.088 -179.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.559 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.4 pp -108.91 151.76 25.84 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.906 -1.121 . . . . 0.0 109.618 179.082 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.427 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.5 p -112.72 -28.1 7.91 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.173 -0.954 . . . . 0.0 113.521 -178.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.638 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.7 m -144.05 -168.5 2.88 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 120.094 -1.629 . . . . 0.0 109.955 179.217 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' A' ' 106' ' ' LEU . 12.5 mt -95.62 -38.76 10.24 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.219 -0.926 . . . . 0.0 109.884 178.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 32.6 ttm-85 -102.22 29.63 5.01 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.032 -1.042 . . . . 0.0 110.129 178.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.638 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.8 t -127.67 17.23 6.91 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.053 -1.03 . . . . 0.0 108.935 -179.533 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.498 HG22 ' HG3' ' A' ' 123' ' ' ARG . 1.1 pt -158.07 38.68 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.264 0 O-C-N 120.863 -1.148 . . . . 0.0 110.179 -178.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.762 ' C ' HG23 ' A' ' 119' ' ' THR . 7.8 mt-30 . . . . . 0 N--CA 1.506 2.347 0 O-C-N 120.884 -1.135 . . . . 0.0 110.829 -178.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.762 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.5 m . . . . . 0 N--CA 1.494 1.754 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.423 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 48.8 t -94.48 154.17 17.55 Favored 'General case' 0 N--CA 1.495 1.807 0 C-N-CA 119.505 -0.878 . . . . 0.0 108.853 178.522 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.962 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -74.9 -31.2 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.445 0 O-C-N 121.051 -1.03 . . . . 0.0 111.606 -178.803 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.483 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.2 p -59.12 -35.73 73.97 Favored 'General case' 0 N--CA 1.512 2.625 0 O-C-N 120.663 -1.273 . . . . 0.0 110.594 -179.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.498 ' HG3' HG22 ' A' ' 109' ' ' ILE . 13.4 ttt-85 -57.31 -33.34 67.58 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.997 -1.065 . . . . 0.0 109.979 178.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.3 t -79.58 123.97 83.95 Favored Pre-proline 0 N--CA 1.506 2.372 0 O-C-N 121.092 -1.005 . . . . 0.0 110.117 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -67.01 178.72 2.72 Favored 'Trans proline' 0 N--CA 1.489 1.212 0 O-C-N 123.164 1.086 . . . . 0.0 110.801 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 25.1 mmm-85 -75.14 -37.39 61.4 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.238 -0.914 . . . . 0.0 110.422 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.36 -40.91 79.07 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.048 -1.033 . . . . 0.0 110.062 -179.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -69.64 -41.95 74.9 Favored 'General case' 0 N--CA 1.504 2.267 0 C-N-CA 119.31 -0.956 . . . . 0.0 109.193 179.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.61 ' O ' HG11 ' A' ' 140' ' ' VAL . 5.5 mt -66.56 -39.1 88.36 Favored 'General case' 0 N--CA 1.504 2.269 0 C-N-CA 119.41 -0.916 . . . . 0.0 109.422 178.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -60.86 -38.54 85.94 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.168 -0.957 . . . . 0.0 109.936 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -59.64 -38.98 82.85 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.163 -0.96 . . . . 0.0 110.203 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -61.54 -46.46 89.85 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.126 -0.984 . . . . 0.0 109.722 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.458 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -62.12 -43.88 97.86 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.209 -0.932 . . . . 0.0 109.651 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.29 -32.65 70.24 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.171 -0.955 . . . . 0.0 110.358 179.533 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 40.4 mttt -80.72 -30.03 36.3 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.988 -1.07 . . . . 0.0 111.136 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 46.5 mttt -99.05 25.04 7.09 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 120.817 -1.177 . . . . 0.0 111.593 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.16 46.97 50.78 Favored Glycine 0 N--CA 1.5 2.951 0 O-C-N 120.702 -1.249 . . . . 0.0 110.82 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.458 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.6 t -149.54 -165.65 2.34 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.114 -1.227 . . . . 0.0 110.604 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -133.64 153.38 51.72 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.179 -0.951 . . . . 0.0 110.396 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.61 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.8 p -133.21 161.57 41.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 121.215 -0.928 . . . . 0.0 110.161 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 34.3 t -167.43 99.1 0.5 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.195 -0.94 . . . . 0.0 111.149 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.962 ' CD1' HD12 ' A' ' 121' ' ' ILE . 81.5 t80 -103.49 160.06 15.05 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.184 -0.947 . . . . 0.0 110.67 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 6.5 m80 -138.23 -60.3 0.62 Allowed 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -143.97 148.69 35.67 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.446 -0.784 . . . . 0.0 109.184 178.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . 0.408 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.8 p -90.21 154.35 19.81 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.997 -1.064 . . . . 0.0 111.131 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.7 p -73.01 -24.71 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.457 0 C-N-CA 119.788 -0.765 . . . . 0.0 111.474 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -49.9 -60.54 2.82 Favored 'General case' 0 N--CA 1.516 2.871 0 O-C-N 120.933 -1.104 . . . . 0.0 110.047 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.504 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.7 p -126.41 -164.7 1.36 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.313 -0.867 . . . . 0.0 110.291 179.262 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . 0.431 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -101.34 65.72 0.49 Allowed Glycine 0 N--CA 1.493 2.481 0 N-CA-C 107.831 -2.108 . . . . 0.0 107.831 178.296 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 31.8 t -103.64 142.78 33.72 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.397 -1.06 . . . . 0.0 109.965 -178.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 26.4 mtt-85 -98.55 49.04 0.98 Allowed 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.247 -0.908 . . . . 0.0 109.42 179.002 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 71.56 99.01 0.06 OUTLIER Glycine 0 N--CA 1.486 2.007 0 N-CA-C 109.749 -1.34 . . . . 0.0 109.749 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 p -110.63 126.02 54.04 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.31 -1.112 . . . . 0.0 110.335 179.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -146.3 146.42 30.7 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.087 -1.008 . . . . 0.0 110.141 -179.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.5 2.04 0 O-C-N 121.171 -0.955 . . . . 0.0 110.506 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.753 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.502 2.158 0 CA-C-O 120.343 0.116 . . . . 0.0 110.704 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -73.97 162.5 38.98 Favored 'Trans proline' 0 C--N 1.318 -1.038 0 O-C-N 123.152 1.08 . . . . 0.0 110.599 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -49.26 -31.68 9.34 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 121.351 -0.843 . . . . 0.0 111.329 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.04 -33.95 45.55 Favored Glycine 0 N--CA 1.498 2.808 0 O-C-N 120.961 -1.087 . . . . 0.0 110.695 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -54.65 -32.92 59.92 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 120.862 -1.375 . . . . 0.0 110.734 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -54.33 -38.16 65.69 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 121.083 -1.011 . . . . 0.0 110.256 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -58.15 -35.07 70.99 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.294 -0.879 . . . . 0.0 110.341 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.649 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.7 pt -117.62 35.71 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.157 -0.965 . . . . 0.0 110.604 179.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.427 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -83.36 -43.73 0.84 Allowed Pre-proline 0 N--CA 1.509 2.492 0 O-C-N 121.037 -1.039 . . . . 0.0 113.186 -179.286 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.9 Cg_endo -75.48 -36.9 2.03 Favored 'Trans proline' 0 N--CA 1.486 1.087 0 O-C-N 122.656 0.819 . . . . 0.0 111.666 -178.151 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.805 HG21 ' CE2' ' A' ' 62' ' ' TYR . 69.9 m -61.04 -44.91 96.69 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 121.036 -1.04 . . . . 0.0 109.879 -179.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.649 HD12 ' O ' ' A' ' 19' ' ' ILE . 2.5 mt -62.77 -38.31 90.12 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.428 -0.909 . . . . 0.0 109.676 179.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.8 m -56.85 -35.04 68.4 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.096 -1.002 . . . . 0.0 110.371 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -56.9 -38.68 73.17 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.054 -1.029 . . . . 0.0 110.001 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.746 ' CD2' HD22 ' A' ' 55' ' ' LEU . 22.3 m-85 -59.05 -40.08 84.02 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.228 -0.92 . . . . 0.0 110.028 179.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -61.05 -22.59 64.72 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.266 -0.896 . . . . 0.0 111.501 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.537 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.9 mp -80.84 -36.1 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.465 0 O-C-N 120.836 -1.165 . . . . 0.0 109.571 179.566 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.511 ' HG2' HD11 ' A' ' 55' ' ' LEU . 23.7 tt0 -80.77 -37.11 30.92 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.028 -1.045 . . . . 0.0 108.9 178.378 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.736 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.4 OUTLIER -72.21 -33.51 67.67 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.18 -0.95 . . . . 0.0 110.135 178.896 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.0 ptm180 -70.71 -37.3 73.52 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.884 -1.135 . . . . 0.0 109.791 179.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.1 -39.14 92.74 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.04 -1.038 . . . . 0.0 109.54 179.199 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.529 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -66.65 -40.77 88.82 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.218 -0.927 . . . . 0.0 109.516 179.344 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -59.14 -35.77 74.07 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.213 -0.93 . . . . 0.0 110.475 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.9 mttt -94.96 -36.17 11.69 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 121.068 -1.02 . . . . 0.0 110.925 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 . . . . . 0 N--CA 1.51 2.532 0 O-C-N 121.007 -1.058 . . . . 0.0 110.379 179.982 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.502 2.174 0 CA-C-O 120.625 0.25 . . . . 0.0 110.655 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -57.35 -36.54 71.32 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.112 -0.993 . . . . 0.0 110.34 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.423 ' HA ' ' CE3' ' A' ' 50' ' ' TRP . 16.9 mt-10 -58.11 -39.77 79.51 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.137 -0.977 . . . . 0.0 110.201 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 43.4 tp60 -63.22 -43.05 99.21 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.385 -0.926 . . . . 0.0 109.643 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.643 HD23 HD12 ' A' ' 52' ' ' ILE . 12.5 mt -58.76 -37.78 77.02 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.109 -0.995 . . . . 0.0 110.166 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.499 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.8 m0 -59.81 -37.54 79.44 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.17 -0.956 . . . . 0.0 109.955 179.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -60.65 -29.77 69.48 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.012 -1.055 . . . . 0.0 109.705 178.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.736 HG23 ' CG ' ' A' ' 30' ' ' LEU . 77.2 mt -70.63 -60.42 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.289 0 O-C-N 121.024 -1.048 . . . . 0.0 108.918 179.157 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.6 ptm -61.24 -29.94 70.14 Favored 'General case' 0 N--CA 1.509 2.478 0 C-N-CA 118.691 -1.204 . . . . 0.0 109.778 178.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -68.06 -37.6 81.49 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.909 -1.12 . . . . 0.0 109.208 178.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.746 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.4 mt -53.22 -33.26 52.1 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.959 -1.088 . . . . 0.0 110.211 179.069 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.459 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 8.2 t60 -55.12 -36.79 66.1 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.057 -1.027 . . . . 0.0 110.178 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.562 ' CD2' HD21 ' A' ' 91' ' ' LEU . 5.8 m170 -59.86 -49.62 77.0 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.086 -1.008 . . . . 0.0 109.365 179.167 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 -61.06 -37.7 83.57 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.324 -0.95 . . . . 0.0 109.17 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.443 ' HD2' ' CD2' ' A' ' 26' ' ' PHE . 6.9 mtp85 -62.23 -49.16 76.83 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.213 -0.929 . . . . 0.0 109.167 178.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 87.5 p -63.34 -39.02 93.39 Favored 'General case' 0 N--CA 1.504 2.233 0 C-N-CA 119.415 -0.914 . . . . 0.0 109.257 179.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 33.6 ttp85 -64.67 -40.49 95.51 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.145 -0.972 . . . . 0.0 109.117 178.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.805 ' CE2' HG21 ' A' ' 22' ' ' THR . 38.0 t80 -63.05 -50.88 68.88 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.192 -0.942 . . . . 0.0 109.319 179.295 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.594 HD12 ' HB2' ' A' ' 87' ' ' ALA . 84.0 mt -69.65 -38.16 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.436 0 C-N-CA 119.386 -0.926 . . . . 0.0 109.341 179.27 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.461 ' HD2' HD13 ' A' ' 92' ' ' ILE . 12.4 t80 -66.42 -42.83 87.18 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.103 -0.998 . . . . 0.0 108.989 179.018 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.402 ' HA ' ' CD ' ' A' ' 69' ' ' LYS . 91.2 m -60.83 -40.64 93.55 Favored 'General case' 0 N--CA 1.502 2.173 0 C-N-CA 119.335 -0.946 . . . . 0.0 110.482 -179.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.575 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.22 -34.55 25.85 Favored 'General case' 0 N--CA 1.504 2.245 0 C-N-CA 118.796 -1.162 . . . . 0.0 112.54 -178.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.537 ' N ' HD12 ' A' ' 66' ' ' LEU . 33.5 t80 -86.52 -32.2 20.87 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 120.622 -1.299 . . . . 0.0 112.184 -179.212 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -98.35 -18.06 18.52 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.774 -1.203 . . . . 0.0 113.152 -178.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.402 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 4.6 mtpp -115.85 -57.24 2.25 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 120.46 -1.4 . . . . 0.0 110.993 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.5 mtt85 -76.02 -30.11 58.35 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.173 -0.954 . . . . 0.0 110.761 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.3 tptt 59.96 45.08 12.65 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 120.827 -1.17 . . . . 0.0 109.969 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -107.68 34.97 3.27 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.372 -0.83 . . . . 0.0 109.48 178.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.81 HG13 HD23 ' A' ' 77' ' ' LEU . 13.0 tt -151.82 162.68 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.239 -0.913 . . . . 0.0 109.742 -179.683 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 78.3 p -107.23 145.52 32.57 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.088 -1.008 . . . . 0.0 110.02 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -45.36 -32.84 2.23 Favored 'General case' 0 N--CA 1.518 2.932 0 O-C-N 121.328 -0.858 . . . . 0.0 111.455 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -60.94 -48.69 80.66 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 120.93 -1.106 . . . . 0.0 109.32 179.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.81 HD23 HG13 ' A' ' 73' ' ' ILE . 47.3 tp -68.26 -44.41 75.68 Favored 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 119.171 -1.011 . . . . 0.0 108.337 178.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.43 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 15.3 t80 -59.51 -37.29 77.92 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.389 -0.819 . . . . 0.0 109.557 179.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.418 ' O ' HG22 ' A' ' 82' ' ' ILE . 22.9 t70 -76.08 -41.67 49.81 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.125 -0.985 . . . . 0.0 108.842 178.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.753 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 82.9 t90 -58.82 -37.96 77.56 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.135 -0.978 . . . . 0.0 109.198 178.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.549 HD23 ' CE2' ' A' ' 86' ' ' TYR . 11.9 mt -66.95 -58.04 5.75 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.223 -0.923 . . . . 0.0 108.984 178.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.549 HD12 ' HB3' ' A' ' 87' ' ' ALA . 0.6 OUTLIER -56.19 -27.19 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 121.223 -0.923 . . . . 0.0 110.767 -179.976 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.6 ttpm? -89.13 -16.69 30.85 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 120.915 -1.115 . . . . 0.0 111.905 179.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.448 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 43.4 mm-40 -105.46 25.63 10.47 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 120.622 -1.299 . . . . 0.0 111.982 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.403 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 0.8 OUTLIER 76.47 68.37 0.06 Allowed 'General case' 0 N--CA 1.512 2.67 0 O-C-N 121.265 -0.897 . . . . 0.0 111.959 179.413 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.608 ' HE2' HD13 ' A' ' 23' ' ' LEU . 27.3 m-85 -131.12 -62.71 0.88 Allowed 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.594 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -134.84 168.4 19.12 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.476 -0.765 . . . . 0.0 109.303 179.281 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.459 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 15.3 t0 -116.09 109.92 18.16 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.093 -1.004 . . . . 0.0 110.555 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.513 ' N ' HD11 ' A' ' 82' ' ' ILE . 17.8 mttt -58.95 -38.04 78.12 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.208 -0.933 . . . . 0.0 109.927 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.64 HD23 HD13 ' A' ' 106' ' ' LEU . 18.0 tp -58.51 -38.22 77.22 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.131 -0.981 . . . . 0.0 110.033 179.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.562 HD21 ' CD2' ' A' ' 57' ' ' HIS . 58.4 tp -69.46 -47.23 64.64 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 120.996 -1.065 . . . . 0.0 108.856 179.299 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.461 HD13 ' HD2' ' A' ' 64' ' ' TYR . 72.8 mt -59.65 -39.16 78.85 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.42 0 O-C-N 121.155 -0.966 . . . . 0.0 108.527 178.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.17 -39.68 93.24 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.139 -0.976 . . . . 0.0 109.196 178.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.428 ' HB3' HD22 ' A' ' 103' ' ' LEU . 6.1 mmtm -56.74 -41.82 78.19 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.069 -1.019 . . . . 0.0 109.578 179.269 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.4 m0 -64.48 -33.65 76.37 Favored 'General case' 0 N--CA 1.507 2.41 0 C-N-CA 119.514 -0.875 . . . . 0.0 110.355 179.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -81.81 -34.51 30.23 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.089 -1.007 . . . . 0.0 110.586 179.523 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 25.3 mmtt -50.72 175.11 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.787 0 O-C-N 120.973 -1.079 . . . . 0.0 110.833 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 13.1 t -100.65 141.39 33.59 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.181 -0.949 . . . . 0.0 109.695 179.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.72 -24.96 30.09 Favored Glycine 0 N--CA 1.494 2.556 0 C-N-CA 119.888 -1.149 . . . . 0.0 110.523 -179.202 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.624 ' HB3' HD23 ' A' ' 103' ' ' LEU . 65.5 m-85 -91.82 58.11 3.36 Favored 'General case' 0 N--CA 1.503 2.206 0 CA-C-N 119.171 1.486 . . . . 0.0 110.225 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -71.96 -37.19 69.98 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.029 -1.044 . . . . 0.0 110.141 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -124.81 85.38 2.4 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.127 -0.983 . . . . 0.0 110.361 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.624 HD23 ' HB3' ' A' ' 100' ' ' TYR . 0.5 OUTLIER -126.05 150.1 48.38 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.149 -0.97 . . . . 0.0 110.35 179.72 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.476 ' N ' HD12 ' A' ' 103' ' ' LEU . 27.0 p -114.37 -31.35 6.29 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.227 -0.92 . . . . 0.0 113.144 -179.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.644 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.0 m -142.59 -167.94 2.63 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.171 -1.581 . . . . 0.0 109.928 179.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.64 HD13 HD23 ' A' ' 90' ' ' LEU . 15.3 mt -96.09 -39.56 9.66 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.266 -0.896 . . . . 0.0 109.943 179.035 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 46.7 ttt-85 -101.98 29.68 4.89 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 120.961 -1.087 . . . . 0.0 110.134 178.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.644 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.296 1.8 t -126.07 16.63 7.88 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.025 -1.047 . . . . 0.0 108.925 -179.784 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.461 HG23 ' C ' ' A' ' 108' ' ' CYS . 1.5 pt -156.29 34.56 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.17 0 O-C-N 120.791 -1.193 . . . . 0.0 110.776 -178.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.716 ' C ' HG23 ' A' ' 119' ' ' THR . 5.8 mt-30 . . . . . 0 N--CA 1.497 1.924 0 O-C-N 120.795 -1.191 . . . . 0.0 111.122 -179.222 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.716 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.2 OUTLIER . . . . . 0 N--CA 1.497 1.902 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 41.6 t -62.56 152.93 33.49 Favored 'General case' 0 N--CA 1.505 2.275 0 C-N-CA 118.962 -1.095 . . . . 0.0 108.985 179.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.81 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -75.57 -36.1 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 121.022 -1.049 . . . . 0.0 111.39 -178.803 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.466 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 10.8 p -53.46 -32.34 49.6 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 120.785 -1.197 . . . . 0.0 111.362 -178.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.47 HH12 HG21 ' A' ' 119' ' ' THR . 0.0 OUTLIER -59.91 -34.28 73.0 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 120.842 -1.161 . . . . 0.0 109.526 178.316 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.625 HG12 ' HG ' ' A' ' 129' ' ' LEU . 56.1 t -82.34 125.42 76.62 Favored Pre-proline 0 N--CA 1.503 2.22 0 O-C-N 121.053 -1.03 . . . . 0.0 109.647 179.457 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.511 ' HD3' ' HB1' ' A' ' 154' ' ' ALA . 38.7 Cg_endo -65.56 179.85 1.51 Allowed 'Trans proline' 0 N--CA 1.489 1.226 0 O-C-N 123.159 1.084 . . . . 0.0 110.721 179.589 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 2.6 tpp85 -75.18 -35.93 61.52 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.201 -0.937 . . . . 0.0 110.953 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.42 -47.38 86.35 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.023 -1.048 . . . . 0.0 109.797 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -64.62 -41.53 96.13 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.219 -0.926 . . . . 0.0 109.263 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.625 ' HG ' HG12 ' A' ' 124' ' ' VAL . 52.3 mt -62.59 -39.26 93.18 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.285 -0.884 . . . . 0.0 109.672 179.363 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -59.26 -39.62 83.44 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.102 -0.999 . . . . 0.0 110.059 179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -57.98 -36.53 72.74 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.145 -0.972 . . . . 0.0 110.467 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -59.74 -39.55 85.13 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.169 -0.957 . . . . 0.0 110.27 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.653 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -60.89 -44.91 96.47 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.082 -1.011 . . . . 0.0 109.93 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 10.4 mmt85 -59.72 -38.78 82.62 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.142 -0.974 . . . . 0.0 109.886 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 76.1 mttt -58.9 -36.35 74.55 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.147 -0.971 . . . . 0.0 110.554 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 22.6 mtmt -107.37 21.53 17.36 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.002 -1.061 . . . . 0.0 111.797 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.76 46.04 60.18 Favored Glycine 0 N--CA 1.5 2.918 0 O-C-N 120.648 -1.282 . . . . 0.0 110.545 179.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.653 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.9 t -140.6 -165.18 1.88 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.105 -1.232 . . . . 0.0 110.154 179.747 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -127.41 173.59 9.69 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.154 -0.966 . . . . 0.0 110.354 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.2 p -159.1 160.71 1.8 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.975 0 O-C-N 121.225 -0.922 . . . . 0.0 110.774 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 28.3 t -168.95 85.18 0.15 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.215 -0.928 . . . . 0.0 110.995 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.775 ' CG ' HD12 ' A' ' 121' ' ' ILE . 50.9 t80 -95.61 160.92 14.27 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.243 -0.911 . . . . 0.0 110.538 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 38.0 m80 -140.49 -60.54 0.51 Allowed 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.007 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -131.78 151.83 51.39 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.404 -0.81 . . . . 0.0 109.095 178.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . 0.404 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.8 p -95.57 153.65 17.6 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.027 -1.045 . . . . 0.0 110.96 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 27.3 m -71.98 -25.49 23.97 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.461 0 O-C-N 121.432 -0.793 . . . . 0.0 111.595 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -50.34 -61.67 2.04 Favored 'General case' 0 N--CA 1.514 2.748 0 O-C-N 120.888 -1.133 . . . . 0.0 110.336 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.499 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.3 p -124.56 -164.46 1.27 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.183 -0.948 . . . . 0.0 110.544 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.0 60.45 0.72 Allowed Glycine 0 N--CA 1.492 2.431 0 N-CA-C 108.13 -1.988 . . . . 0.0 108.13 178.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 28.4 t -102.26 142.44 33.48 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.333 -1.098 . . . . 0.0 109.818 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 6.2 mtt85 -99.04 49.04 0.96 Allowed 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.272 -0.892 . . . . 0.0 109.613 179.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 73.15 96.55 0.08 OUTLIER Glycine 0 N--CA 1.488 2.163 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.0 p -108.68 126.22 52.74 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.205 -1.174 . . . . 0.0 110.32 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . 0.511 ' HB1' ' HD3' ' A' ' 125' ' ' PRO . . . -152.77 148.93 27.81 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.098 -1.001 . . . . 0.0 110.467 -179.402 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 3.5 m . . . . . 0 N--CA 1.503 2.217 0 O-C-N 121.328 -0.857 . . . . 0.0 110.572 -179.976 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.843 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.512 2.631 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -84.36 82.68 1.8 Allowed 'Trans proline' 0 C--N 1.32 -0.922 0 O-C-N 123.129 1.068 . . . . 0.0 112.422 -178.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 48.73 92.67 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.258 -0.901 . . . . 0.0 111.737 178.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.73 -39.05 0.51 Allowed Glycine 0 N--CA 1.499 2.886 0 C-N-CA 119.792 -1.194 . . . . 0.0 110.538 179.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.605 ' N ' HD21 ' A' ' 77' ' ' LEU . 19.2 t80 -57.03 -29.74 63.63 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.063 -1.257 . . . . 0.0 110.462 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -52.86 -34.53 54.84 Favored 'General case' 0 N--CA 1.511 2.608 0 O-C-N 120.889 -1.132 . . . . 0.0 110.156 179.259 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.1 mtpp -58.73 -38.61 78.75 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.181 -0.949 . . . . 0.0 110.144 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.57 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.8 pt -116.74 36.58 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.17 -0.956 . . . . 0.0 110.43 179.765 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.423 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -84.08 -43.24 0.76 Allowed Pre-proline 0 N--CA 1.511 2.579 0 O-C-N 121.056 -1.028 . . . . 0.0 113.531 -178.804 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.2 Cg_endo -74.27 -34.55 4.66 Favored 'Trans proline' 0 N--CA 1.487 1.09 0 O-C-N 122.587 0.783 . . . . 0.0 112.043 -177.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.783 HG21 ' CE2' ' A' ' 62' ' ' TYR . 84.1 m -60.91 -43.56 98.4 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 120.973 -1.08 . . . . 0.0 110.071 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.57 HD12 ' O ' ' A' ' 19' ' ' ILE . 0.4 OUTLIER -63.46 -39.11 93.59 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.224 -0.923 . . . . 0.0 109.792 179.67 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -57.42 -35.04 69.55 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.102 -0.999 . . . . 0.0 110.29 179.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -57.31 -35.94 70.47 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.038 -1.039 . . . . 0.0 110.311 179.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.668 ' CD2' HD22 ' A' ' 55' ' ' LEU . 16.1 m-85 -57.67 -39.35 76.89 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.094 -1.003 . . . . 0.0 110.48 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -58.66 -39.69 81.36 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.223 -0.923 . . . . 0.0 110.487 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.42 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.1 mp -65.72 -41.1 89.68 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 C-N-CA 119.221 -0.992 . . . . 0.0 108.83 179.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -70.49 -49.59 46.81 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.198 -1.001 . . . . 0.0 108.619 178.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.048 HD11 HG23 ' A' ' 52' ' ' ILE . 0.9 OUTLIER -59.84 -34.46 73.13 Favored 'General case' 0 N--CA 1.507 2.42 0 C-N-CA 119.376 -0.929 . . . . 0.0 109.558 178.508 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 3.7 mtt85 -56.91 -39.63 74.78 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.041 -1.037 . . . . 0.0 110.071 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.48 -47.86 77.37 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.206 -0.997 . . . . 0.0 109.754 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.437 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -69.6 -37.93 77.08 Favored 'General case' 0 N--CA 1.504 2.265 0 C-N-CA 119.225 -0.99 . . . . 0.0 109.512 179.121 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 13.5 mt-30 -66.63 -32.73 74.25 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.222 -0.924 . . . . 0.0 110.277 179.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.1 mttp -95.05 -35.03 12.09 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 120.962 -1.086 . . . . 0.0 110.921 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 11.7 t70 . . . . . 0 N--CA 1.511 2.587 0 O-C-N 120.988 -1.07 . . . . 0.0 110.261 -179.934 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.502 2.151 0 CA-C-O 120.598 0.237 . . . . 0.0 110.488 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -58.63 -39.67 81.16 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.109 -0.994 . . . . 0.0 110.048 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -62.73 -42.5 99.69 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.266 -0.896 . . . . 0.0 109.829 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 58.1 tp60 -60.42 -39.26 86.78 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.168 -0.957 . . . . 0.0 109.872 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -57.85 -38.43 75.65 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.122 -0.986 . . . . 0.0 110.062 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.499 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.1 m0 -58.01 -36.12 72.24 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.157 -0.964 . . . . 0.0 109.989 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -61.95 -29.28 70.13 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.064 -1.022 . . . . 0.0 109.79 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 1.048 HG23 HD11 ' A' ' 30' ' ' LEU . 22.1 mt -72.26 -59.28 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.201 0 O-C-N 120.942 -1.099 . . . . 0.0 109.181 179.429 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.6 ptm -58.85 -27.89 65.56 Favored 'General case' 0 N--CA 1.511 2.6 0 C-N-CA 118.45 -1.3 . . . . 0.0 109.827 178.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.5 mm100 -69.86 -37.66 76.18 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 120.823 -1.173 . . . . 0.0 109.05 177.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.668 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.2 mt -53.36 -32.61 50.09 Favored 'General case' 0 N--CA 1.512 2.65 0 O-C-N 120.951 -1.093 . . . . 0.0 110.128 179.007 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.439 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 23.0 t60 -55.83 -36.82 67.9 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.145 -0.972 . . . . 0.0 110.198 179.73 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.424 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 7.4 m170 -59.64 -48.9 79.86 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.095 -1.003 . . . . 0.0 109.387 179.237 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.2 tp60 -58.37 -34.19 70.42 Favored 'General case' 0 N--CA 1.508 2.435 0 C-N-CA 119.461 -0.896 . . . . 0.0 109.573 178.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.467 ' HD3' ' CD1' ' A' ' 26' ' ' PHE . 38.8 mmm-85 -64.77 -52.87 54.64 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.031 -1.043 . . . . 0.0 109.28 179.066 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 84.5 p -64.02 -40.04 95.44 Favored 'General case' 0 N--CA 1.503 2.187 0 C-N-CA 119.3 -0.96 . . . . 0.0 108.997 179.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.423 ' HD3' ' OG1' ' A' ' 65' ' ' THR . 0.1 OUTLIER -63.11 -40.17 96.84 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.197 -0.939 . . . . 0.0 109.051 178.856 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.783 ' CE2' HG21 ' A' ' 22' ' ' THR . 30.5 t80 -63.58 -53.33 53.33 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.098 -1.001 . . . . 0.0 109.009 179.212 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.903 HD12 ' HB2' ' A' ' 87' ' ' ALA . 75.8 mt -65.64 -37.18 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.333 0 C-N-CA 119.223 -0.991 . . . . 0.0 109.19 179.307 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.438 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 8.1 t80 -66.03 -41.55 90.77 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.059 -1.026 . . . . 0.0 108.778 178.704 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.423 ' OG1' ' HD3' ' A' ' 61' ' ' ARG . 91.7 m -59.28 -41.44 88.92 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.211 -0.931 . . . . 0.0 110.806 -179.453 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.633 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.06 -34.9 26.1 Favored 'General case' 0 N--CA 1.505 2.282 0 C-N-CA 118.764 -1.174 . . . . 0.0 112.823 -178.523 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.56 ' N ' HD12 ' A' ' 66' ' ' LEU . 52.0 t80 -86.27 -32.02 21.32 Favored 'General case' 0 N--CA 1.514 2.751 0 O-C-N 120.564 -1.335 . . . . 0.0 111.961 -179.345 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.438 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 11.8 m-85 -97.05 -16.82 20.36 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 120.729 -1.232 . . . . 0.0 112.584 -178.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.419 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 5.8 mttt -124.74 -59.6 1.43 Allowed 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.495 -1.378 . . . . 0.0 110.996 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.406 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 5.2 ttt85 -59.94 -30.38 69.03 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.03 -1.044 . . . . 0.0 110.906 -179.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 27.2 tptt 57.1 41.2 27.69 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.803 -1.185 . . . . 0.0 110.131 -179.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.06 37.47 3.66 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.399 -0.813 . . . . 0.0 109.725 179.375 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.633 HG21 ' CD1' ' A' ' 66' ' ' LEU . 13.7 tt -154.23 162.77 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 121.249 -0.907 . . . . 0.0 109.904 -179.73 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 4.9 p -110.08 149.7 29.65 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.092 -1.005 . . . . 0.0 110.354 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 71.5 tttt -45.79 -32.35 2.5 Favored 'General case' 0 N--CA 1.515 2.799 0 O-C-N 121.338 -0.851 . . . . 0.0 111.596 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -65.49 -47.02 77.48 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 120.846 -1.159 . . . . 0.0 109.51 179.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.605 HD21 ' N ' ' A' ' 16' ' ' PHE . 0.3 OUTLIER -67.48 -41.61 84.27 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.183 -0.948 . . . . 0.0 108.727 179.02 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.453 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 14.6 t80 -67.85 -41.07 83.51 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.265 -0.897 . . . . 0.0 109.188 179.135 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -72.11 -40.7 67.98 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.19 -0.944 . . . . 0.0 108.795 178.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.843 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 80.5 t90 -55.11 -37.92 67.49 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.265 -0.897 . . . . 0.0 109.532 178.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.545 HD22 ' CD2' ' A' ' 86' ' ' TYR . 17.1 mt -69.69 -48.84 58.27 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 119.344 -0.942 . . . . 0.0 108.561 178.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.558 HD12 ' HG3' ' A' ' 89' ' ' LYS . 35.4 mm -57.4 -32.72 42.1 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.573 0 O-C-N 121.281 -0.887 . . . . 0.0 109.904 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.8 tttt -86.87 -23.9 25.09 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.952 -1.092 . . . . 0.0 111.589 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.428 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 16.7 mm-40 -97.39 19.4 13.31 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 120.707 -1.246 . . . . 0.0 111.948 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 28.2 tttt 73.38 80.53 0.13 Allowed 'General case' 0 N--CA 1.51 2.565 0 O-C-N 120.914 -1.116 . . . . 0.0 111.327 179.268 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.545 ' CD2' HD22 ' A' ' 81' ' ' LEU . 29.3 m-85 -137.24 -64.03 0.58 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.546 -0.722 . . . . 0.0 109.932 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.903 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -118.31 -172.55 2.29 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.419 -0.8 . . . . 0.0 109.593 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.439 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 7.1 t0 -122.56 102.77 8.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.058 -1.026 . . . . 0.0 110.373 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.558 ' HG3' HD12 ' A' ' 82' ' ' ILE . 12.0 mtpt -64.35 -40.19 95.38 Favored 'General case' 0 N--CA 1.508 2.429 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.63 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.574 HD23 HD13 ' A' ' 106' ' ' LEU . 32.4 tp -59.78 -37.21 78.44 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.23 -0.918 . . . . 0.0 110.056 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.564 HD21 ' CH2' ' A' ' 95' ' ' TRP . 34.3 tp -71.73 -48.16 48.86 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.005 -1.059 . . . . 0.0 108.756 179.142 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.485 HG22 ' HD2' ' A' ' 96' ' ' ARG . 50.7 mt -58.86 -36.19 60.01 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 C-N-CA 119.378 -0.929 . . . . 0.0 108.7 178.293 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.94 -39.48 83.44 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.128 -0.983 . . . . 0.0 109.062 178.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.427 ' HB3' ' CD2' ' A' ' 103' ' ' LEU . 7.1 mmtt -58.49 -44.35 89.34 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.139 -0.975 . . . . 0.0 109.364 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.564 ' CH2' HD21 ' A' ' 91' ' ' LEU . 7.8 m0 -65.72 -41.19 92.58 Favored 'General case' 0 N--CA 1.507 2.406 0 C-N-CA 119.557 -0.857 . . . . 0.0 109.506 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.485 ' HD2' HG22 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -65.71 -33.29 75.53 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.283 -0.885 . . . . 0.0 110.425 179.479 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.1 mmtp -54.31 -176.78 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.646 0 O-C-N 121.056 -1.028 . . . . 0.0 110.535 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 32.1 m -105.87 132.75 51.61 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.172 -0.955 . . . . 0.0 109.85 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 98.57 10.92 49.23 Favored Glycine 0 N--CA 1.492 2.427 0 C-N-CA 120.213 -0.994 . . . . 0.0 111.087 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -115.97 69.51 0.74 Allowed 'General case' 0 N--CA 1.495 1.778 0 CA-C-N 119.487 1.644 . . . . 0.0 110.117 179.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -92.08 -38.95 11.89 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.221 -0.924 . . . . 0.0 109.96 179.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -110.15 78.5 1.13 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.151 -0.968 . . . . 0.0 109.61 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.937 HD13 HD13 ' A' ' 109' ' ' ILE . 8.9 tp -122.23 137.87 54.69 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.242 -0.911 . . . . 0.0 109.823 -179.24 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.424 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 28.1 p -111.61 -38.6 4.86 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.234 -0.916 . . . . 0.0 112.483 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.821 ' O ' HD11 ' A' ' 103' ' ' LEU . 6.9 m -138.76 -168.49 2.42 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.17 -1.581 . . . . 0.0 109.85 179.077 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.574 HD13 HD23 ' A' ' 90' ' ' LEU . 13.9 mt -97.48 -38.15 9.7 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.177 -0.952 . . . . 0.0 110.295 179.189 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -102.2 31.34 4.02 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 120.953 -1.092 . . . . 0.0 109.804 178.221 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.676 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.7 t -125.86 16.28 8.01 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.131 -0.981 . . . . 0.0 108.929 -179.592 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.937 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -159.01 38.01 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.38 0 O-C-N 120.922 -1.111 . . . . 0.0 110.4 -178.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.575 ' O ' HG23 ' A' ' 119' ' ' THR . 2.0 tt0 . . . . . 0 N--CA 1.499 2.006 0 O-C-N 120.739 -1.226 . . . . 0.0 111.698 -178.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.575 HG23 ' O ' ' A' ' 110' ' ' GLN . 4.4 m . . . . . 0 N--CA 1.495 1.779 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 48.6 t -87.17 154.15 20.95 Favored 'General case' 0 N--CA 1.499 2.017 0 C-N-CA 119.499 -0.88 . . . . 0.0 109.202 179.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.804 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -72.64 -36.11 52.46 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.433 0 O-C-N 121.16 -0.962 . . . . 0.0 111.012 -179.225 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 7.9 p -55.46 -34.32 64.42 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 120.846 -1.158 . . . . 0.0 110.911 -178.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.481 ' HG3' HG22 ' A' ' 109' ' ' ILE . 16.8 ttt-85 -59.32 -36.43 75.62 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 120.995 -1.066 . . . . 0.0 109.681 178.435 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 61.0 t -76.19 125.42 87.87 Favored Pre-proline 0 N--CA 1.504 2.24 0 O-C-N 121.171 -0.956 . . . . 0.0 109.795 179.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.495 ' O ' HD12 ' A' ' 129' ' ' LEU . 37.5 Cg_endo -64.02 178.2 1.59 Allowed 'Trans proline' 0 N--CA 1.49 1.283 0 O-C-N 123.228 1.12 . . . . 0.0 110.791 179.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.09 -37.27 61.61 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.22 -0.925 . . . . 0.0 110.635 -179.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.41 -41.64 85.4 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.013 -1.054 . . . . 0.0 109.929 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 37.3 tp60 -68.8 -41.44 78.69 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 119.395 -0.922 . . . . 0.0 109.103 179.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.62 HD11 HD11 ' A' ' 121' ' ' ILE . 3.9 mt -62.54 -38.69 90.99 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.288 -0.883 . . . . 0.0 109.757 179.306 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -60.2 -39.83 87.97 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.193 -0.942 . . . . 0.0 109.971 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -58.08 -35.88 72.03 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.151 -0.968 . . . . 0.0 110.475 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -59.98 -40.99 91.03 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.152 -0.968 . . . . 0.0 110.164 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.705 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -61.72 -45.02 95.76 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.144 -0.972 . . . . 0.0 109.798 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 15.2 mtp85 -58.69 -38.7 78.82 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.208 -0.932 . . . . 0.0 109.929 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -58.01 -36.38 72.59 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.17 -0.956 . . . . 0.0 110.486 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 2.6 mtpm? -107.82 21.08 17.94 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.008 -1.057 . . . . 0.0 111.806 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 53.88 45.87 69.62 Favored Glycine 0 N--CA 1.499 2.85 0 O-C-N 120.572 -1.33 . . . . 0.0 110.467 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.705 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.7 t -141.68 -164.36 1.76 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.217 -1.167 . . . . 0.0 110.145 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -130.46 155.1 47.01 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.12 -0.988 . . . . 0.0 110.237 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.512 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.4 p -131.51 161.52 41.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.213 -0.929 . . . . 0.0 110.148 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 31.2 t -165.53 86.01 0.37 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.24 -0.913 . . . . 0.0 111.087 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.764 ' CG ' HD12 ' A' ' 121' ' ' ILE . 52.0 t80 -97.26 159.57 14.84 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.216 -0.927 . . . . 0.0 110.382 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 22.5 m80 -138.08 -61.13 0.62 Allowed 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 179.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -133.73 151.01 51.5 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.418 -0.801 . . . . 0.0 108.93 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . 0.402 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.6 p -91.98 152.53 19.97 Favored 'General case' 0 N--CA 1.505 2.285 0 C-N-CA 119.063 -1.055 . . . . 0.0 111.142 -179.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 23.2 m -69.71 -26.46 30.69 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.449 0 C-N-CA 119.748 -0.781 . . . . 0.0 111.347 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.1 m-70 -50.91 -60.18 3.35 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 120.84 -1.163 . . . . 0.0 110.142 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.499 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 25.7 p -126.82 -167.41 1.72 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.3 -0.875 . . . . 0.0 110.797 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . 0.404 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -98.98 58.17 0.89 Allowed Glycine 0 N--CA 1.491 2.346 0 N-CA-C 108.04 -2.024 . . . . 0.0 108.04 178.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 16.8 t -99.67 145.97 27.01 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.442 -1.034 . . . . 0.0 109.755 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 4.9 ttm-85 -97.83 50.79 1.04 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.226 -0.922 . . . . 0.0 109.318 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.31 97.33 0.03 OUTLIER Glycine 0 N--CA 1.486 2.019 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.1 p -109.09 128.23 54.81 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.293 -1.122 . . . . 0.0 110.327 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -143.02 130.23 20.87 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.069 -1.02 . . . . 0.0 110.099 -179.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.502 2.151 0 O-C-N 121.17 -0.957 . . . . 0.0 110.606 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.676 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.504 2.269 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -71.95 166.41 29.65 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 O-C-N 123.308 1.162 . . . . 0.0 110.835 -179.667 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -47.97 -31.93 5.87 Favored 'General case' 0 N--CA 1.515 2.825 0 O-C-N 121.507 -0.745 . . . . 0.0 111.529 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.49 -34.46 34.74 Favored Glycine 0 N--CA 1.5 2.931 0 O-C-N 120.96 -1.087 . . . . 0.0 110.585 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.405 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 26.0 t80 -55.56 -33.27 63.72 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 120.938 -1.33 . . . . 0.0 110.555 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -54.32 -37.8 65.26 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.046 -1.034 . . . . 0.0 110.167 179.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.5 mtpt -57.4 -36.56 71.44 Favored 'General case' 0 N--CA 1.511 2.585 0 O-C-N 121.298 -0.877 . . . . 0.0 110.117 179.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.743 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.8 pt -118.69 35.28 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.2 -0.937 . . . . 0.0 110.388 179.453 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -83.73 -43.37 0.8 Allowed Pre-proline 0 N--CA 1.508 2.457 0 O-C-N 120.976 -1.077 . . . . 0.0 113.105 -179.087 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.8 Cg_endo -76.27 -36.4 1.85 Allowed 'Trans proline' 0 N--CA 1.487 1.113 0 O-C-N 122.583 0.78 . . . . 0.0 111.506 -178.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.825 HG21 ' CE2' ' A' ' 62' ' ' TYR . 78.5 m -59.8 -42.92 94.5 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.02 -1.05 . . . . 0.0 110.092 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.743 HD12 ' O ' ' A' ' 19' ' ' ILE . 2.7 mt -64.37 -39.84 94.66 Favored 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.672 179.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -57.97 -35.27 70.93 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.107 -0.996 . . . . 0.0 110.228 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -56.22 -34.52 66.4 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.127 -0.983 . . . . 0.0 110.528 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.669 ' CD1' HD22 ' A' ' 55' ' ' LEU . 13.9 m-85 -58.52 -40.35 82.65 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.037 -1.04 . . . . 0.0 110.642 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -60.41 -39.93 89.16 Favored 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.653 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.425 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.2 mp -66.08 -39.96 85.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.381 0 C-N-CA 119.195 -1.002 . . . . 0.0 109.126 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -70.34 -49.15 52.32 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.081 -1.012 . . . . 0.0 108.689 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.665 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -62.91 -32.94 74.33 Favored 'General case' 0 N--CA 1.508 2.433 0 C-N-CA 119.229 -0.988 . . . . 0.0 108.926 178.186 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 23.1 mtt180 -56.9 -40.31 76.04 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.009 -1.057 . . . . 0.0 110.018 179.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -62.9 -51.09 68.32 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.252 -0.979 . . . . 0.0 109.417 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.585 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -65.75 -40.35 92.0 Favored 'General case' 0 N--CA 1.504 2.263 0 C-N-CA 119.227 -0.989 . . . . 0.0 109.11 179.038 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.439 ' CG ' HD23 ' A' ' 30' ' ' LEU . 5.4 mm100 -62.74 -38.59 91.13 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.178 -0.951 . . . . 0.0 109.641 179.398 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.0 mmtm -60.5 -39.26 87.1 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.134 -0.979 . . . . 0.0 110.02 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 . . . . . 0 N--CA 1.51 2.534 0 O-C-N 121.142 -0.973 . . . . 0.0 110.114 179.867 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.9 p . . . . . 0 N--CA 1.498 1.961 0 CA-C-O 120.629 0.252 . . . . 0.0 110.553 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -55.91 -37.97 69.62 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.163 -0.96 . . . . 0.0 110.142 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -61.01 -40.96 95.55 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.17 -0.957 . . . . 0.0 109.823 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -62.64 -40.23 96.37 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.195 -0.941 . . . . 0.0 109.82 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.477 HD23 HD12 ' A' ' 52' ' ' ILE . 12.5 mt -59.46 -38.03 79.69 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.203 -0.935 . . . . 0.0 110.26 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.492 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.5 m0 -58.36 -36.67 73.81 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.038 -1.039 . . . . 0.0 110.127 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -62.33 -30.34 71.09 Favored 'General case' 0 N--CA 1.506 2.327 0 C-N-CA 119.204 -0.998 . . . . 0.0 109.983 178.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.665 HG23 ' CG ' ' A' ' 30' ' ' LEU . 69.6 mt -71.91 -57.09 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.269 0 O-C-N 120.913 -1.117 . . . . 0.0 109.466 179.526 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.5 ptm -61.13 -29.48 69.8 Favored 'General case' 0 N--CA 1.509 2.49 0 C-N-CA 118.414 -1.314 . . . . 0.0 109.704 178.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -67.82 -37.42 81.93 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.841 -1.162 . . . . 0.0 109.09 178.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.669 HD22 ' CD1' ' A' ' 26' ' ' PHE . 11.0 mt -53.15 -31.87 44.72 Favored 'General case' 0 N--CA 1.512 2.636 0 O-C-N 120.965 -1.084 . . . . 0.0 110.169 178.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.466 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 70.6 t60 -54.79 -39.3 68.29 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.038 -1.038 . . . . 0.0 109.828 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.51 ' CD2' HD21 ' A' ' 91' ' ' LEU . 5.7 m170 -59.49 -46.61 88.31 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.158 -0.964 . . . . 0.0 109.404 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.9 tp-100 -59.44 -34.93 73.11 Favored 'General case' 0 N--CA 1.506 2.349 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.489 178.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.446 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 8.2 mmm-85 -65.39 -53.33 44.86 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.041 -1.037 . . . . 0.0 109.194 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 12.3 p -61.65 -38.58 88.23 Favored 'General case' 0 N--CA 1.505 2.277 0 C-N-CA 119.3 -0.96 . . . . 0.0 109.357 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.426 ' O ' ' OG1' ' A' ' 65' ' ' THR . 6.3 ttt85 -65.1 -41.37 95.02 Favored 'General case' 0 N--CA 1.504 2.259 0 C-N-CA 119.216 -0.993 . . . . 0.0 109.221 179.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.825 ' CE2' HG21 ' A' ' 22' ' ' THR . 40.1 t80 -62.62 -49.54 74.8 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.17 -0.956 . . . . 0.0 109.547 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.751 HD12 ' HB2' ' A' ' 87' ' ' ALA . 85.4 mt -71.85 -38.85 66.62 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.327 0 O-C-N 121.204 -0.935 . . . . 0.0 109.448 179.564 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.405 ' HD2' HD13 ' A' ' 92' ' ' ILE . 9.4 t80 -66.03 -42.25 89.86 Favored 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.107 -0.996 . . . . 0.0 108.832 178.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.426 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 91.6 m -60.97 -42.17 97.78 Favored 'General case' 0 N--CA 1.504 2.239 0 C-N-CA 119.253 -0.979 . . . . 0.0 110.171 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.567 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.1 -33.11 26.42 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.962 -1.086 . . . . 0.0 112.474 -178.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.495 ' N ' HD12 ' A' ' 66' ' ' LEU . 36.3 t80 -86.33 -32.86 20.78 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 120.554 -1.341 . . . . 0.0 111.896 -179.158 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -97.54 -21.1 17.29 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 120.878 -1.138 . . . . 0.0 112.527 -178.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.414 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 6.9 mtpt -118.3 -59.65 1.87 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 120.56 -1.337 . . . . 0.0 110.808 179.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.415 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 11.3 ttt85 -62.16 -29.7 70.54 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.129 -0.982 . . . . 0.0 110.865 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.2 mtpt 56.27 42.32 28.06 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.938 -1.102 . . . . 0.0 110.171 -179.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.51 35.6 3.95 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.444 -0.785 . . . . 0.0 110.0 179.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.776 HG13 HD23 ' A' ' 77' ' ' LEU . 14.1 tt -153.87 162.27 2.14 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.202 -0.936 . . . . 0.0 109.974 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 50.4 m -110.0 148.29 31.94 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.181 -0.95 . . . . 0.0 110.136 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.2 tttm -46.77 -31.72 3.18 Favored 'General case' 0 N--CA 1.515 2.781 0 O-C-N 121.302 -0.874 . . . . 0.0 111.55 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -62.88 -52.01 64.74 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 120.836 -1.165 . . . . 0.0 109.261 179.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.776 HD23 HG13 ' A' ' 73' ' ' ILE . 22.4 tp -64.76 -45.68 85.36 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 119.232 -0.987 . . . . 0.0 108.469 178.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.759 ' HA ' HD12 ' A' ' 81' ' ' LEU . 11.8 t80 -59.3 -40.84 87.47 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.337 -0.852 . . . . 0.0 109.424 179.177 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -71.65 -43.14 66.61 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.178 -0.951 . . . . 0.0 108.506 178.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.676 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 88.7 t90 -57.0 -34.68 68.38 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.229 -0.92 . . . . 0.0 109.353 178.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.759 HD12 ' HA ' ' A' ' 78' ' ' TYR . 11.3 mt -67.11 -59.89 3.08 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.115 -0.991 . . . . 0.0 108.889 179.012 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.423 HG13 ' HB3' ' A' ' 87' ' ' ALA . 5.4 mt -57.97 -26.51 28.86 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.555 0 O-C-N 120.941 -1.1 . . . . 0.0 110.035 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.9 tttp -80.03 -19.07 48.53 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 120.869 -1.144 . . . . 0.0 110.853 178.323 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.442 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 8.3 mm-40 -108.47 23.11 14.99 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 120.752 -1.217 . . . . 0.0 111.984 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.415 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 1.5 tmtt? 76.83 69.82 0.06 Allowed 'General case' 0 N--CA 1.515 2.794 0 O-C-N 121.148 -0.97 . . . . 0.0 111.882 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.678 ' HE2' HD13 ' A' ' 23' ' ' LEU . 21.8 m-85 -130.95 -62.34 0.9 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.488 -0.758 . . . . 0.0 109.215 179.354 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.751 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -127.75 166.99 17.11 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.458 -0.776 . . . . 0.0 109.812 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.466 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 19.1 t0 -115.41 109.45 17.89 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.231 -0.918 . . . . 0.0 110.156 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.44 -38.09 73.87 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.216 -0.927 . . . . 0.0 110.171 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.46 HD23 HD22 ' A' ' 106' ' ' LEU . 11.2 tp -59.52 -38.77 81.85 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.178 -0.951 . . . . 0.0 110.179 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.51 HD21 ' CD2' ' A' ' 57' ' ' HIS . 55.6 tp -68.32 -50.02 56.3 Favored 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 119.17 -1.012 . . . . 0.0 109.164 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.405 HD13 ' HD2' ' A' ' 64' ' ' TYR . 68.9 mt -60.94 -37.57 77.32 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 C-N-CA 119.117 -1.033 . . . . 0.0 108.817 178.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.81 -38.67 86.92 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.082 -1.011 . . . . 0.0 109.086 178.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.484 ' HB3' HD22 ' A' ' 103' ' ' LEU . 9.7 mmtm -58.3 -44.85 88.74 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.105 -0.997 . . . . 0.0 109.565 179.345 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 3.2 m0 -60.68 -35.86 77.31 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.317 -0.865 . . . . 0.0 110.053 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.83 -32.79 40.64 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.105 -0.997 . . . . 0.0 110.491 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 10.3 mmtp -51.66 177.93 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.728 0 O-C-N 120.952 -1.092 . . . . 0.0 110.841 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 3.5 m -105.4 141.77 36.33 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.22 -0.925 . . . . 0.0 109.39 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 103.68 -29.15 12.78 Favored Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.896 -1.282 . . . . 0.0 109.896 -179.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.603 ' HB3' HD23 ' A' ' 103' ' ' LEU . 55.9 m-85 -92.98 57.76 2.84 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 120.906 -1.349 . . . . 0.0 109.986 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.425 ' HB2' ' OG ' ' A' ' 155' ' ' SER . 5.4 mt-10 -63.02 -37.73 88.34 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 120.972 -1.08 . . . . 0.0 110.287 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -131.91 83.25 2.07 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.071 -1.018 . . . . 0.0 110.636 -179.781 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.603 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.2 pp -114.49 147.51 39.23 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.243 -0.911 . . . . 0.0 109.951 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.428 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.4 p -109.22 -27.63 9.45 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.215 -0.928 . . . . 0.0 113.003 -179.383 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.654 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 11.5 m -143.73 -167.72 2.66 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.202 -1.562 . . . . 0.0 109.789 179.107 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.46 HD22 HD23 ' A' ' 90' ' ' LEU . 13.2 mt -95.97 -38.54 10.19 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.149 -0.97 . . . . 0.0 110.098 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 22.6 ttt180 -103.37 31.73 4.18 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 120.972 -1.08 . . . . 0.0 109.876 178.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.654 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.7 t -128.38 19.44 6.32 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.266 -0.897 . . . . 0.0 108.733 -179.632 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.497 HG22 ' HG3' ' A' ' 123' ' ' ARG . 1.4 pt -158.34 39.01 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.345 0 O-C-N 120.974 -1.079 . . . . 0.0 110.064 -178.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.795 ' C ' HG23 ' A' ' 119' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.506 2.335 0 O-C-N 120.95 -1.094 . . . . 0.0 111.004 -178.633 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.795 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.9 OUTLIER . . . . . 0 N--CA 1.497 1.877 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.432 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 49.9 t -82.19 153.9 25.73 Favored 'General case' 0 N--CA 1.499 2.005 0 C-N-CA 119.213 -0.995 . . . . 0.0 108.705 178.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.964 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -75.52 -30.62 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.52 0 O-C-N 121.053 -1.03 . . . . 0.0 111.759 -178.702 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.495 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 14.2 p -58.94 -35.41 73.07 Favored 'General case' 0 N--CA 1.511 2.61 0 O-C-N 120.692 -1.255 . . . . 0.0 110.869 -179.037 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.497 ' HG3' HG22 ' A' ' 109' ' ' ILE . 0.0 OUTLIER -57.12 -30.41 64.37 Favored 'General case' 0 N--CA 1.51 2.557 0 O-C-N 120.917 -1.114 . . . . 0.0 110.261 179.034 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.4 t -83.06 124.35 76.59 Favored Pre-proline 0 N--CA 1.505 2.298 0 O-C-N 121.061 -1.024 . . . . 0.0 110.147 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -66.17 174.8 5.51 Favored 'Trans proline' 0 N--CA 1.49 1.27 0 O-C-N 123.138 1.072 . . . . 0.0 110.774 179.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 31.1 mmm-85 -75.08 -37.0 61.7 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.216 -0.927 . . . . 0.0 110.57 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.36 -40.65 78.56 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 120.996 -1.065 . . . . 0.0 110.044 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 38.6 tp60 -69.35 -41.98 75.87 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.338 -0.945 . . . . 0.0 109.128 179.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.654 HD11 HD11 ' A' ' 121' ' ' ILE . 8.0 mt -65.23 -39.47 92.77 Favored 'General case' 0 N--CA 1.505 2.304 0 C-N-CA 119.461 -0.895 . . . . 0.0 109.407 179.044 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -59.84 -39.0 83.67 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.17 -0.956 . . . . 0.0 109.994 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -59.78 -40.07 87.01 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.127 -0.983 . . . . 0.0 110.054 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -61.62 -44.29 97.27 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.189 -0.944 . . . . 0.0 109.819 179.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.453 ' HB1' ' HA ' ' A' ' 139' ' ' GLN . . . -60.94 -41.41 96.21 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.209 -0.932 . . . . 0.0 109.953 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 18.3 ttt-85 -63.44 -33.13 74.88 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.111 -0.993 . . . . 0.0 110.492 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 24.5 mtmt -79.95 -30.85 39.95 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.014 -1.054 . . . . 0.0 111.197 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.37 23.51 8.35 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 120.836 -1.165 . . . . 0.0 111.739 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.89 46.6 49.17 Favored Glycine 0 N--CA 1.5 2.923 0 O-C-N 120.645 -1.284 . . . . 0.0 110.882 179.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.43 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 9.3 t -147.8 -164.01 1.91 Allowed 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.136 -1.214 . . . . 0.0 110.383 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . 0.453 ' HA ' ' HB1' ' A' ' 133' ' ' ALA . 27.5 mt-30 -136.25 151.42 49.64 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.135 -0.978 . . . . 0.0 110.224 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.584 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.8 p -132.12 161.07 41.99 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.123 -0.985 . . . . 0.0 110.222 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 34.7 t -168.33 92.99 0.34 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.249 -0.907 . . . . 0.0 111.001 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.964 ' CD1' HD12 ' A' ' 121' ' ' ILE . 78.3 t80 -100.53 159.97 14.73 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.161 -0.962 . . . . 0.0 110.57 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -138.27 -60.92 0.61 Allowed 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -142.46 149.57 39.4 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.48 -0.762 . . . . 0.0 109.079 178.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . 0.409 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.6 p -90.32 153.82 20.16 Favored 'General case' 0 N--CA 1.506 2.368 0 C-N-CA 119.102 -1.039 . . . . 0.0 111.195 -179.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 27.0 m -72.11 -24.96 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.439 0 O-C-N 121.445 -0.785 . . . . 0.0 111.396 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -50.06 -61.31 2.23 Favored 'General case' 0 N--CA 1.515 2.802 0 O-C-N 120.837 -1.164 . . . . 0.0 110.036 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.492 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.3 p -125.93 -166.13 1.52 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.273 -0.892 . . . . 0.0 110.459 179.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -99.43 64.52 0.67 Allowed Glycine 0 N--CA 1.492 2.376 0 N-CA-C 107.987 -2.045 . . . . 0.0 107.987 178.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 29.9 t -104.73 137.32 42.71 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.359 -1.083 . . . . 0.0 110.007 -179.074 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 18.7 ttt85 -95.3 53.79 1.55 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.306 -0.871 . . . . 0.0 109.419 178.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 68.95 98.09 0.04 OUTLIER Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.986 -1.245 . . . . 0.0 109.986 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 29.8 p -105.56 119.01 38.04 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.279 -1.13 . . . . 0.0 110.248 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -145.86 154.64 42.2 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.141 -0.975 . . . . 0.0 110.063 -179.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . 0.425 ' OG ' ' HB2' ' A' ' 101' ' ' GLU . 0.7 OUTLIER . . . . . 0 N--CA 1.505 2.304 0 O-C-N 121.29 -0.881 . . . . 0.0 110.693 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.664 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.504 2.236 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.415 ' HG2' HD13 ' A' ' 77' ' ' LEU . 44.8 Cg_endo -71.13 160.69 48.35 Favored 'Trans proline' 0 C--N 1.317 -1.097 0 O-C-N 123.358 1.188 . . . . 0.0 110.852 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -49.05 -31.72 8.25 Favored 'General case' 0 N--CA 1.515 2.791 0 O-C-N 121.411 -0.805 . . . . 0.0 111.361 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.8 -33.93 43.76 Favored Glycine 0 N--CA 1.498 2.826 0 O-C-N 120.957 -1.089 . . . . 0.0 110.503 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -55.66 -33.28 63.96 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.029 -1.277 . . . . 0.0 110.673 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -53.62 -38.29 63.89 Favored 'General case' 0 N--CA 1.513 2.687 0 O-C-N 121.047 -1.033 . . . . 0.0 110.2 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.7 mtmt -60.29 -37.42 80.47 Favored 'General case' 0 N--CA 1.509 2.482 0 C-N-CA 119.559 -0.856 . . . . 0.0 109.999 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.862 ' O ' HD12 ' A' ' 23' ' ' LEU . 1.3 pt -115.41 33.64 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.193 -0.942 . . . . 0.0 110.61 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 2.5 tttt -84.64 -43.08 0.71 Allowed Pre-proline 0 N--CA 1.51 2.557 0 O-C-N 120.936 -1.102 . . . . 0.0 113.393 -179.03 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.6 Cg_endo -75.57 -35.09 2.94 Favored 'Trans proline' 0 N--CA 1.487 1.094 0 O-C-N 122.604 0.792 . . . . 0.0 111.797 -178.093 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.472 HG21 ' CE2' ' A' ' 62' ' ' TYR . 82.9 m -60.43 -43.76 96.46 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 120.955 -1.091 . . . . 0.0 110.019 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.862 HD12 ' O ' ' A' ' 19' ' ' ILE . 6.2 mt -65.33 -39.49 92.49 Favored 'General case' 0 N--CA 1.507 2.377 0 C-N-CA 119.337 -0.945 . . . . 0.0 109.466 179.465 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.1 m -57.62 -35.54 70.6 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.085 -1.009 . . . . 0.0 110.185 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -56.81 -36.14 69.57 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.067 -1.021 . . . . 0.0 110.438 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.709 ' CD2' HD22 ' A' ' 55' ' ' LEU . 14.7 m-85 -58.46 -38.98 78.67 Favored 'General case' 0 N--CA 1.51 2.526 0 O-C-N 121.114 -0.991 . . . . 0.0 110.51 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -60.47 -38.48 84.35 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.185 -0.947 . . . . 0.0 110.711 -179.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.414 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.2 mp -66.9 -40.97 86.94 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.397 0 C-N-CA 119.238 -0.985 . . . . 0.0 109.089 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 29.2 tp60 -67.76 -47.17 69.99 Favored 'General case' 0 N--CA 1.506 2.354 0 C-N-CA 119.178 -1.009 . . . . 0.0 108.785 179.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.698 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.1 OUTLIER -63.58 -36.23 83.13 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 121.225 -0.922 . . . . 0.0 109.001 178.474 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.2 mtt85 -57.88 -41.41 82.46 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.026 -1.046 . . . . 0.0 109.874 179.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.86 -46.3 88.54 Favored 'General case' 0 N--CA 1.506 2.334 0 C-N-CA 119.27 -0.972 . . . . 0.0 109.602 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.53 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -66.91 -41.66 86.72 Favored 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 119.262 -0.975 . . . . 0.0 109.202 179.194 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -60.29 -34.24 73.49 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.566 -0.854 . . . . 0.0 110.191 179.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -92.72 -32.79 14.58 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.05 -1.031 . . . . 0.0 110.824 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 . . . . . 0 N--CA 1.512 2.638 0 O-C-N 120.933 -1.105 . . . . 0.0 110.357 -179.968 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.415 ' OG ' ' N ' ' A' ' 46' ' ' ASN . 24.0 p . . . . . 0 N--CA 1.496 1.832 0 CA-C-O 120.657 0.265 . . . . 0.0 110.368 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.415 ' N ' ' OG ' ' A' ' 45' ' ' SER . 1.3 m-80 -57.0 -38.79 73.58 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.281 -0.887 . . . . 0.0 109.966 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -64.58 -40.09 94.91 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.213 -0.93 . . . . 0.0 109.687 179.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.8 tp60 -62.33 -41.05 98.24 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.207 -0.933 . . . . 0.0 109.765 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.452 ' HA ' HD13 ' A' ' 49' ' ' LEU . 4.3 mm? -60.5 -39.87 89.31 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.212 -0.93 . . . . 0.0 109.993 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.497 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 52.9 m0 -60.83 -37.63 82.68 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.132 -0.98 . . . . 0.0 110.041 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -61.15 -31.07 70.8 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.038 -1.039 . . . . 0.0 109.916 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.698 HG23 ' CG ' ' A' ' 30' ' ' LEU . 70.6 mt -71.57 -58.41 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.244 0 O-C-N 120.864 -1.148 . . . . 0.0 109.286 179.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.407 ' HE1' ' O ' ' A' ' 147' ' ' HIS . 3.2 ptm -60.62 -28.28 68.41 Favored 'General case' 0 N--CA 1.509 2.52 0 C-N-CA 118.503 -1.279 . . . . 0.0 109.847 178.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -68.45 -37.26 80.05 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.756 -1.215 . . . . 0.0 109.24 178.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.709 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.3 mt -52.78 -32.5 44.02 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 120.967 -1.083 . . . . 0.0 110.175 179.044 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.473 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 10.4 t60 -54.61 -37.82 66.04 Favored 'General case' 0 N--CA 1.511 2.579 0 O-C-N 121.049 -1.032 . . . . 0.0 110.178 179.562 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.437 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 5.2 m170 -62.06 -51.84 66.33 Favored 'General case' 0 N--CA 1.508 2.443 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.472 179.29 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 19.6 tp60 -57.74 -34.67 69.76 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.273 -0.892 . . . . 0.0 109.831 179.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.426 ' HD3' ' CE2' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -68.81 -49.94 54.36 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.005 -1.06 . . . . 0.0 109.142 178.938 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 65.5 p -61.78 -37.45 84.38 Favored 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.162 -0.961 . . . . 0.0 109.432 179.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.84 -39.0 93.17 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.068 -1.02 . . . . 0.0 109.546 179.34 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.752 ' OH ' HG22 ' A' ' 19' ' ' ILE . 36.8 t80 -61.7 -49.82 74.92 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.182 -0.949 . . . . 0.0 109.379 179.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.764 HD12 ' HB2' ' A' ' 87' ' ' ALA . 85.1 mt -73.61 -41.47 55.47 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 C-N-CA 119.398 -0.921 . . . . 0.0 109.137 179.151 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.443 ' CE1' HG23 ' A' ' 92' ' ' ILE . 45.9 t80 -60.81 -33.07 72.44 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.289 -0.882 . . . . 0.0 110.135 179.125 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.7 m -79.25 -35.82 40.9 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.886 -1.133 . . . . 0.0 110.748 -179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.631 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -82.93 -33.69 26.74 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.836 -1.165 . . . . 0.0 112.412 -179.035 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.529 ' N ' HD12 ' A' ' 66' ' ' LEU . 64.2 t80 -86.6 -34.94 19.71 Favored 'General case' 0 N--CA 1.511 2.617 0 O-C-N 120.674 -1.266 . . . . 0.0 112.047 -179.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -98.55 -20.73 16.88 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.778 -1.201 . . . . 0.0 112.862 -178.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.415 ' HE2' ' CD2' ' A' ' 64' ' ' TYR . 0.6 OUTLIER -118.75 -56.65 2.1 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.552 -1.343 . . . . 0.0 111.198 -179.523 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.424 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 6.9 ttt85 -66.2 -30.84 71.38 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 121.085 -1.01 . . . . 0.0 110.706 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.2 ttpt 58.64 44.0 18.13 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.785 -1.197 . . . . 0.0 110.133 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.65 38.12 3.56 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.367 -0.833 . . . . 0.0 109.701 179.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.824 HG13 HD23 ' A' ' 77' ' ' LEU . 14.2 tt -155.32 162.97 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.92 0 O-C-N 121.25 -0.906 . . . . 0.0 110.206 -179.604 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.8 m -108.11 146.05 33.2 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.118 -0.989 . . . . 0.0 109.978 179.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -45.99 -32.9 3.02 Favored 'General case' 0 N--CA 1.516 2.835 0 O-C-N 121.269 -0.894 . . . . 0.0 111.598 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -61.42 -49.63 76.08 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 120.947 -1.095 . . . . 0.0 109.324 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.824 HD23 HG13 ' A' ' 73' ' ' ILE . 34.5 tp -67.31 -43.01 82.73 Favored 'General case' 0 N--CA 1.504 2.26 0 C-N-CA 119.25 -0.98 . . . . 0.0 108.593 178.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.463 ' HA ' HD12 ' A' ' 81' ' ' LEU . 17.6 t80 -61.3 -38.69 87.72 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 121.352 -0.842 . . . . 0.0 109.35 178.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.464 ' O ' HG22 ' A' ' 82' ' ' ILE . 10.4 t0 -74.73 -41.2 60.57 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.171 -0.956 . . . . 0.0 108.954 178.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.664 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 81.6 t90 -59.73 -38.33 81.38 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.175 -0.953 . . . . 0.0 109.291 178.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.463 HD12 ' HA ' ' A' ' 78' ' ' TYR . 16.6 mt -66.01 -55.69 15.4 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.179 -0.951 . . . . 0.0 109.278 179.144 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.537 HD12 ' HB3' ' A' ' 87' ' ' ALA . 0.9 OUTLIER -56.48 -27.43 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 O-C-N 121.104 -0.997 . . . . 0.0 110.831 -179.726 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 10.2 tppt? -89.26 -15.37 33.71 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 120.918 -1.114 . . . . 0.0 111.868 179.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.438 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 75.0 mm-40 -107.48 25.04 11.95 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.564 -1.335 . . . . 0.0 111.927 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.408 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 7.0 ttmt 76.69 67.89 0.06 Allowed 'General case' 0 N--CA 1.514 2.741 0 O-C-N 121.252 -0.905 . . . . 0.0 112.022 179.278 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.603 ' HE2' HD13 ' A' ' 23' ' ' LEU . 27.2 m-85 -131.28 -62.58 0.88 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.406 -0.809 . . . . 0.0 108.977 178.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.764 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -132.89 168.53 18.26 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.388 -0.82 . . . . 0.0 109.391 179.318 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.473 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.7 t70 -121.29 111.88 17.91 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.132 -0.98 . . . . 0.0 110.546 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 7.8 mttt -58.61 -35.26 72.16 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.229 -0.919 . . . . 0.0 110.259 179.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.3 tp -57.61 -40.55 79.36 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 120.992 -1.067 . . . . 0.0 110.069 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.689 ' HA ' HD21 ' A' ' 106' ' ' LEU . 63.1 tp -71.03 -49.85 40.43 Favored 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 119.195 -1.002 . . . . 0.0 108.723 179.275 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.443 HG23 ' CE1' ' A' ' 64' ' ' TYR . 63.8 mt -60.76 -30.3 46.84 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.289 0 C-N-CA 119.32 -0.952 . . . . 0.0 109.377 178.501 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.9 -45.39 78.13 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 120.964 -1.085 . . . . 0.0 109.423 178.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.486 ' HD3' HD23 ' A' ' 106' ' ' LEU . 11.9 mttp -59.47 -44.27 93.05 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.003 -1.061 . . . . 0.0 109.859 179.282 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 3.3 m0 -57.49 -33.52 68.11 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.077 -1.014 . . . . 0.0 110.367 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.29 -35.58 35.6 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.129 -0.982 . . . . 0.0 110.282 179.418 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.8 mmtm -53.57 -178.62 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.641 0 O-C-N 120.953 -1.092 . . . . 0.0 110.62 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.87 140.18 39.3 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.257 -0.902 . . . . 0.0 109.472 179.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 102.52 -27.55 19.81 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 -178.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.604 ' HB3' HD23 ' A' ' 103' ' ' LEU . 66.0 m-85 -92.62 59.05 3.24 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 120.859 -1.377 . . . . 0.0 109.734 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -81.37 -35.98 30.16 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.064 -1.022 . . . . 0.0 110.456 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.17 66.71 0.83 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.049 -1.032 . . . . 0.0 110.694 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.604 HD23 ' HB3' ' A' ' 100' ' ' TYR . 0.7 OUTLIER -109.59 149.46 29.64 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 120.967 -1.083 . . . . 0.0 109.82 179.43 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.437 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 27.0 p -111.62 -27.88 8.37 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.193 -0.942 . . . . 0.0 113.264 -179.186 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.684 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 12.4 m -144.86 -168.77 3.01 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 120.168 -1.582 . . . . 0.0 109.865 179.207 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.689 HD21 ' HA ' ' A' ' 91' ' ' LEU . 17.3 mt -97.01 -37.34 10.2 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.165 -0.959 . . . . 0.0 110.234 179.002 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 7.9 ttp180 -104.07 33.32 3.51 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.93 -1.106 . . . . 0.0 109.675 178.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.684 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.304 1.7 t -128.37 20.84 6.19 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 108.388 -0.968 . . . . 0.0 108.388 -179.629 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.466 HG23 ' C ' ' A' ' 108' ' ' CYS . 1.6 pt -157.29 38.34 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.298 0 O-C-N 121.017 -1.052 . . . . 0.0 110.211 -178.776 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.751 ' C ' HG23 ' A' ' 119' ' ' THR . 83.4 mt-30 . . . . . 0 N--CA 1.509 2.512 0 O-C-N 120.953 -1.092 . . . . 0.0 110.675 -178.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.751 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.7 m . . . . . 0 N--CA 1.503 2.193 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 39.6 t -92.62 154.2 18.54 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 119.386 -0.926 . . . . 0.0 108.962 178.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.965 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -77.29 -30.15 17.28 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.443 0 O-C-N 121.025 -1.047 . . . . 0.0 111.775 -178.711 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.48 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.7 p -59.02 -35.55 73.47 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 120.676 -1.265 . . . . 0.0 110.75 -179.156 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.08 -32.57 64.25 Favored 'General case' 0 N--CA 1.512 2.629 0 O-C-N 120.94 -1.1 . . . . 0.0 110.001 178.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 62.5 t -81.3 124.76 80.36 Favored Pre-proline 0 N--CA 1.503 2.212 0 O-C-N 121.051 -1.031 . . . . 0.0 109.681 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.97 178.81 2.15 Favored 'Trans proline' 0 N--CA 1.488 1.174 0 O-C-N 123.114 1.06 . . . . 0.0 110.762 179.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -75.12 -38.44 61.07 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.308 -0.87 . . . . 0.0 110.355 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.2 -40.88 82.73 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.089 -1.007 . . . . 0.0 110.029 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -67.41 -42.2 83.64 Favored 'General case' 0 N--CA 1.506 2.368 0 C-N-CA 119.432 -0.907 . . . . 0.0 109.217 179.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.698 HD11 HD11 ' A' ' 121' ' ' ILE . 9.5 mt -63.59 -39.78 95.26 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.155 -0.966 . . . . 0.0 109.547 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -58.82 -37.79 77.21 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.096 -1.002 . . . . 0.0 110.059 179.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -57.42 -37.18 72.35 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.098 -1.001 . . . . 0.0 110.381 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 62.7 mt-10 -61.43 -47.59 85.05 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.144 -0.972 . . . . 0.0 109.695 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.85 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -59.81 -37.97 80.67 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.171 -0.956 . . . . 0.0 109.877 179.644 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 23.6 ttm-85 -61.69 -38.72 88.89 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.155 -0.966 . . . . 0.0 110.318 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 49.5 mttm -87.08 -39.66 15.38 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.105 -0.997 . . . . 0.0 110.212 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 67.7 mttt -69.13 -26.0 64.67 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.21 -0.931 . . . . 0.0 111.17 179.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 90.0 33.54 8.88 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.85 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.7 t -144.31 -161.41 1.28 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.049 -1.266 . . . . 0.0 109.946 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -125.74 150.86 47.37 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.089 -1.007 . . . . 0.0 109.979 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.514 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.0 p -132.14 160.72 42.29 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.17 -0.956 . . . . 0.0 110.434 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 46.9 t -170.26 98.04 0.27 Allowed 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.237 -0.915 . . . . 0.0 110.892 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.965 ' CD1' HD12 ' A' ' 121' ' ' ILE . 81.6 t80 -103.93 159.97 15.2 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.124 -0.985 . . . . 0.0 110.85 -179.608 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -138.75 -61.06 0.58 Allowed 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -141.69 148.51 39.21 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.536 -0.728 . . . . 0.0 109.155 178.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . 0.417 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 29.8 p -89.81 154.13 20.14 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.073 -1.051 . . . . 0.0 111.069 -179.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.2 p -72.34 -25.77 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.386 0 O-C-N 121.385 -0.822 . . . . 0.0 111.463 -179.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . 0.407 ' O ' ' HE1' ' A' ' 53' ' ' MET . 3.6 m-70 -49.78 -59.34 3.92 Favored 'General case' 0 N--CA 1.516 2.844 0 O-C-N 120.853 -1.154 . . . . 0.0 110.208 -179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.497 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.6 p -126.96 -165.23 1.44 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.278 -0.889 . . . . 0.0 110.333 179.289 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . 0.44 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -101.55 63.18 0.52 Allowed Glycine 0 N--CA 1.492 2.387 0 N-CA-C 107.879 -2.088 . . . . 0.0 107.879 178.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 20.6 t -101.49 141.26 34.62 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.347 -1.09 . . . . 0.0 109.819 -179.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 23.9 mtt85 -97.55 50.19 1.05 Allowed 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.246 -0.909 . . . . 0.0 109.546 179.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 71.42 98.37 0.06 OUTLIER Glycine 0 N--CA 1.486 2.017 0 N-CA-C 109.975 -1.25 . . . . 0.0 109.975 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.4 p -109.43 126.04 53.05 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.244 -1.15 . . . . 0.0 110.173 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -150.17 151.75 33.58 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.077 -1.015 . . . . 0.0 110.434 -179.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.5 2.058 0 O-C-N 121.217 -0.927 . . . . 0.0 110.583 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.768 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.504 2.24 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.45 165.05 33.82 Favored 'Trans proline' 0 C--N 1.317 -1.115 0 O-C-N 123.296 1.156 . . . . 0.0 110.514 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -48.18 -32.25 6.8 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 121.5 -0.75 . . . . 0.0 111.368 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.99 -33.99 51.47 Favored Glycine 0 N--CA 1.499 2.833 0 O-C-N 120.984 -1.072 . . . . 0.0 110.514 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.504 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 28.5 t80 -54.98 -31.63 60.94 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.039 -1.271 . . . . 0.0 110.689 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -53.27 -37.03 61.79 Favored 'General case' 0 N--CA 1.512 2.662 0 O-C-N 120.982 -1.074 . . . . 0.0 110.236 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp -59.0 -37.7 77.46 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.24 -0.913 . . . . 0.0 110.116 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.889 HD12 HD11 ' A' ' 23' ' ' LEU . 1.9 pt -119.51 35.07 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.223 -0.923 . . . . 0.0 110.537 179.77 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.439 ' HG3' ' CE2' ' A' ' 16' ' ' PHE . 3.0 tttt -84.9 -43.3 0.68 Allowed Pre-proline 0 N--CA 1.509 2.481 0 O-C-N 120.992 -1.067 . . . . 0.0 113.42 -178.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.42 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.7 Cg_endo -75.74 -35.45 2.64 Favored 'Trans proline' 0 N--CA 1.486 1.085 0 O-C-N 122.559 0.768 . . . . 0.0 111.867 -177.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.513 HG21 ' CE2' ' A' ' 62' ' ' TYR . 59.8 m -61.5 -45.62 93.45 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.985 -1.072 . . . . 0.0 110.061 -179.585 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.889 HD11 HD12 ' A' ' 19' ' ' ILE . 9.0 mt -63.53 -40.36 96.83 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.509 -0.877 . . . . 0.0 109.694 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.09 -35.34 73.23 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.157 -0.964 . . . . 0.0 110.087 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -57.92 -36.05 71.93 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.009 -1.057 . . . . 0.0 110.272 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.451 ' CD2' ' HD3' ' A' ' 59' ' ' ARG . 10.4 m-85 -55.46 -40.95 72.25 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 120.879 -1.138 . . . . 0.0 109.978 179.598 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -58.58 -25.1 62.2 Favored 'General case' 0 N--CA 1.505 2.323 0 C-N-CA 119.484 -0.887 . . . . 0.0 110.711 179.284 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 11.3 mm -70.53 -49.01 55.76 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.31 0 O-C-N 120.894 -1.129 . . . . 0.0 109.136 179.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.77 -43.35 72.39 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.154 -0.967 . . . . 0.0 108.867 179.155 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.67 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -64.43 -34.68 78.75 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.249 -0.98 . . . . 0.0 109.215 178.544 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.58 -40.86 84.37 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.014 -1.054 . . . . 0.0 109.957 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -62.43 -48.19 80.77 Favored 'General case' 0 N--CA 1.508 2.45 0 C-N-CA 119.28 -0.968 . . . . 0.0 109.541 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.615 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -67.68 -41.05 84.28 Favored 'General case' 0 N--CA 1.505 2.292 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.245 179.124 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.52 ' HG3' HD23 ' A' ' 30' ' ' LEU . 8.8 mm-40 -66.28 -34.21 77.49 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.309 -0.869 . . . . 0.0 110.159 179.401 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt -85.87 -34.32 21.04 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.033 -1.042 . . . . 0.0 110.631 179.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 36.1 t70 . . . . . 0 N--CA 1.511 2.619 0 O-C-N 121.002 -1.062 . . . . 0.0 110.209 179.907 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 27.9 t . . . . . 0 N--CA 1.494 1.758 0 CA-C-O 120.685 0.279 . . . . 0.0 110.363 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -56.96 -39.45 74.62 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 121.169 -0.957 . . . . 0.0 109.911 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -63.07 -39.35 94.45 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.153 -0.967 . . . . 0.0 109.763 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 46.4 tp60 -62.15 -41.02 97.88 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.167 -0.958 . . . . 0.0 109.855 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -60.05 -39.99 87.87 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.225 -0.922 . . . . 0.0 110.169 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.496 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.3 m0 -59.13 -36.38 75.11 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.214 -0.929 . . . . 0.0 110.276 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -60.99 -29.86 69.93 Favored 'General case' 0 N--CA 1.507 2.378 0 C-N-CA 119.164 -1.014 . . . . 0.0 110.173 179.136 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.67 HG23 ' CG ' ' A' ' 30' ' ' LEU . 71.7 mt -72.58 -58.16 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.269 0 O-C-N 120.936 -1.103 . . . . 0.0 109.196 179.461 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.4 ptm -60.53 -29.96 69.45 Favored 'General case' 0 N--CA 1.51 2.548 0 C-N-CA 118.609 -1.237 . . . . 0.0 109.861 178.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.9 mt-30 -69.81 -37.66 76.35 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.894 -1.129 . . . . 0.0 109.075 178.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.414 ' HA ' HD23 ' A' ' 55' ' ' LEU . 12.5 mt -54.26 -32.65 56.69 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.003 -1.06 . . . . 0.0 110.211 178.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.449 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 6.2 t60 -55.0 -37.13 66.2 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.008 -1.057 . . . . 0.0 110.111 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.493 ' NE2' HD21 ' A' ' 91' ' ' LEU . 5.1 m170 -59.61 -48.3 82.19 Favored 'General case' 0 N--CA 1.509 2.508 0 C-N-CA 119.313 -0.955 . . . . 0.0 109.538 179.05 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -60.58 -36.15 77.81 Favored 'General case' 0 N--CA 1.506 2.327 0 C-N-CA 119.396 -0.921 . . . . 0.0 109.505 179.036 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.451 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -67.59 -49.58 62.46 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.182 -0.949 . . . . 0.0 109.304 179.073 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.6 p -61.26 -38.11 85.54 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.146 -0.971 . . . . 0.0 109.586 179.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.0 ttt85 -65.7 -39.0 90.77 Favored 'General case' 0 N--CA 1.507 2.392 0 C-N-CA 119.164 -1.014 . . . . 0.0 109.406 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.56 ' OH ' HG22 ' A' ' 19' ' ' ILE . 40.5 t80 -59.88 -47.13 86.98 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.21 -0.931 . . . . 0.0 109.561 179.496 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.772 HD12 ' HB2' ' A' ' 87' ' ' ALA . 86.2 mt -78.01 -44.06 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 O-C-N 121.186 -0.946 . . . . 0.0 108.947 179.212 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.523 ' CE1' HG23 ' A' ' 92' ' ' ILE . 37.7 t80 -59.17 -25.62 64.08 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.326 -0.859 . . . . 0.0 110.289 178.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.417 ' HA ' ' CD ' ' A' ' 69' ' ' LYS . 71.2 m -87.47 -37.12 17.25 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.774 -1.204 . . . . 0.0 110.283 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.58 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.6 pp -83.14 -31.82 26.99 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.005 -1.059 . . . . 0.0 112.485 -179.116 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.491 ' HD1' HG23 ' A' ' 73' ' ' ILE . 73.5 t80 -86.27 -36.2 19.5 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 120.697 -1.252 . . . . 0.0 111.482 -179.192 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -94.36 -17.11 22.87 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 120.889 -1.132 . . . . 0.0 112.726 -178.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.417 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 1.1 mttt -125.0 -60.48 1.35 Allowed 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.53 -1.356 . . . . 0.0 111.264 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.426 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 1.7 tpt180 -59.82 -29.89 68.56 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 120.986 -1.071 . . . . 0.0 110.825 -179.636 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.2 tttt 58.55 43.86 18.64 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.885 -1.134 . . . . 0.0 110.058 -179.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -114.07 36.63 3.62 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.366 -0.834 . . . . 0.0 109.798 179.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.755 HG13 HD23 ' A' ' 77' ' ' LEU . 13.8 tt -159.43 162.36 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.202 -0.936 . . . . 0.0 110.119 -179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.05 149.44 29.26 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.048 -1.032 . . . . 0.0 110.199 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.9 tttp -46.09 -32.7 3.03 Favored 'General case' 0 N--CA 1.515 2.804 0 O-C-N 121.375 -0.828 . . . . 0.0 111.588 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -62.46 -51.37 67.74 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 120.961 -1.087 . . . . 0.0 109.224 179.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.755 HD23 HG13 ' A' ' 73' ' ' ILE . 29.6 tp -65.92 -42.35 90.26 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.192 -1.003 . . . . 0.0 108.659 178.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.584 ' HA ' HD12 ' A' ' 81' ' ' LEU . 17.6 t80 -61.86 -40.13 94.29 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.302 -0.874 . . . . 0.0 109.244 179.022 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -70.84 -42.21 70.45 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.14 -0.975 . . . . 0.0 108.868 178.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.768 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 81.5 t90 -57.57 -36.84 72.21 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.248 -0.907 . . . . 0.0 109.65 179.049 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.584 HD12 ' HA ' ' A' ' 78' ' ' TYR . 15.8 mt -67.99 -51.37 47.99 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.059 -1.025 . . . . 0.0 109.082 179.176 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.494 HG21 ' HD2' ' A' ' 89' ' ' LYS . 34.8 mm -56.77 -29.27 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.53 0 O-C-N 121.208 -0.932 . . . . 0.0 110.209 179.415 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 25.2 tttt -89.1 -20.33 24.44 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 120.873 -1.142 . . . . 0.0 111.93 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.441 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 29.0 mm-40 -102.91 22.9 13.04 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 120.635 -1.291 . . . . 0.0 112.077 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? 73.81 77.65 0.13 Allowed 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.02 -1.05 . . . . 0.0 111.685 179.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.736 ' HE2' HD13 ' A' ' 23' ' ' LEU . 31.8 m-85 -135.9 -62.39 0.68 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.51 -0.743 . . . . 0.0 109.342 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.772 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -127.96 171.67 11.61 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.478 -0.763 . . . . 0.0 109.41 179.324 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.449 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 25.8 t0 -114.35 104.94 12.56 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.144 -0.973 . . . . 0.0 110.246 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.494 ' HD2' HG21 ' A' ' 82' ' ' ILE . 20.5 mttm -58.83 -39.91 82.6 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.219 -0.926 . . . . 0.0 109.934 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.596 HD23 HD13 ' A' ' 106' ' ' LEU . 27.5 tp -61.52 -38.59 87.95 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.135 -0.978 . . . . 0.0 109.924 179.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.493 HD21 ' NE2' ' A' ' 57' ' ' HIS . 57.0 tp -71.47 -47.25 56.86 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.056 -1.028 . . . . 0.0 108.702 179.241 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.523 HG23 ' CE1' ' A' ' 64' ' ' TYR . 23.1 mt -58.02 -36.44 56.49 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 O-C-N 121.16 -0.962 . . . . 0.0 108.627 178.305 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.99 -38.91 86.88 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 121.154 -0.966 . . . . 0.0 109.137 178.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.433 ' HD2' ' CZ ' ' A' ' 100' ' ' TYR . 4.9 mmtt -57.64 -42.91 84.41 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.152 -0.967 . . . . 0.0 109.474 179.288 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.5 m0 -64.79 -37.46 87.7 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.56 -0.856 . . . . 0.0 110.055 179.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.3 mtp85 -75.68 -32.81 60.29 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.194 -0.941 . . . . 0.0 110.543 179.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -54.06 -176.59 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.7 0 O-C-N 121.065 -1.022 . . . . 0.0 110.657 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -104.03 136.14 44.23 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.129 -0.982 . . . . 0.0 109.694 179.228 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 95.63 11.3 55.63 Favored Glycine 0 N--CA 1.494 2.553 0 C-N-CA 120.172 -1.013 . . . . 0.0 111.023 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.641 ' HB3' HD23 ' A' ' 103' ' ' LEU . 48.2 m-85 -119.28 71.95 0.88 Allowed 'General case' 0 N--CA 1.493 1.715 0 CA-C-N 119.403 1.602 . . . . 0.0 109.777 179.703 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -96.73 -36.26 10.72 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.177 -0.952 . . . . 0.0 110.807 -179.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.33 66.98 0.99 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.015 -1.053 . . . . 0.0 110.822 -179.598 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.641 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.2 pp -114.5 153.04 30.72 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.035 -1.041 . . . . 0.0 109.78 179.297 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.433 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.7 p -114.36 -29.92 6.74 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.172 -0.955 . . . . 0.0 113.569 -178.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.645 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.8 m -142.92 -167.99 2.67 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 120.051 -1.656 . . . . 0.0 109.907 179.263 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.596 HD13 HD23 ' A' ' 90' ' ' LEU . 15.0 mt -95.69 -39.04 10.09 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.2 -0.937 . . . . 0.0 109.937 179.083 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 5.7 ttm-85 -102.83 30.74 4.55 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.026 -1.046 . . . . 0.0 109.933 178.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.645 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.299 1.8 t -128.14 17.98 6.59 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.12 -0.988 . . . . 0.0 108.947 -179.554 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.461 HG23 ' C ' ' A' ' 108' ' ' CYS . 1.2 pt -158.28 37.83 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.275 0 O-C-N 120.864 -1.147 . . . . 0.0 110.571 -178.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.524 ' C ' HG23 ' A' ' 119' ' ' THR . 12.1 mm-40 . . . . . 0 N--CA 1.51 2.559 0 O-C-N 120.854 -1.154 . . . . 0.0 110.509 -178.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.524 HG23 ' C ' ' A' ' 110' ' ' GLN . 2.7 m . . . . . 0 N--CA 1.495 1.824 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.428 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 41.7 t -102.74 155.28 18.42 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.247 -0.908 . . . . 0.0 109.698 179.521 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.778 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -72.96 -36.34 51.13 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.457 0 O-C-N 121.114 -0.991 . . . . 0.0 111.052 -179.36 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.483 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 11.9 p -53.65 -33.17 54.33 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 120.84 -1.163 . . . . 0.0 111.253 -178.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.32 -32.57 70.2 Favored 'General case' 0 N--CA 1.512 2.65 0 O-C-N 120.952 -1.092 . . . . 0.0 109.666 178.392 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 49.3 t -82.84 125.41 75.45 Favored Pre-proline 0 N--CA 1.505 2.297 0 O-C-N 121.06 -1.025 . . . . 0.0 109.85 179.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.64 175.29 4.49 Favored 'Trans proline' 0 N--CA 1.488 1.189 0 O-C-N 123.155 1.082 . . . . 0.0 110.797 179.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.11 -36.71 61.66 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.256 -0.902 . . . . 0.0 110.73 -179.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.65 -40.22 78.8 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 121.031 -1.043 . . . . 0.0 110.105 -179.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -69.84 -41.35 75.02 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 119.356 -0.938 . . . . 0.0 109.288 179.316 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.728 HD11 HD11 ' A' ' 121' ' ' ILE . 2.9 mt -65.04 -38.45 90.87 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.246 -0.909 . . . . 0.0 109.648 179.231 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -61.22 -40.46 94.08 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.088 -1.008 . . . . 0.0 109.842 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -59.8 -37.49 79.29 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.144 -0.973 . . . . 0.0 110.294 179.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -61.53 -43.44 98.86 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.169 -0.957 . . . . 0.0 110.071 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.618 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -60.29 -40.89 92.09 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.186 -0.946 . . . . 0.0 110.015 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.94 -33.82 69.22 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.183 -0.948 . . . . 0.0 110.401 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 25.1 mttt -76.88 -30.93 56.44 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.065 -1.022 . . . . 0.0 110.949 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 14.8 mtpp -98.42 22.33 9.9 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 120.916 -1.115 . . . . 0.0 111.688 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.67 39.38 46.13 Favored Glycine 0 N--CA 1.5 2.964 0 O-C-N 120.691 -1.255 . . . . 0.0 110.727 179.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.618 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 7.0 t -143.55 -166.64 2.38 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.089 -1.242 . . . . 0.0 110.338 179.898 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . 0.438 ' HA ' ' HB1' ' A' ' 133' ' ' ALA . 37.6 mt-30 -132.94 155.05 49.81 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.245 -0.91 . . . . 0.0 110.248 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.611 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.2 p -130.63 161.36 40.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.152 -0.968 . . . . 0.0 109.961 179.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 42.2 t -166.41 85.52 0.3 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.138 -0.976 . . . . 0.0 111.285 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.762 ' CG ' HD12 ' A' ' 121' ' ' ILE . 55.1 t80 -97.43 159.94 14.62 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.207 -0.933 . . . . 0.0 110.136 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 9.8 m-70 -136.82 -61.47 0.67 Allowed 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 179.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -136.7 151.0 48.76 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.45 -0.781 . . . . 0.0 108.928 178.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . 0.402 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 29.0 p -91.49 154.48 19.09 Favored 'General case' 0 N--CA 1.506 2.331 0 C-N-CA 119.121 -1.032 . . . . 0.0 111.093 -179.456 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.5 m -72.7 -25.1 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.462 0 C-N-CA 119.742 -0.783 . . . . 0.0 111.541 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -50.43 -60.81 2.63 Favored 'General case' 0 N--CA 1.516 2.856 0 O-C-N 120.906 -1.121 . . . . 0.0 110.022 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.496 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.9 p -126.43 -165.39 1.44 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.215 -0.928 . . . . 0.0 110.393 179.263 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . 0.441 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.39 63.52 0.61 Allowed Glycine 0 N--CA 1.492 2.42 0 N-CA-C 108.053 -2.019 . . . . 0.0 108.053 178.543 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 30.5 t -103.69 138.89 39.69 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.357 -1.084 . . . . 0.0 110.074 -179.191 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -95.03 54.38 1.68 Allowed 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.266 -0.896 . . . . 0.0 109.444 179.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.66 97.93 0.03 OUTLIER Glycine 0 N--CA 1.486 2.024 0 N-CA-C 109.819 -1.312 . . . . 0.0 109.819 -179.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.5 p -107.22 126.23 52.14 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.219 -1.165 . . . . 0.0 110.391 179.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -150.29 148.5 28.93 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.193 -0.942 . . . . 0.0 110.343 -179.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.502 2.174 0 O-C-N 121.248 -0.907 . . . . 0.0 110.772 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.712 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.507 2.405 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -71.82 162.1 43.01 Favored 'Trans proline' 0 C--N 1.318 -1.072 0 O-C-N 123.281 1.148 . . . . 0.0 110.896 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -48.82 -31.96 7.94 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 121.464 -0.773 . . . . 0.0 111.344 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.35 -33.91 40.28 Favored Glycine 0 N--CA 1.498 2.827 0 O-C-N 120.992 -1.067 . . . . 0.0 110.584 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -54.89 -32.6 61.08 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 120.972 -1.311 . . . . 0.0 110.634 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -54.44 -37.94 65.73 Favored 'General case' 0 N--CA 1.512 2.659 0 O-C-N 121.04 -1.037 . . . . 0.0 110.251 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.8 mttm -57.94 -37.14 73.58 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.27 -0.894 . . . . 0.0 110.115 179.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.89 HD12 HD11 ' A' ' 23' ' ' LEU . 2.6 pt -116.1 35.31 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.206 -0.934 . . . . 0.0 110.402 179.392 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.432 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -83.59 -43.09 0.81 Allowed Pre-proline 0 N--CA 1.51 2.529 0 O-C-N 121.082 -1.011 . . . . 0.0 113.17 -179.179 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.432 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.2 Cg_endo -76.12 -35.79 2.23 Favored 'Trans proline' 0 N--CA 1.487 1.123 0 O-C-N 122.632 0.806 . . . . 0.0 111.66 -178.392 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.781 HG21 ' CE2' ' A' ' 62' ' ' TYR . 88.6 m -60.5 -44.96 95.44 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 120.946 -1.096 . . . . 0.0 109.828 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.89 HD11 HD12 ' A' ' 19' ' ' ILE . 8.4 mt -65.01 -39.36 93.33 Favored 'General case' 0 N--CA 1.505 2.321 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.416 179.401 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 20.2 m -58.5 -35.41 72.19 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.076 -1.015 . . . . 0.0 110.051 179.16 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -56.37 -35.87 68.18 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 121.037 -1.039 . . . . 0.0 110.394 179.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.685 ' CD2' HD22 ' A' ' 55' ' ' LEU . 12.9 m-85 -56.82 -36.4 69.9 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.075 -1.016 . . . . 0.0 110.475 179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -57.79 -38.61 75.8 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.069 -1.02 . . . . 0.0 110.499 -179.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.422 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.1 mp -65.96 -41.01 88.98 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.412 0 C-N-CA 119.31 -0.956 . . . . 0.0 109.033 179.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 8.7 tp60 -68.97 -46.75 67.31 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.108 -0.995 . . . . 0.0 108.826 179.044 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.026 HD11 HG23 ' A' ' 52' ' ' ILE . 2.4 tp -61.89 -36.97 82.86 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.205 -0.935 . . . . 0.0 109.235 178.735 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.1 mtt85 -57.24 -36.46 70.96 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.138 -0.976 . . . . 0.0 110.298 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -62.93 -51.78 65.59 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.072 -1.017 . . . . 0.0 109.503 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.456 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -69.08 -42.27 76.43 Favored 'General case' 0 N--CA 1.504 2.274 0 C-N-CA 119.045 -1.062 . . . . 0.0 108.614 178.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -61.26 -33.19 73.13 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 119.455 -0.898 . . . . 0.0 110.297 179.369 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.8 mmtt -94.25 -29.23 15.19 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 120.897 -1.127 . . . . 0.0 111.289 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 . . . . . 0 N--CA 1.513 2.69 0 O-C-N 120.79 -1.194 . . . . 0.0 110.473 -179.869 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.8 m . . . . . 0 N--CA 1.494 1.755 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -56.81 -39.07 73.5 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 121.226 -0.921 . . . . 0.0 109.763 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -58.54 -35.16 71.88 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.243 -0.911 . . . . 0.0 110.137 179.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.422 ' HG2' ' CB ' ' A' ' 33' ' ' ALA . 0.3 OUTLIER -58.72 -46.31 87.63 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 120.974 -1.079 . . . . 0.0 109.585 179.72 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 92.1 mt -63.28 -37.78 88.58 Favored 'General case' 0 N--CA 1.508 2.463 0 C-N-CA 119.305 -0.958 . . . . 0.0 109.916 179.517 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.498 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 38.3 m0 -59.36 -33.99 71.84 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.153 -0.967 . . . . 0.0 109.405 179.413 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -68.03 -33.49 74.68 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 120.727 -1.233 . . . . 0.0 109.326 178.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 1.026 HG23 HD11 ' A' ' 30' ' ' LEU . 11.2 mt -70.82 -53.64 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.245 0 O-C-N 121.03 -1.044 . . . . 0.0 109.491 179.222 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.496 ' CE ' ' HB2' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -59.83 -33.1 71.32 Favored 'General case' 0 N--CA 1.51 2.538 0 C-N-CA 118.764 -1.174 . . . . 0.0 109.718 179.169 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.36 -39.59 91.18 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 120.91 -1.119 . . . . 0.0 109.44 179.129 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.685 HD22 ' CD2' ' A' ' 26' ' ' PHE . 18.0 mt -54.46 -34.31 61.27 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.158 -0.964 . . . . 0.0 110.097 179.235 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.441 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 4.8 t60 -58.55 -39.21 79.6 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 120.983 -1.073 . . . . 0.0 109.85 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.439 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 7.6 m170 -59.95 -48.39 81.91 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.086 -1.009 . . . . 0.0 109.064 179.24 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.88 -38.51 88.59 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.55 -0.86 . . . . 0.0 109.397 179.065 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.23 -44.71 96.83 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.246 -0.909 . . . . 0.0 109.502 179.478 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 52.7 p -66.34 -39.96 89.56 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.091 -1.006 . . . . 0.0 109.151 179.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 60.3 ttt-85 -63.04 -40.24 97.11 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.117 -0.989 . . . . 0.0 109.298 179.086 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.781 ' CE2' HG21 ' A' ' 22' ' ' THR . 40.1 t80 -62.2 -50.58 71.23 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.151 -0.968 . . . . 0.0 109.383 179.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.842 HD12 ' HB2' ' A' ' 87' ' ' ALA . 82.3 mt -70.59 -37.56 70.19 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 C-N-CA 119.289 -0.964 . . . . 0.0 109.332 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.413 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 8.5 t80 -66.56 -41.65 88.28 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.146 -0.971 . . . . 0.0 108.996 178.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 86.3 m -60.84 -41.82 96.54 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.112 -0.992 . . . . 0.0 110.098 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.603 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.18 -35.65 25.32 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 120.958 -1.089 . . . . 0.0 112.716 -178.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.58 ' N ' HD12 ' A' ' 66' ' ' LEU . 41.8 t80 -86.58 -33.56 20.17 Favored 'General case' 0 N--CA 1.514 2.751 0 O-C-N 120.614 -1.304 . . . . 0.0 112.044 -179.066 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.413 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 6.8 m-85 -98.25 -3.35 37.56 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.854 -1.153 . . . . 0.0 113.308 -178.351 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -136.32 -57.52 0.75 Allowed 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.374 -1.454 . . . . 0.0 111.134 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.422 ' HB2' ' HA ' ' A' ' 66' ' ' LEU . 14.3 mtp85 -69.19 -28.58 66.51 Favored 'General case' 0 N--CA 1.51 2.557 0 O-C-N 120.949 -1.094 . . . . 0.0 110.731 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.0 tttp 60.22 44.78 12.27 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.781 -1.199 . . . . 0.0 109.985 -179.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.54 35.73 3.71 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.343 -0.848 . . . . 0.0 109.817 179.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.804 HG13 HD23 ' A' ' 77' ' ' LEU . 14.3 tt -155.99 162.69 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 O-C-N 121.151 -0.968 . . . . 0.0 110.052 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.7 p -109.5 147.08 33.53 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.085 -1.009 . . . . 0.0 110.095 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.3 tttt -45.87 -32.23 2.52 Favored 'General case' 0 N--CA 1.515 2.809 0 O-C-N 121.309 -0.869 . . . . 0.0 111.621 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -61.8 -50.54 71.93 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.955 -1.091 . . . . 0.0 109.274 179.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.804 HD23 HG13 ' A' ' 73' ' ' ILE . 38.5 tp -66.68 -44.44 81.78 Favored 'General case' 0 N--CA 1.505 2.295 0 C-N-CA 119.241 -0.984 . . . . 0.0 108.442 178.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.435 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 18.5 t80 -60.43 -38.74 85.06 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.327 -0.858 . . . . 0.0 109.564 179.208 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -73.39 -41.92 62.77 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.059 -1.026 . . . . 0.0 109.016 178.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.712 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 84.1 t90 -57.65 -37.3 73.13 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.219 -0.926 . . . . 0.0 109.756 179.143 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.779 HD22 ' CD2' ' A' ' 86' ' ' TYR . 60.9 mt -69.28 -47.86 63.35 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.209 -0.932 . . . . 0.0 108.949 179.217 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.566 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 33.1 mm -56.23 -31.72 32.96 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.64 0 O-C-N 121.264 -0.897 . . . . 0.0 109.975 179.383 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 8.3 ttmt -89.24 -16.55 30.99 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 120.868 -1.145 . . . . 0.0 112.136 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.454 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 15.5 mm-40 -104.53 22.73 14.46 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 120.583 -1.323 . . . . 0.0 112.158 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.6 tptt 75.75 71.44 0.08 Allowed 'General case' 0 N--CA 1.512 2.643 0 O-C-N 121.149 -0.969 . . . . 0.0 111.903 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.779 ' CD2' HD22 ' A' ' 81' ' ' LEU . 33.2 m-85 -134.1 -63.03 0.74 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.42 -0.8 . . . . 0.0 109.019 179.198 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.842 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -128.36 164.08 23.44 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.485 -0.759 . . . . 0.0 109.26 179.168 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.441 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 3.3 t0 -112.04 107.33 16.24 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.102 -0.999 . . . . 0.0 110.468 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.6 mttt -58.82 -39.59 81.64 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.13 -0.981 . . . . 0.0 109.914 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.597 HD23 HD22 ' A' ' 106' ' ' LEU . 16.2 tp -60.61 -39.3 87.65 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.233 -0.917 . . . . 0.0 110.05 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.43 ' HA ' HD21 ' A' ' 106' ' ' LEU . 61.0 tp -70.11 -48.2 58.58 Favored 'General case' 0 N--CA 1.507 2.4 0 C-N-CA 119.203 -0.999 . . . . 0.0 108.669 179.229 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.441 HG22 ' HD2' ' A' ' 96' ' ' ARG . 62.9 mt -61.34 -38.22 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.434 0 C-N-CA 119.32 -0.952 . . . . 0.0 108.552 178.285 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.99 -39.06 83.31 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.146 -0.971 . . . . 0.0 109.087 178.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.467 ' HB3' HD22 ' A' ' 103' ' ' LEU . 5.8 mmtt -57.7 -41.85 82.5 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.043 -1.036 . . . . 0.0 109.43 179.363 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.418 ' CZ3' ' HG ' ' A' ' 91' ' ' LEU . 4.7 m0 -68.11 -40.21 82.62 Favored 'General case' 0 N--CA 1.506 2.352 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.475 179.296 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.441 ' HD2' HG22 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -66.16 -36.0 81.95 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.274 -0.891 . . . . 0.0 110.229 179.503 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.2 mmtp -53.84 -179.41 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.637 0 O-C-N 121.075 -1.016 . . . . 0.0 110.471 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -106.03 141.26 37.7 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.308 -0.87 . . . . 0.0 109.58 179.428 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.36 -20.49 49.62 Favored Glycine 0 N--CA 1.491 2.366 0 C-N-CA 119.854 -1.165 . . . . 0.0 110.608 -179.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -92.55 57.06 2.85 Favored 'General case' 0 N--CA 1.504 2.233 0 CA-C-N 119.313 1.556 . . . . 0.0 110.282 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -74.93 -38.57 61.76 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.009 -1.057 . . . . 0.0 109.66 179.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -111.91 83.95 1.88 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.239 -0.913 . . . . 0.0 109.602 179.583 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.881 HD13 HD13 ' A' ' 109' ' ' ILE . 9.3 tp -121.02 137.39 54.67 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.268 -0.895 . . . . 0.0 110.017 -179.293 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.439 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.8 p -111.6 -38.54 4.88 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.208 -0.932 . . . . 0.0 112.327 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.819 ' O ' HD11 ' A' ' 103' ' ' LEU . 5.5 m -139.65 -168.71 2.54 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 120.25 -1.531 . . . . 0.0 109.884 178.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.597 HD22 HD23 ' A' ' 90' ' ' LEU . 12.4 mt -97.59 -37.98 9.72 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.006 -1.059 . . . . 0.0 110.557 179.425 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.8 ttt-85 -101.89 32.2 3.54 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.939 -1.101 . . . . 0.0 109.464 178.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.672 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.306 1.7 t -127.36 16.22 7.13 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.231 -0.918 . . . . 0.0 109.119 -179.21 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.881 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -159.77 39.21 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 O-C-N 120.905 -1.122 . . . . 0.0 110.1 -178.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.769 ' C ' HG23 ' A' ' 119' ' ' THR . 1.7 tt0 . . . . . 0 N--CA 1.501 2.113 0 O-C-N 120.813 -1.179 . . . . 0.0 111.124 -178.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.769 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.3 OUTLIER . . . . . 0 N--CA 1.494 1.739 0 CA-C-O 120.76 0.314 . . . . 0.0 110.198 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.462 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 42.5 t -106.59 155.49 19.57 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.25 -0.906 . . . . 0.0 109.282 178.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.793 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -71.22 -36.81 63.66 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.336 0 O-C-N 121.098 -1.001 . . . . 0.0 110.757 -179.637 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.439 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 5.1 p -54.92 -32.68 61.44 Favored 'General case' 0 N--CA 1.512 2.636 0 O-C-N 120.84 -1.163 . . . . 0.0 110.968 -179.161 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.45 ' HG2' HG22 ' A' ' 109' ' ' ILE . 0.0 OUTLIER -58.5 -35.59 72.47 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.914 -1.116 . . . . 0.0 109.378 178.171 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 55.8 t -79.92 125.42 82.01 Favored Pre-proline 0 N--CA 1.503 2.187 0 O-C-N 121.21 -0.931 . . . . 0.0 109.478 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -64.94 167.94 14.78 Favored 'Trans proline' 0 N--CA 1.488 1.173 0 O-C-N 123.145 1.076 . . . . 0.0 110.662 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.03 -36.86 61.86 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.259 -0.901 . . . . 0.0 110.794 -179.529 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.11 -40.37 81.02 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.045 -1.035 . . . . 0.0 110.077 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -68.14 -41.52 81.5 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.201 -0.937 . . . . 0.0 109.323 179.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.781 HD11 HD11 ' A' ' 121' ' ' ILE . 10.9 mt -62.49 -38.48 90.05 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.496 -0.882 . . . . 0.0 109.859 179.495 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -59.98 -40.32 88.73 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.081 -1.012 . . . . 0.0 109.958 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -64.3 -38.96 92.88 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.174 -0.954 . . . . 0.0 109.822 179.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -60.61 -39.94 89.99 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.24 -0.913 . . . . 0.0 109.99 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.08 -45.06 95.18 Favored 'General case' 0 N--CA 1.508 2.452 0 C-N-CA 119.351 -0.94 . . . . 0.0 109.85 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 10.2 ttp85 -60.83 -39.05 87.58 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.203 -0.936 . . . . 0.0 109.789 179.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 27.8 mtmt -61.86 -34.38 75.89 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.144 -0.973 . . . . 0.0 110.602 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 29.4 mttt -102.49 18.48 21.06 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.005 -1.059 . . . . 0.0 111.921 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 55.35 45.45 83.34 Favored Glycine 0 N--CA 1.498 2.792 0 O-C-N 120.607 -1.308 . . . . 0.0 110.38 179.491 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.8 t -140.67 -163.44 1.53 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.171 -1.194 . . . . 0.0 110.079 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -138.51 145.41 40.73 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.184 -0.948 . . . . 0.0 110.253 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.571 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.6 p -132.03 160.85 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 O-C-N 121.147 -0.971 . . . . 0.0 110.109 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 41.4 t -168.8 80.68 0.14 Allowed 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.22 -0.925 . . . . 0.0 111.149 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.781 ' CG ' HD12 ' A' ' 121' ' ' ILE . 49.6 t80 -94.4 159.8 14.95 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.222 -0.924 . . . . 0.0 110.195 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 28.8 m170 -136.16 -61.13 0.71 Allowed 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 178.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -136.79 152.6 50.48 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.459 -0.776 . . . . 0.0 109.357 179.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 26.2 p -94.74 155.65 16.74 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.156 -0.965 . . . . 0.0 110.904 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.8 p -74.15 -25.28 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.532 0 O-C-N 121.344 -0.848 . . . . 0.0 111.583 -179.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -50.59 -46.68 58.04 Favored 'General case' 0 N--CA 1.517 2.896 0 O-C-N 120.755 -1.216 . . . . 0.0 109.594 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.498 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 29.5 p -141.5 -178.58 5.7 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.411 -0.806 . . . . 0.0 110.411 179.315 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -91.02 62.21 2.93 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 107.781 -2.128 . . . . 0.0 107.781 178.116 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.5 t -105.68 138.77 41.33 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.382 -1.069 . . . . 0.0 109.626 -178.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 3.7 tpt85 -92.65 57.05 2.81 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.276 -0.89 . . . . 0.0 109.727 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 61.82 96.25 0.01 OUTLIER Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.739 -1.344 . . . . 0.0 109.739 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.3 p -104.71 128.51 52.82 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.308 -1.113 . . . . 0.0 110.401 179.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -138.44 142.67 39.5 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.168 -0.957 . . . . 0.0 109.85 -179.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.495 1.788 0 O-C-N 121.205 -0.934 . . . . 0.0 110.174 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.726 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.503 2.183 0 CA-C-O 120.453 0.168 . . . . 0.0 110.691 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.56 162.63 40.83 Favored 'Trans proline' 0 C--N 1.318 -1.039 0 O-C-N 123.245 1.129 . . . . 0.0 110.675 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -48.77 -32.14 8.13 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 121.466 -0.771 . . . . 0.0 111.325 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -54.31 -33.42 52.73 Favored Glycine 0 N--CA 1.499 2.847 0 O-C-N 121.067 -1.021 . . . . 0.0 110.572 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -53.51 -31.48 46.27 Favored 'General case' 0 N--CA 1.512 2.662 0 O-C-N 120.903 -1.351 . . . . 0.0 110.818 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -54.37 -36.97 64.45 Favored 'General case' 0 N--CA 1.513 2.711 0 O-C-N 121.038 -1.039 . . . . 0.0 110.33 179.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.6 mmmt -57.14 -35.02 69.0 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.262 -0.899 . . . . 0.0 110.406 179.424 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.656 ' O ' HD12 ' A' ' 23' ' ' LEU . 3.2 pt -117.32 37.55 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.137 -0.977 . . . . 0.0 110.366 179.577 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.435 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 2.7 tmtt? -83.79 -42.91 0.79 Allowed Pre-proline 0 N--CA 1.507 2.394 0 O-C-N 121.142 -0.974 . . . . 0.0 113.254 -179.155 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.435 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.4 Cg_endo -75.85 -39.68 0.89 Allowed 'Trans proline' 0 N--CA 1.487 1.118 0 O-C-N 122.615 0.797 . . . . 0.0 111.853 -178.306 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.806 HG21 ' CE2' ' A' ' 62' ' ' TYR . 90.7 m -59.39 -43.25 92.96 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 120.906 -1.121 . . . . 0.0 109.952 -179.695 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.656 HD12 ' O ' ' A' ' 19' ' ' ILE . 3.6 mt -63.48 -37.8 88.67 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 119.425 -0.91 . . . . 0.0 109.506 179.304 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.3 m -56.63 -34.82 67.65 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.058 -1.026 . . . . 0.0 110.353 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.11 -38.81 73.95 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.004 -1.06 . . . . 0.0 110.014 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.723 ' CD2' HD22 ' A' ' 55' ' ' LEU . 22.6 m-85 -57.85 -40.09 79.28 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.121 -0.987 . . . . 0.0 110.025 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -57.02 -27.64 61.8 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.267 -0.896 . . . . 0.0 111.066 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.499 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.7 mp -78.09 -35.7 20.53 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.386 0 O-C-N 120.996 -1.065 . . . . 0.0 109.423 179.392 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.1 tp60 -79.78 -39.85 30.0 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 120.985 -1.072 . . . . 0.0 108.61 178.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.131 HD11 HG23 ' A' ' 52' ' ' ILE . 6.6 tp -69.6 -34.31 73.93 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.235 -0.916 . . . . 0.0 110.369 179.103 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -71.01 -35.54 72.07 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 120.885 -1.134 . . . . 0.0 109.953 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -65.44 -38.58 90.29 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.062 -1.024 . . . . 0.0 110.006 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.431 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -73.81 -42.02 61.51 Favored 'General case' 0 N--CA 1.504 2.251 0 C-N-CA 118.975 -1.09 . . . . 0.0 109.097 179.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -63.76 -33.19 75.1 Favored 'General case' 0 N--CA 1.505 2.322 0 C-N-CA 119.471 -0.892 . . . . 0.0 110.129 179.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.1 mttm -82.16 -31.35 30.53 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 120.857 -1.152 . . . . 0.0 110.893 179.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.3 t70 . . . . . 0 N--CA 1.512 2.653 0 O-C-N 120.97 -1.081 . . . . 0.0 110.709 179.985 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.499 1.993 0 CA-C-O 120.648 0.261 . . . . 0.0 110.434 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.416 ' O ' ' CG ' ' A' ' 50' ' ' TRP . 35.7 m120 -57.92 -40.01 79.36 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.168 -0.958 . . . . 0.0 109.924 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -66.13 -42.88 88.55 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.163 -0.96 . . . . 0.0 109.59 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.401 ' CG ' ' HA ' ' A' ' 33' ' ' ALA . 49.5 tp60 -68.51 -40.58 80.78 Favored 'General case' 0 N--CA 1.505 2.278 0 C-N-CA 119.293 -0.963 . . . . 0.0 109.347 179.283 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.586 HD23 HD12 ' A' ' 52' ' ' ILE . 13.1 mt -63.41 -36.85 85.1 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.238 -0.914 . . . . 0.0 109.924 179.574 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.516 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 53.6 m0 -58.04 -37.28 74.06 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 120.955 -1.09 . . . . 0.0 109.908 179.663 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -30.17 71.32 Favored 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 119.125 -1.03 . . . . 0.0 109.516 178.181 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 1.131 HG23 HD11 ' A' ' 30' ' ' LEU . 17.7 mt -69.61 -58.66 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.268 0 O-C-N 120.875 -1.14 . . . . 0.0 109.181 179.371 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.8 ptm -61.48 -29.96 70.31 Favored 'General case' 0 N--CA 1.51 2.557 0 C-N-CA 118.462 -1.295 . . . . 0.0 109.779 179.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -65.92 -38.23 88.13 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 120.887 -1.133 . . . . 0.0 109.167 178.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.723 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.3 mt -53.3 -32.23 47.82 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 120.962 -1.086 . . . . 0.0 110.182 179.108 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.461 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 72.6 t60 -55.61 -38.23 69.17 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 120.982 -1.074 . . . . 0.0 110.113 179.634 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.422 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.3 m170 -58.57 -47.17 85.18 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.091 -1.006 . . . . 0.0 109.412 179.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 -61.26 -35.64 77.82 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 119.407 -0.917 . . . . 0.0 109.219 178.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.459 ' HD3' ' CD1' ' A' ' 26' ' ' PHE . 20.2 mmm-85 -63.9 -51.14 65.88 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.105 -0.997 . . . . 0.0 109.37 179.212 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 52.0 p -60.58 -39.63 88.74 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.22 -0.925 . . . . 0.0 109.661 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.3 ttt85 -65.18 -41.76 94.28 Favored 'General case' 0 N--CA 1.504 2.255 0 C-N-CA 119.115 -1.034 . . . . 0.0 109.012 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.806 ' CE2' HG21 ' A' ' 22' ' ' THR . 46.1 t80 -63.37 -50.06 71.42 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.244 -0.91 . . . . 0.0 109.502 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.578 HD12 ' HB2' ' A' ' 87' ' ' ALA . 84.9 mt -70.2 -37.68 72.31 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.292 0 O-C-N 121.211 -0.931 . . . . 0.0 109.524 179.451 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.461 ' HD2' HD13 ' A' ' 92' ' ' ILE . 12.9 t80 -67.56 -42.17 83.04 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.168 -0.958 . . . . 0.0 108.995 179.04 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.404 ' HA ' ' HD3' ' A' ' 69' ' ' LYS . 90.0 m -61.19 -40.76 95.14 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.123 -0.986 . . . . 0.0 110.322 -179.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.599 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.35 -33.28 25.89 Favored 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 118.894 -1.122 . . . . 0.0 112.504 -178.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.502 ' N ' HD12 ' A' ' 66' ' ' LEU . 45.6 t80 -86.35 -32.12 21.15 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 120.611 -1.305 . . . . 0.0 111.927 -179.295 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -98.34 -18.98 18.04 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 120.874 -1.141 . . . . 0.0 112.721 -178.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.404 ' HD3' ' HA ' ' A' ' 65' ' ' THR . 13.5 mtpt -119.38 -58.77 1.89 Allowed 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.483 -1.385 . . . . 0.0 110.794 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.41 ' HB3' ' HA ' ' A' ' 66' ' ' LEU . 5.8 tpt180 -64.53 -30.59 71.62 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.11 -0.994 . . . . 0.0 110.99 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt 57.51 41.8 25.36 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 120.815 -1.178 . . . . 0.0 110.056 -179.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.07 35.46 3.93 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.409 -0.807 . . . . 0.0 109.941 179.288 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.81 HG13 HD23 ' A' ' 77' ' ' LEU . 13.8 tt -152.83 162.19 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.145 -0.972 . . . . 0.0 109.874 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.0 m -109.64 147.58 32.82 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.038 -1.039 . . . . 0.0 110.133 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.7 ttmt -45.81 -32.42 2.56 Favored 'General case' 0 N--CA 1.514 2.774 0 O-C-N 121.317 -0.865 . . . . 0.0 111.556 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.75 -50.28 73.02 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 120.987 -1.071 . . . . 0.0 109.205 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.81 HD23 HG13 ' A' ' 73' ' ' ILE . 41.7 tp -67.24 -44.48 79.35 Favored 'General case' 0 N--CA 1.505 2.292 0 C-N-CA 119.208 -0.997 . . . . 0.0 108.354 178.708 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.436 ' HA ' HD12 ' A' ' 81' ' ' LEU . 14.3 t80 -59.97 -37.58 80.04 Favored 'General case' 0 N--CA 1.507 2.397 0 C-N-CA 119.628 -0.829 . . . . 0.0 109.511 179.117 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.455 ' O ' HG22 ' A' ' 82' ' ' ILE . 32.3 t70 -75.22 -40.93 58.65 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.141 -0.974 . . . . 0.0 108.902 178.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.726 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 87.4 t90 -59.26 -37.83 78.6 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.05 -1.031 . . . . 0.0 109.263 178.744 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.54 HD23 ' CE2' ' A' ' 86' ' ' TYR . 11.4 mt -66.68 -57.28 7.48 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.188 -0.945 . . . . 0.0 109.057 178.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.553 HD11 ' N ' ' A' ' 89' ' ' LYS . 0.7 OUTLIER -56.01 -27.36 22.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.406 0 O-C-N 121.228 -0.92 . . . . 0.0 110.837 -179.877 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.9 tttt -89.52 -16.75 30.02 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 120.938 -1.101 . . . . 0.0 111.919 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.445 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 76.3 mm-40 -104.89 25.72 10.1 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.516 -1.365 . . . . 0.0 111.98 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.403 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 18.8 ttmt 76.64 66.92 0.05 Allowed 'General case' 0 N--CA 1.511 2.623 0 O-C-N 121.198 -0.938 . . . . 0.0 112.053 179.274 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.609 ' HE2' HD13 ' A' ' 23' ' ' LEU . 26.1 m-85 -129.95 -63.31 0.92 Allowed 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 178.751 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.578 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -135.75 171.21 14.78 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.497 -0.752 . . . . 0.0 109.23 179.164 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.461 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 11.0 t0 -119.49 111.72 18.46 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.151 -0.968 . . . . 0.0 110.273 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.553 ' N ' HD11 ' A' ' 82' ' ' ILE . 8.3 mtpt -57.58 -37.93 73.99 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.207 -0.933 . . . . 0.0 110.077 179.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.489 HD23 HD22 ' A' ' 106' ' ' LEU . 17.5 tp -59.08 -37.16 76.44 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.181 -0.949 . . . . 0.0 110.163 179.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.442 ' HA ' HD21 ' A' ' 106' ' ' LEU . 58.8 tp -70.03 -49.34 52.29 Favored 'General case' 0 N--CA 1.506 2.354 0 C-N-CA 119.231 -0.988 . . . . 0.0 108.764 179.275 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.461 HD13 ' HD2' ' A' ' 64' ' ' TYR . 68.1 mt -57.57 -38.51 64.37 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.52 0 O-C-N 121.148 -0.97 . . . . 0.0 108.693 178.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.04 -41.59 86.29 Favored 'General case' 0 N--CA 1.502 2.165 0 C-N-CA 119.356 -0.938 . . . . 0.0 108.742 178.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 8.3 mmtm -53.21 -39.84 64.02 Favored 'General case' 0 N--CA 1.512 2.669 0 O-C-N 121.162 -0.961 . . . . 0.0 109.892 179.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 3.6 m0 -68.85 -26.48 65.17 Favored 'General case' 0 N--CA 1.508 2.447 0 C-N-CA 119.436 -0.906 . . . . 0.0 110.723 179.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.49 -33.84 25.48 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 120.809 -1.182 . . . . 0.0 110.776 179.48 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? -53.26 -177.7 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.767 0 O-C-N 120.992 -1.068 . . . . 0.0 110.793 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -102.55 146.86 27.53 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.237 -0.914 . . . . 0.0 109.525 179.1 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 86.0 0.31 87.34 Favored Glycine 0 N--CA 1.495 2.619 0 C-N-CA 119.979 -1.105 . . . . 0.0 111.277 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.583 ' HB3' HD23 ' A' ' 103' ' ' LEU . 48.4 m-85 -111.06 67.17 0.64 Allowed 'General case' 0 N--CA 1.498 1.936 0 CA-C-N 119.576 1.688 . . . . 0.0 109.593 179.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -96.17 -35.35 11.34 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.111 -0.993 . . . . 0.0 110.935 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.54 63.0 0.77 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.021 -1.049 . . . . 0.0 110.895 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.583 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.5 pp -111.95 154.61 25.0 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.932 -1.105 . . . . 0.0 109.798 179.319 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.422 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.4 p -115.6 -30.47 6.16 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -178.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.634 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.5 m -142.09 -167.45 2.47 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 120.052 -1.655 . . . . 0.0 110.087 179.399 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.489 HD22 HD23 ' A' ' 90' ' ' LEU . 13.6 mt -95.53 -40.13 9.61 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.142 -0.974 . . . . 0.0 109.89 179.17 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -101.15 28.51 5.3 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.044 -1.035 . . . . 0.0 110.067 178.189 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.634 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.8 t -126.92 15.6 7.4 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.047 -1.033 . . . . 0.0 109.112 -179.584 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.501 HG22 ' HG3' ' A' ' 123' ' ' ARG . 1.0 OUTLIER -159.34 38.75 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 O-C-N 120.931 -1.106 . . . . 0.0 110.345 -178.783 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.695 ' C ' HG23 ' A' ' 119' ' ' THR . 1.2 tt0 . . . . . 0 N--CA 1.501 2.118 0 O-C-N 120.79 -1.194 . . . . 0.0 111.452 -178.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.695 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.718 0 CA-C-O 120.855 0.36 . . . . 0.0 110.476 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.458 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 48.5 t -109.25 155.48 21.07 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.359 -0.838 . . . . 0.0 109.116 178.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.962 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -73.65 -30.83 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 121.026 -1.046 . . . . 0.0 111.475 -179.163 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.478 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.4 p -59.79 -35.85 75.51 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 120.598 -1.314 . . . . 0.0 110.486 -179.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.501 ' HG3' HG22 ' A' ' 109' ' ' ILE . 0.1 OUTLIER -57.03 -33.13 66.88 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.041 -1.037 . . . . 0.0 109.961 178.807 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 61.6 t -79.78 123.93 83.65 Favored Pre-proline 0 N--CA 1.504 2.25 0 O-C-N 121.062 -1.024 . . . . 0.0 109.965 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.462 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.8 Cg_endo -66.33 -178.22 1.08 Allowed 'Trans proline' 0 N--CA 1.488 1.149 0 O-C-N 123.112 1.059 . . . . 0.0 110.785 179.574 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -75.06 -38.0 61.48 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.208 -0.932 . . . . 0.0 110.413 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.1 -43.37 91.87 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.052 -1.03 . . . . 0.0 109.95 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 64.1 tp60 -67.3 -41.54 85.21 Favored 'General case' 0 N--CA 1.506 2.331 0 C-N-CA 119.296 -0.962 . . . . 0.0 109.298 179.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.497 HD11 HD11 ' A' ' 121' ' ' ILE . 4.6 mt -63.44 -38.95 93.11 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.274 -0.891 . . . . 0.0 109.508 179.195 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -59.07 -39.55 82.43 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.058 -1.026 . . . . 0.0 109.989 179.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -58.59 -38.04 77.08 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.122 -0.986 . . . . 0.0 110.212 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -59.98 -41.99 93.23 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.177 -0.952 . . . . 0.0 110.048 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.662 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -61.49 -45.12 95.57 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.17 -0.956 . . . . 0.0 109.809 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 14.2 mmt180 -59.58 -39.26 83.55 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.155 -0.966 . . . . 0.0 109.9 179.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 3.4 ttmt -58.82 -35.75 73.39 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.148 -0.97 . . . . 0.0 110.515 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 43.8 mttt -107.74 21.62 17.16 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 120.961 -1.087 . . . . 0.0 111.827 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.5 46.26 58.57 Favored Glycine 0 N--CA 1.499 2.888 0 O-C-N 120.695 -1.253 . . . . 0.0 110.656 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.662 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 9.0 t -141.03 -165.06 1.87 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.155 -1.203 . . . . 0.0 110.176 179.822 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -126.54 171.98 10.62 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.12 -0.988 . . . . 0.0 110.355 -179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 8.7 p -157.06 160.94 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.326 -0.859 . . . . 0.0 110.664 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 27.3 t -167.58 107.31 0.57 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.185 -0.947 . . . . 0.0 110.911 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.962 ' CD1' HD12 ' A' ' 121' ' ' ILE . 84.2 t80 -108.79 160.23 16.14 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.247 -0.908 . . . . 0.0 111.035 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -138.61 -61.03 0.59 Allowed 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -142.15 149.12 39.35 Favored 'General case' 0 N--CA 1.495 1.821 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 178.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . 0.415 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 29.6 p -89.88 153.88 20.3 Favored 'General case' 0 N--CA 1.506 2.342 0 C-N-CA 119.078 -1.049 . . . . 0.0 111.187 -179.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 19.6 m -72.54 -23.43 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 121.428 -0.795 . . . . 0.0 111.385 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -51.52 -62.6 1.52 Allowed 'General case' 0 N--CA 1.513 2.723 0 O-C-N 120.781 -1.2 . . . . 0.0 110.021 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.516 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 21.9 p -123.9 -164.5 1.24 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.27 -0.894 . . . . 0.0 110.321 179.255 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . 0.434 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -101.58 64.45 0.5 Allowed Glycine 0 N--CA 1.493 2.462 0 N-CA-C 107.897 -2.081 . . . . 0.0 107.897 178.501 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 28.4 t -104.36 141.42 36.35 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.314 -1.109 . . . . 0.0 109.965 -179.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 46.0 ttt180 -97.06 51.01 1.1 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.271 -0.893 . . . . 0.0 109.476 179.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.2 99.32 0.05 OUTLIER Glycine 0 N--CA 1.486 2.028 0 N-CA-C 109.969 -1.252 . . . . 0.0 109.969 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 26.2 p -110.19 126.37 54.04 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.269 -1.136 . . . . 0.0 110.148 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -150.33 148.44 28.82 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.038 -1.039 . . . . 0.0 110.472 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.501 2.092 0 O-C-N 121.26 -0.9 . . . . 0.0 110.562 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.757 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.504 2.235 0 N-CA-C 110.394 -0.224 . . . . 0.0 110.394 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.01 163.77 38.09 Favored 'Trans proline' 0 C--N 1.317 -1.095 0 O-C-N 123.387 1.204 . . . . 0.0 110.718 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -48.27 -32.39 7.22 Favored 'General case' 0 N--CA 1.516 2.841 0 O-C-N 121.435 -0.791 . . . . 0.0 111.426 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.81 -34.89 51.77 Favored Glycine 0 N--CA 1.498 2.812 0 O-C-N 120.967 -1.083 . . . . 0.0 110.417 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.436 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 27.3 t80 -55.17 -33.14 62.72 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 121.039 -1.271 . . . . 0.0 110.739 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.7 tm-20 -54.4 -38.06 65.78 Favored 'General case' 0 N--CA 1.511 2.623 0 O-C-N 120.984 -1.073 . . . . 0.0 110.206 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.8 mttm -59.06 -35.62 73.65 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.257 -0.902 . . . . 0.0 110.21 179.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.64 ' O ' HD12 ' A' ' 23' ' ' LEU . 1.9 pt -117.99 37.07 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 121.074 -1.016 . . . . 0.0 110.34 179.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.432 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 2.5 tmtt? -84.82 -43.35 0.69 Allowed Pre-proline 0 N--CA 1.509 2.488 0 O-C-N 121.12 -0.988 . . . . 0.0 113.379 -179.041 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.432 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.7 Cg_endo -76.3 -37.15 1.52 Allowed 'Trans proline' 0 N--CA 1.486 1.065 0 O-C-N 122.586 0.782 . . . . 0.0 111.892 -178.018 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.67 HG21 ' CE2' ' A' ' 62' ' ' TYR . 88.2 m -59.85 -42.07 92.84 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 120.919 -1.113 . . . . 0.0 110.131 -179.579 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.704 HD13 ' HE2' ' A' ' 86' ' ' TYR . 2.4 mt -64.85 -39.07 92.98 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 119.387 -0.925 . . . . 0.0 109.577 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.0 -35.59 69.4 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.159 -0.963 . . . . 0.0 110.247 179.502 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -57.24 -36.33 70.8 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.056 -1.027 . . . . 0.0 110.389 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.528 ' CD2' HD22 ' A' ' 55' ' ' LEU . 15.5 m-85 -59.05 -39.64 82.64 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.07 -1.019 . . . . 0.0 110.525 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -59.45 -39.43 83.6 Favored 'General case' 0 N--CA 1.508 2.427 0 C-N-CA 119.362 -0.935 . . . . 0.0 110.42 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.431 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.1 mp -65.37 -41.78 92.04 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.341 0 C-N-CA 119.204 -0.998 . . . . 0.0 108.764 179.452 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.66 -50.83 40.31 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.209 -0.997 . . . . 0.0 108.443 178.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.054 HD11 HG23 ' A' ' 52' ' ' ILE . 5.2 tp -58.9 -34.53 71.78 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.25 -0.906 . . . . 0.0 109.502 178.404 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.08 -39.8 79.47 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 121.061 -1.025 . . . . 0.0 110.194 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -63.03 -51.12 67.97 Favored 'General case' 0 N--CA 1.507 2.403 0 C-N-CA 119.27 -0.972 . . . . 0.0 109.57 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.495 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -68.26 -38.71 82.03 Favored 'General case' 0 N--CA 1.505 2.314 0 C-N-CA 119.249 -0.98 . . . . 0.0 109.262 179.031 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -67.41 -34.04 76.42 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.207 -0.933 . . . . 0.0 110.117 179.293 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 9.2 mmtt -78.79 -38.03 39.44 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.0 -1.063 . . . . 0.0 110.293 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.8 t70 . . . . . 0 N--CA 1.509 2.515 0 O-C-N 121.06 -1.025 . . . . 0.0 110.162 179.833 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.497 1.923 0 CA-C-O 120.679 0.275 . . . . 0.0 110.406 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -56.87 -39.44 74.33 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 121.167 -0.958 . . . . 0.0 109.962 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -61.48 -40.53 94.86 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.238 -0.914 . . . . 0.0 109.766 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 49.7 tp60 -61.4 -40.54 94.74 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.147 -0.971 . . . . 0.0 109.848 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -60.01 -39.19 84.94 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.124 -0.985 . . . . 0.0 110.083 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.505 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.8 m0 -58.09 -37.03 73.74 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.011 -1.055 . . . . 0.0 110.023 179.603 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -60.59 -30.36 69.76 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.081 -1.012 . . . . 0.0 110.089 178.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 1.054 HG23 HD11 ' A' ' 30' ' ' LEU . 17.1 mt -72.27 -58.78 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.237 0 O-C-N 120.871 -1.143 . . . . 0.0 109.107 179.424 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.3 ptm -60.79 -29.53 69.5 Favored 'General case' 0 N--CA 1.509 2.515 0 C-N-CA 118.52 -1.272 . . . . 0.0 109.684 178.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -70.33 -38.91 74.98 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 120.904 -1.122 . . . . 0.0 108.931 177.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.528 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.3 mt -53.69 -31.53 48.29 Favored 'General case' 0 N--CA 1.512 2.642 0 O-C-N 121.058 -1.026 . . . . 0.0 110.3 178.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.451 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 3.9 t60 -57.13 -37.38 71.92 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.002 -1.062 . . . . 0.0 110.097 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.489 ' NE2' HD21 ' A' ' 91' ' ' LEU . 5.8 m170 -59.31 -48.67 80.77 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.006 -1.059 . . . . 0.0 109.457 179.044 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.6 tp60 -60.82 -37.27 81.43 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 119.34 -0.944 . . . . 0.0 109.071 178.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.434 ' HD2' ' CD2' ' A' ' 26' ' ' PHE . 11.5 mtp85 -66.36 -51.79 53.58 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.147 -0.971 . . . . 0.0 109.024 178.7 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.453 ' HA ' ' HB1' ' A' ' 87' ' ' ALA . 22.2 p -63.46 -38.78 92.45 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.241 -0.912 . . . . 0.0 109.177 179.156 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -65.18 -38.82 91.72 Favored 'General case' 0 N--CA 1.507 2.41 0 C-N-CA 119.242 -0.983 . . . . 0.0 109.25 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.67 ' CE2' HG21 ' A' ' 22' ' ' THR . 37.1 t80 -60.99 -49.8 75.99 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.155 -0.966 . . . . 0.0 109.313 179.441 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.63 HD12 ' HB2' ' A' ' 87' ' ' ALA . 87.7 mt -74.3 -41.76 50.63 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 C-N-CA 119.42 -0.912 . . . . 0.0 109.128 179.219 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.497 ' CD1' ' CD2' ' A' ' 68' ' ' TYR . 45.8 t80 -60.51 -35.38 75.83 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.259 -0.901 . . . . 0.0 109.653 178.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.401 ' HA ' ' CD ' ' A' ' 69' ' ' LYS . 79.7 m -74.52 -38.24 62.85 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.926 -1.109 . . . . 0.0 110.422 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.561 ' C ' HD12 ' A' ' 66' ' ' LEU . 3.7 pp -83.08 -30.86 27.66 Favored 'General case' 0 N--CA 1.505 2.288 0 C-N-CA 119.028 -1.069 . . . . 0.0 112.512 -179.046 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.482 ' N ' HD12 ' A' ' 66' ' ' LEU . 42.1 t80 -86.04 -33.25 21.07 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 120.634 -1.291 . . . . 0.0 111.724 -179.203 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.497 ' CD2' ' CD1' ' A' ' 64' ' ' TYR . 29.4 m-85 -97.4 -25.73 15.11 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.708 -1.245 . . . . 0.0 112.432 -178.774 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.401 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 4.6 mttt -113.37 -60.14 1.92 Allowed 'General case' 0 N--CA 1.501 2.078 0 O-C-N 120.659 -1.275 . . . . 0.0 111.131 -179.645 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.418 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 3.0 ttt85 -62.68 -31.06 71.88 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.127 -0.983 . . . . 0.0 110.641 -179.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.1 tttt 58.29 44.33 18.78 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 120.813 -1.18 . . . . 0.0 110.001 -179.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.33 36.36 3.59 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.358 -0.839 . . . . 0.0 109.891 179.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.79 HG13 HD23 ' A' ' 77' ' ' LEU . 14.2 tt -157.32 162.53 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.206 -0.934 . . . . 0.0 110.175 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.56 149.49 29.57 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.164 -0.96 . . . . 0.0 110.232 179.848 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.9 tttt -46.29 -32.35 3.06 Favored 'General case' 0 N--CA 1.515 2.807 0 O-C-N 121.362 -0.836 . . . . 0.0 111.584 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -63.1 -51.96 64.49 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.925 -1.109 . . . . 0.0 109.274 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.79 HD23 HG13 ' A' ' 73' ' ' ILE . 40.5 tp -65.04 -43.48 92.2 Favored 'General case' 0 N--CA 1.506 2.347 0 C-N-CA 119.141 -1.024 . . . . 0.0 108.559 178.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.71 ' HA ' HD12 ' A' ' 81' ' ' LEU . 14.0 t80 -60.99 -41.72 97.03 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.301 -0.875 . . . . 0.0 109.242 179.151 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -70.57 -42.69 70.77 Favored 'General case' 0 N--CA 1.503 2.221 0 C-N-CA 119.321 -0.951 . . . . 0.0 108.518 178.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.757 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 86.6 t90 -56.99 -35.19 68.89 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.338 -0.851 . . . . 0.0 109.519 178.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.71 HD12 ' HA ' ' A' ' 78' ' ' TYR . 13.4 mt -67.53 -57.94 5.6 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.084 -1.01 . . . . 0.0 109.081 179.077 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.417 ' CD1' ' CE1' ' A' ' 78' ' ' TYR . 0.5 OUTLIER -57.24 -27.22 27.45 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.685 0 C-N-CA 119.044 -1.063 . . . . 0.0 109.897 179.218 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -83.34 -20.42 34.35 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 120.885 -1.134 . . . . 0.0 111.391 179.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.437 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 16.5 mm-40 -107.21 22.97 15.17 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 120.652 -1.28 . . . . 0.0 111.989 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 8.1 tttp 74.44 78.45 0.12 Allowed 'General case' 0 N--CA 1.511 2.61 0 O-C-N 121.072 -1.017 . . . . 0.0 111.37 179.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.704 ' HE2' HD13 ' A' ' 23' ' ' LEU . 28.4 m-85 -136.52 -63.79 0.61 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.622 -0.674 . . . . 0.0 109.707 -179.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.63 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -128.5 -173.42 2.95 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.349 -0.844 . . . . 0.0 109.755 179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.451 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 7.8 t0 -126.18 102.57 7.26 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.151 -0.968 . . . . 0.0 110.53 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.6 mtmt -59.37 -38.48 80.57 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 121.184 -0.948 . . . . 0.0 109.95 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.665 HD23 HD13 ' A' ' 106' ' ' LEU . 26.0 tp -60.44 -41.71 94.62 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.194 -0.941 . . . . 0.0 109.864 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.495 ' N ' HD11 ' A' ' 106' ' ' LEU . 60.5 tp -67.01 -49.42 65.38 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.068 -1.02 . . . . 0.0 108.961 179.321 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.482 HG23 ' CE1' ' A' ' 64' ' ' TYR . 40.7 mt -56.81 -36.36 49.32 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.47 0 O-C-N 121.124 -0.985 . . . . 0.0 108.918 178.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.77 -39.64 94.79 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.121 -0.987 . . . . 0.0 109.082 178.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.436 ' HD2' ' CZ ' ' A' ' 100' ' ' TYR . 4.3 mmtt -59.32 -46.58 88.19 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.087 -1.008 . . . . 0.0 109.276 179.274 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.0 m0 -60.17 -37.54 80.48 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.247 -0.908 . . . . 0.0 110.111 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.6 mtp85 -75.14 -31.92 61.21 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.064 -1.023 . . . . 0.0 110.615 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -53.97 -176.9 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.699 0 O-C-N 121.014 -1.054 . . . . 0.0 110.572 179.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 2.4 m -102.89 133.38 48.08 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.183 -0.948 . . . . 0.0 109.751 179.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.39 9.09 57.08 Favored Glycine 0 N--CA 1.493 2.486 0 C-N-CA 120.152 -1.023 . . . . 0.0 111.242 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.486 ' HB3' HD23 ' A' ' 103' ' ' LEU . 51.4 m-85 -116.08 69.02 0.73 Allowed 'General case' 0 N--CA 1.495 1.801 0 CA-C-N 119.569 1.685 . . . . 0.0 109.971 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -97.29 -35.25 10.79 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.143 -0.973 . . . . 0.0 110.915 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.98 71.88 0.95 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.999 -1.063 . . . . 0.0 110.8 -179.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.486 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.3 pp -123.58 161.78 24.3 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.038 -1.039 . . . . 0.0 109.946 179.38 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.483 ' N ' HD12 ' A' ' 103' ' ' LEU . 26.8 p -120.48 -33.0 3.95 Favored 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -178.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.626 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.8 m -140.92 -168.39 2.59 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.067 -1.646 . . . . 0.0 110.162 179.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.665 HD13 HD23 ' A' ' 90' ' ' LEU . 13.2 mt -95.47 -39.4 10.0 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.235 -0.916 . . . . 0.0 109.909 178.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 9.3 ttm180 -101.15 27.23 6.28 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.913 -1.117 . . . . 0.0 110.271 178.174 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.626 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.287 1.8 t -124.82 14.38 8.6 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.054 -1.029 . . . . 0.0 109.213 -179.779 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.458 HG23 ' C ' ' A' ' 108' ' ' CYS . 1.0 OUTLIER -158.67 35.64 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.339 0 O-C-N 120.714 -1.241 . . . . 0.0 111.116 -178.8 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.59 ' O ' HG23 ' A' ' 119' ' ' THR . 12.3 mt-30 . . . . . 0 N--CA 1.5 2.038 0 O-C-N 120.604 -1.31 . . . . 0.0 111.498 -178.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.59 HG23 ' O ' ' A' ' 110' ' ' GLN . 2.8 m . . . . . 0 N--CA 1.494 1.763 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 46.7 t -101.49 155.55 18.01 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.259 -0.9 . . . . 0.0 109.785 179.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.815 HD12 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -71.64 -37.47 63.33 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.347 0 O-C-N 121.087 -1.008 . . . . 0.0 110.682 -179.554 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.463 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 9.2 p -52.82 -32.98 47.13 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 120.953 -1.092 . . . . 0.0 111.262 -178.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -33.19 68.71 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 120.907 -1.121 . . . . 0.0 109.852 178.34 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 48.4 t -81.11 125.73 78.85 Favored Pre-proline 0 N--CA 1.503 2.216 0 O-C-N 121.1 -1.0 . . . . 0.0 109.746 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.661 ' HD3' ' HB1' ' A' ' 154' ' ' ALA . 38.1 Cg_endo -65.91 172.02 9.04 Favored 'Trans proline' 0 N--CA 1.489 1.224 0 O-C-N 123.145 1.076 . . . . 0.0 110.815 179.696 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 5.1 tpt180 -75.07 -37.88 61.47 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.304 -0.873 . . . . 0.0 110.426 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.53 -40.28 78.45 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.071 -1.018 . . . . 0.0 110.107 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -69.41 -40.89 77.03 Favored 'General case' 0 N--CA 1.505 2.302 0 C-N-CA 119.344 -0.942 . . . . 0.0 109.333 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.663 ' O ' HG11 ' A' ' 140' ' ' VAL . 4.3 mt -67.14 -38.93 86.39 Favored 'General case' 0 N--CA 1.507 2.377 0 C-N-CA 119.494 -0.882 . . . . 0.0 109.591 179.254 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -65.96 -40.07 90.96 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.133 -0.98 . . . . 0.0 109.573 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.71 -39.64 94.66 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.165 -0.959 . . . . 0.0 109.791 179.551 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -60.41 -41.78 94.64 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.287 -0.883 . . . . 0.0 110.031 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.41 -40.63 91.69 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.223 -0.923 . . . . 0.0 110.025 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -60.16 -39.59 86.94 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.239 -0.913 . . . . 0.0 109.95 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -61.76 -34.92 76.71 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.247 -0.908 . . . . 0.0 110.697 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.14 19.24 19.93 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 120.948 -1.095 . . . . 0.0 111.942 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 53.35 41.47 62.7 Favored Glycine 0 N--CA 1.5 2.903 0 O-C-N 120.612 -1.305 . . . . 0.0 110.593 179.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.7 t -131.54 -163.49 1.33 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.091 -1.241 . . . . 0.0 109.969 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -142.1 140.78 32.61 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.131 -0.981 . . . . 0.0 110.494 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.663 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.4 p -131.87 161.2 41.69 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.186 -0.946 . . . . 0.0 109.886 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 33.2 t -167.59 83.25 0.21 Allowed 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.175 -0.953 . . . . 0.0 111.48 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.815 ' CG ' HD12 ' A' ' 121' ' ' ILE . 36.5 t80 -93.56 162.1 14.09 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.187 -0.946 . . . . 0.0 109.943 179.501 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -139.07 -59.51 0.59 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.417 -0.802 . . . . 0.0 109.379 179.129 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.82 152.14 51.51 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.324 -0.86 . . . . 0.0 109.384 179.179 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . 0.408 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 25.1 p -97.19 156.89 16.21 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.21 -0.931 . . . . 0.0 110.894 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 12.9 p -77.83 -22.18 13.84 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.509 0 O-C-N 121.337 -0.852 . . . . 0.0 111.872 -179.472 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -50.96 -57.88 7.44 Favored 'General case' 0 N--CA 1.516 2.839 0 O-C-N 120.834 -1.166 . . . . 0.0 109.9 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.505 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.8 p -128.78 -163.43 1.29 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.303 -0.873 . . . . 0.0 110.279 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.41 65.22 0.57 Allowed Glycine 0 N--CA 1.493 2.435 0 N-CA-C 108.036 -2.026 . . . . 0.0 108.036 178.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 37.3 t -104.59 147.36 27.71 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.31 -1.111 . . . . 0.0 110.297 -178.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 28.7 mtt85 -102.79 42.94 1.11 Allowed 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.327 -0.858 . . . . 0.0 109.482 179.237 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 77.06 96.72 0.19 Allowed Glycine 0 N--CA 1.487 2.08 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 22.7 p -111.53 128.42 56.02 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.23 -1.159 . . . . 0.0 110.554 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . 0.661 ' HB1' ' HD3' ' A' ' 125' ' ' PRO . . . -154.83 145.86 22.68 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.162 -0.962 . . . . 0.0 110.474 -179.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.632 0 O-C-N 121.199 -0.938 . . . . 0.0 110.349 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.676 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.51 2.539 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.405 ' HG2' HD13 ' A' ' 77' ' ' LEU . 45.2 Cg_endo -70.6 162.26 43.13 Favored 'Trans proline' 0 N--CA 1.487 1.13 0 O-C-N 123.335 1.177 . . . . 0.0 110.772 -179.744 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -48.53 -32.03 7.36 Favored 'General case' 0 N--CA 1.514 2.772 0 O-C-N 121.443 -0.786 . . . . 0.0 111.402 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.12 -34.0 38.74 Favored Glycine 0 N--CA 1.499 2.867 0 O-C-N 120.938 -1.101 . . . . 0.0 110.641 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.434 ' CE2' ' HG2' ' A' ' 20' ' ' LYS . 27.2 t80 -55.19 -32.4 62.17 Favored 'General case' 0 N--CA 1.511 2.585 0 O-C-N 120.882 -1.363 . . . . 0.0 110.795 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -53.15 -37.84 62.21 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 120.975 -1.078 . . . . 0.0 110.276 179.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.5 mmtt -59.56 -36.48 76.27 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.579 -0.848 . . . . 0.0 110.213 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.879 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.2 pt -120.79 35.6 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.175 -0.953 . . . . 0.0 110.602 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.434 ' HG2' ' CE2' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -85.22 -43.11 0.66 Allowed Pre-proline 0 N--CA 1.509 2.522 0 O-C-N 121.052 -1.03 . . . . 0.0 113.561 -178.892 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.1 Cg_endo -75.37 -35.86 2.66 Favored 'Trans proline' 0 N--CA 1.486 1.051 0 O-C-N 122.521 0.748 . . . . 0.0 112.007 -177.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.597 HG21 ' CE2' ' A' ' 62' ' ' TYR . 79.5 m -61.83 -46.38 89.75 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 120.982 -1.074 . . . . 0.0 109.945 -179.717 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.879 HD12 ' O ' ' A' ' 19' ' ' ILE . 5.0 mt -60.8 -37.2 81.13 Favored 'General case' 0 N--CA 1.507 2.397 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.812 179.512 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 72.6 m -57.22 -36.45 70.91 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 121.066 -1.021 . . . . 0.0 110.22 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -57.4 -38.82 74.93 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.06 -1.025 . . . . 0.0 110.081 179.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.641 ' CD2' HD22 ' A' ' 55' ' ' LEU . 15.0 m-85 -58.24 -40.03 80.67 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.094 -1.004 . . . . 0.0 110.131 179.697 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -59.18 -24.45 63.09 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.247 -0.908 . . . . 0.0 111.406 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.489 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.8 mp -77.96 -36.22 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.459 0 O-C-N 120.877 -1.14 . . . . 0.0 109.851 179.826 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.583 ' OE1' HD21 ' A' ' 55' ' ' LEU . 44.1 tt0 -80.73 -37.18 30.99 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.006 -1.058 . . . . 0.0 109.311 178.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.724 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -73.74 -31.84 63.55 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.134 -0.979 . . . . 0.0 110.164 179.023 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.401 ' CD ' ' HA ' ' A' ' 28' ' ' ILE . 6.0 ptm85 -71.3 -36.74 71.75 Favored 'General case' 0 N--CA 1.505 2.302 0 C-N-CA 118.738 -1.185 . . . . 0.0 109.724 179.257 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.42 -41.4 98.71 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.069 -1.052 . . . . 0.0 109.168 179.107 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.606 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -68.62 -43.13 77.04 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.221 -0.925 . . . . 0.0 109.05 179.053 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.84 -38.36 85.22 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.312 -0.868 . . . . 0.0 109.604 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -57.7 -34.49 69.5 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 121.125 -0.984 . . . . 0.0 110.467 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.6 t70 . . . . . 0 N--CA 1.511 2.608 0 O-C-N 121.078 -1.014 . . . . 0.0 110.335 179.893 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 68.4 m . . . . . 0 N--CA 1.497 1.895 0 CA-C-O 120.63 0.252 . . . . 0.0 110.392 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -55.54 -37.88 68.54 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.202 -0.936 . . . . 0.0 110.092 179.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -60.32 -39.73 88.07 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.269 -0.894 . . . . 0.0 109.998 179.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.4 tp60 -61.73 -40.9 96.73 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.157 -0.964 . . . . 0.0 109.819 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.477 HD23 HD12 ' A' ' 52' ' ' ILE . 16.9 mt -61.12 -37.86 84.31 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.243 -0.911 . . . . 0.0 110.146 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 49.3 m0 -58.8 -37.75 77.05 Favored 'General case' 0 N--CA 1.511 2.596 0 O-C-N 121.146 -0.971 . . . . 0.0 110.086 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -61.81 -31.02 71.22 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.038 -1.039 . . . . 0.0 109.83 178.614 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.724 HG23 ' CG ' ' A' ' 30' ' ' LEU . 79.3 mt -71.81 -59.25 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.272 0 O-C-N 121.078 -1.014 . . . . 0.0 109.047 179.238 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -60.86 -29.45 69.54 Favored 'General case' 0 N--CA 1.509 2.523 0 C-N-CA 118.626 -1.23 . . . . 0.0 109.948 178.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -70.15 -37.82 75.33 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 120.808 -1.182 . . . . 0.0 109.136 178.277 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.641 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.7 mt -54.35 -33.02 58.16 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.146 -0.971 . . . . 0.0 110.296 179.109 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.454 ' NE2' ' N ' ' A' ' 88' ' ' ASP . 5.5 t60 -55.67 -37.33 68.14 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 120.993 -1.067 . . . . 0.0 110.205 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.446 ' NE2' HD21 ' A' ' 91' ' ' LEU . 6.0 m170 -61.48 -49.81 75.28 Favored 'General case' 0 N--CA 1.507 2.412 0 C-N-CA 119.254 -0.978 . . . . 0.0 109.332 179.231 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -60.33 -38.51 83.97 Favored 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 119.346 -0.942 . . . . 0.0 109.074 178.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.449 ' CD ' ' CD2' ' A' ' 26' ' ' PHE . 9.3 mtp180 -64.42 -51.49 62.89 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.256 -0.902 . . . . 0.0 109.315 178.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.0 p -60.75 -37.5 82.02 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.198 -0.939 . . . . 0.0 109.61 179.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -64.78 -39.76 94.14 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.058 -1.026 . . . . 0.0 109.442 179.17 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.597 ' CE2' HG21 ' A' ' 22' ' ' THR . 26.6 t80 -61.58 -49.19 77.66 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.124 -0.985 . . . . 0.0 109.487 179.491 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.453 ' CG2' ' CD1' ' A' ' 78' ' ' TYR . 74.3 mt -73.34 -41.64 57.34 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.381 0 O-C-N 121.232 -0.918 . . . . 0.0 109.0 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.4 ' O ' ' HB2' ' A' ' 68' ' ' TYR . 66.3 t80 -62.64 -40.44 97.0 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.309 -0.869 . . . . 0.0 109.386 179.303 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 86.7 m -66.53 -40.83 89.32 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.997 -1.064 . . . . 0.0 110.477 -179.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.553 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.2 -32.76 26.37 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 120.922 -1.111 . . . . 0.0 112.643 -178.76 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.491 ' N ' HD12 ' A' ' 66' ' ' LEU . 35.3 t80 -86.28 -32.45 21.08 Favored 'General case' 0 N--CA 1.513 2.697 0 O-C-N 120.635 -1.291 . . . . 0.0 111.953 -178.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.4 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 10.3 m-85 -97.98 -18.19 18.76 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.632 -1.293 . . . . 0.0 112.674 -178.694 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.1 mttm -118.64 -58.92 1.92 Allowed 'General case' 0 N--CA 1.503 2.187 0 O-C-N 120.574 -1.329 . . . . 0.0 110.676 179.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.404 ' HB3' ' HA ' ' A' ' 66' ' ' LEU . 1.1 tpt180 -67.63 -29.25 68.51 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.204 -0.935 . . . . 0.0 110.984 -179.578 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.7 mttt 56.45 42.92 26.83 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 120.858 -1.151 . . . . 0.0 109.971 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.45 34.68 3.8 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.482 -0.761 . . . . 0.0 109.851 179.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.673 HG13 HD23 ' A' ' 77' ' ' LEU . 13.8 tt -152.52 162.6 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.197 -0.94 . . . . 0.0 109.753 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.0 m -108.36 144.81 35.41 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.106 -0.996 . . . . 0.0 110.434 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.4 tttp -45.9 -32.28 2.59 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.302 -0.874 . . . . 0.0 111.636 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.63 -49.67 75.65 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 120.861 -1.149 . . . . 0.0 109.312 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.673 HD23 HG13 ' A' ' 73' ' ' ILE . 37.0 tp -68.24 -44.54 75.45 Favored 'General case' 0 N--CA 1.506 2.348 0 C-N-CA 119.148 -1.021 . . . . 0.0 108.294 178.737 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.453 ' CD1' ' CG2' ' A' ' 63' ' ' ILE . 13.4 t80 -59.78 -37.51 79.28 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.369 -0.832 . . . . 0.0 109.471 179.091 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -71.33 -41.58 69.64 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 120.981 -1.074 . . . . 0.0 108.919 178.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.676 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 63.3 t90 -57.11 -39.59 75.38 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.172 -0.955 . . . . 0.0 109.512 179.095 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.49 HD23 ' CD2' ' A' ' 86' ' ' TYR . 3.7 mp -65.92 -50.85 62.96 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.222 -0.924 . . . . 0.0 109.183 179.127 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.9 mm -56.42 -34.62 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.658 0 O-C-N 121.121 -0.987 . . . . 0.0 110.02 179.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.7 mmtt -89.44 -5.8 57.06 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 120.947 -1.095 . . . . 0.0 112.526 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.436 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 45.9 mm-40 -114.99 24.16 11.95 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 120.447 -1.408 . . . . 0.0 112.05 -179.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.5 tttt 75.45 71.18 0.09 Allowed 'General case' 0 N--CA 1.512 2.657 0 O-C-N 121.159 -0.963 . . . . 0.0 111.724 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.586 ' HE2' HD13 ' A' ' 23' ' ' LEU . 27.2 m-85 -131.56 -62.48 0.87 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.468 -0.77 . . . . 0.0 109.255 179.29 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.443 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -136.49 175.92 9.17 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.49 -0.756 . . . . 0.0 109.528 179.438 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.454 ' N ' ' NE2' ' A' ' 56' ' ' HIS . 13.4 t0 -114.79 108.85 17.31 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.186 -0.946 . . . . 0.0 110.417 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 11.2 mtpp -59.02 -40.32 84.64 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.153 -0.967 . . . . 0.0 109.732 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.731 HD23 HD13 ' A' ' 106' ' ' LEU . 16.0 tp -60.08 -37.84 81.1 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.202 -0.936 . . . . 0.0 109.946 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.446 HD21 ' NE2' ' A' ' 57' ' ' HIS . 64.5 tp -68.82 -50.02 53.61 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.013 -1.054 . . . . 0.0 108.808 179.336 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 50.0 mt -57.85 -36.62 56.29 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.511 0 O-C-N 121.179 -0.951 . . . . 0.0 108.803 178.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.31 -39.7 89.47 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.178 -0.951 . . . . 0.0 109.244 178.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.453 ' HD2' ' CE2' ' A' ' 100' ' ' TYR . 7.0 mmtt -57.8 -46.1 85.13 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.088 -1.008 . . . . 0.0 109.395 179.313 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.1 m0 -58.24 -25.67 61.99 Favored 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 119.186 -1.006 . . . . 0.0 110.484 179.375 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.7 24.46 12.88 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 120.927 -1.108 . . . . 0.0 111.461 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.6 mmtt -92.52 -83.44 0.3 Allowed 'General case' 0 N--CA 1.505 2.284 0 O-C-N 120.694 -1.254 . . . . 0.0 109.897 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.439 HG23 ' O ' ' A' ' 98' ' ' THR . 5.9 t -177.52 128.88 0.15 Allowed 'General case' 0 N--CA 1.506 2.358 0 O-C-N 120.843 -1.161 . . . . 0.0 110.764 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.21 11.81 79.48 Favored Glycine 0 N--CA 1.492 2.376 0 C-N-CA 120.131 -1.033 . . . . 0.0 111.551 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.453 ' CE2' ' HD2' ' A' ' 94' ' ' LYS . 20.0 m-85 -100.5 46.88 0.94 Allowed 'General case' 0 N--CA 1.504 2.261 0 CA-C-N 119.746 1.773 . . . . 0.0 110.239 179.389 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -62.93 -39.96 96.19 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.163 -0.961 . . . . 0.0 109.539 179.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.421 ' HB2' ' OG ' ' A' ' 155' ' ' SER . 1.0 OUTLIER -111.94 100.45 8.9 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.215 -0.928 . . . . 0.0 109.684 179.358 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.925 HD13 HD13 ' A' ' 109' ' ' ILE . 9.6 tp -137.41 132.63 33.73 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.226 -0.921 . . . . 0.0 109.925 -179.385 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.442 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.0 p -109.5 -37.53 5.69 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.286 -0.883 . . . . 0.0 112.197 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.801 ' O ' HD11 ' A' ' 103' ' ' LEU . 7.4 m -140.57 -168.03 2.48 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 120.355 -1.466 . . . . 0.0 110.001 179.018 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.731 HD13 HD23 ' A' ' 90' ' ' LEU . 12.5 mt -97.41 -38.38 9.64 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.007 -1.058 . . . . 0.0 110.489 179.277 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 26.8 ttt85 -102.21 31.64 3.88 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 120.995 -1.066 . . . . 0.0 109.614 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.66 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.305 1.7 t -126.94 15.47 7.4 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.193 -0.942 . . . . 0.0 109.003 -179.279 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.925 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -158.59 36.87 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.361 0 O-C-N 120.799 -1.188 . . . . 0.0 110.844 -178.646 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.592 ' O ' HG23 ' A' ' 119' ' ' THR . 89.3 mt-30 . . . . . 0 N--CA 1.5 2.075 0 O-C-N 120.735 -1.228 . . . . 0.0 111.563 -178.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.592 HG23 ' O ' ' A' ' 110' ' ' GLN . 0.7 OUTLIER . . . . . 0 N--CA 1.497 1.918 0 CA-C-O 120.855 0.359 . . . . 0.0 110.353 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.401 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 44.4 t -105.02 155.26 19.13 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.409 -0.807 . . . . 0.0 109.575 179.394 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.802 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -70.47 -36.28 65.63 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 121.151 -0.968 . . . . 0.0 110.872 -179.374 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.455 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.9 p -54.83 -32.49 60.53 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 120.809 -1.182 . . . . 0.0 110.932 -179.153 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.465 ' HG3' HG22 ' A' ' 109' ' ' ILE . 0.0 OUTLIER -61.26 -34.87 75.87 Favored 'General case' 0 N--CA 1.509 2.525 0 O-C-N 120.986 -1.071 . . . . 0.0 109.415 178.047 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 48.4 t -79.84 126.0 81.0 Favored Pre-proline 0 N--CA 1.504 2.267 0 O-C-N 121.109 -0.994 . . . . 0.0 109.707 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.477 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.7 Cg_endo -65.65 172.3 8.3 Favored 'Trans proline' 0 N--CA 1.489 1.255 0 O-C-N 123.159 1.083 . . . . 0.0 110.795 179.676 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.1 -37.55 61.47 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.287 -0.883 . . . . 0.0 110.548 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.68 -41.0 80.71 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.071 -1.018 . . . . 0.0 110.044 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -69.48 -41.58 75.98 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.175 -0.953 . . . . 0.0 109.187 179.248 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.531 ' CD1' HD11 ' A' ' 121' ' ' ILE . 1.9 mt -65.86 -39.26 90.56 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.258 -0.901 . . . . 0.0 109.455 179.088 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -60.93 -39.69 90.42 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.199 -0.938 . . . . 0.0 109.829 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -59.62 -38.14 80.51 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.208 -0.933 . . . . 0.0 110.188 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -61.16 -44.61 97.04 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.209 -0.932 . . . . 0.0 109.929 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.27 -41.53 93.49 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.103 -0.998 . . . . 0.0 109.961 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.57 -35.37 72.26 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.187 -0.946 . . . . 0.0 110.322 179.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 21.3 mttm -71.74 -32.55 67.86 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.088 -1.007 . . . . 0.0 110.94 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 33.8 mttm -98.26 19.35 14.41 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.923 -1.111 . . . . 0.0 111.829 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 54.56 43.59 78.28 Favored Glycine 0 N--CA 1.498 2.825 0 O-C-N 120.591 -1.318 . . . . 0.0 110.502 179.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 7.3 t -142.88 -164.78 1.91 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.127 -1.219 . . . . 0.0 110.088 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.5 mp0 -138.25 149.57 45.87 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.193 -0.942 . . . . 0.0 110.407 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.429 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.5 p -131.86 161.49 41.19 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.165 -0.96 . . . . 0.0 109.949 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 29.1 t -165.79 88.88 0.41 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.164 -0.96 . . . . 0.0 111.167 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.766 ' CG ' HD12 ' A' ' 121' ' ' ILE . 47.1 t80 -97.58 159.9 14.65 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.317 -0.864 . . . . 0.0 110.239 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 53.4 m-70 -137.11 -61.6 0.65 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.482 -0.761 . . . . 0.0 109.001 179.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -133.63 151.96 51.79 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.41 -0.806 . . . . 0.0 108.912 178.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 31.2 p -92.92 153.19 18.93 Favored 'General case' 0 N--CA 1.504 2.243 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.179 -179.462 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 27.0 m -71.64 -25.94 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 O-C-N 121.396 -0.815 . . . . 0.0 111.387 -179.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -50.65 -55.42 16.49 Favored 'General case' 0 N--CA 1.515 2.779 0 O-C-N 120.764 -1.21 . . . . 0.0 110.079 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 25.5 p -130.96 -165.64 1.59 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.276 -0.89 . . . . 0.0 110.566 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.77 56.61 0.76 Allowed Glycine 0 N--CA 1.493 2.457 0 N-CA-C 107.961 -2.056 . . . . 0.0 107.961 178.438 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 17.7 t -99.99 142.25 31.72 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.374 -1.074 . . . . 0.0 109.85 -179.225 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 5.2 mtt-85 -95.46 53.69 1.51 Allowed 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.301 -0.874 . . . . 0.0 109.593 179.27 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 64.5 96.68 0.02 OUTLIER Glycine 0 N--CA 1.487 2.087 0 N-CA-C 109.915 -1.274 . . . . 0.0 109.915 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 26.2 p -106.3 124.8 50.15 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.311 -1.111 . . . . 0.0 110.048 179.437 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -134.59 135.31 42.12 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.131 -0.981 . . . . 0.0 110.1 -179.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . 0.421 ' OG ' ' HB2' ' A' ' 102' ' ' LYS . 0.7 OUTLIER . . . . . 0 N--CA 1.497 1.922 0 O-C-N 121.231 -0.918 . . . . 0.0 109.855 179.647 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.691 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.502 2.147 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.31 162.01 43.84 Favored 'Trans proline' 0 C--N 1.317 -1.109 0 O-C-N 123.335 1.176 . . . . 0.0 110.833 -179.421 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -48.79 -31.92 7.82 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.476 -0.765 . . . . 0.0 111.358 -179.828 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.5 -34.95 43.5 Favored Glycine 0 N--CA 1.498 2.825 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 179.776 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -55.95 -33.45 64.76 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 121.057 -1.261 . . . . 0.0 110.656 179.814 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -53.9 -37.94 64.29 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.085 -1.01 . . . . 0.0 110.149 179.693 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 44.1 mmtt -59.55 -37.38 78.26 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.268 -0.895 . . . . 0.0 110.045 179.504 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.738 HG22 ' OH ' ' A' ' 62' ' ' TYR . 2.1 pt -116.37 35.29 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.182 -0.949 . . . . 0.0 110.552 179.814 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.423 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 4.5 tttt -84.38 -42.89 0.73 Allowed Pre-proline 0 N--CA 1.509 2.491 0 O-C-N 121.136 -0.977 . . . . 0.0 113.334 -179.163 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.0 Cg_endo -75.44 -35.17 2.99 Favored 'Trans proline' 0 N--CA 1.486 1.073 0 O-C-N 122.467 0.72 . . . . 0.0 111.805 -178.138 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.547 HG21 ' CE2' ' A' ' 62' ' ' TYR . 85.4 m -61.62 -46.79 88.32 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 120.932 -1.105 . . . . 0.0 109.896 -179.875 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.714 HD13 ' HE2' ' A' ' 86' ' ' TYR . 6.1 mt -62.58 -39.61 94.24 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 119.4 -0.92 . . . . 0.0 109.605 179.446 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.7 m -57.62 -35.69 70.81 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 121.123 -0.985 . . . . 0.0 110.256 179.524 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -57.6 -36.42 71.72 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 121.089 -1.007 . . . . 0.0 110.287 179.756 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.717 ' CD2' HD22 ' A' ' 55' ' ' LEU . 16.7 m-85 -57.42 -39.98 77.34 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.062 -1.024 . . . . 0.0 110.323 179.994 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -60.38 -23.28 64.19 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.224 -0.922 . . . . 0.0 111.514 -179.668 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.538 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.8 mp -81.18 -34.2 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.347 0 O-C-N 120.776 -1.202 . . . . 0.0 109.738 179.655 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.6 tp60 -80.96 -36.32 31.02 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.948 -1.095 . . . . 0.0 109.453 178.752 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.726 ' CD2' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -75.12 -31.83 61.23 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.131 -0.981 . . . . 0.0 109.96 178.913 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -70.17 -36.15 74.48 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 120.865 -1.147 . . . . 0.0 109.745 179.196 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.33 -41.85 93.54 Favored 'General case' 0 N--CA 1.507 2.387 0 C-N-CA 119.145 -1.022 . . . . 0.0 109.329 179.407 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.59 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -69.06 -42.16 76.63 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.301 -0.874 . . . . 0.0 109.53 179.323 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -68.67 -30.89 69.67 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.344 -0.847 . . . . 0.0 110.435 179.575 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.1 mtpt -92.07 -31.46 15.54 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 120.99 -1.068 . . . . 0.0 111.088 -179.971 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.1 t70 . . . . . 0 N--CA 1.513 2.692 0 O-C-N 120.838 -1.164 . . . . 0.0 110.309 -179.972 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.502 2.128 0 CA-C-O 120.596 0.236 . . . . 0.0 110.693 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -58.0 -39.32 77.98 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 121.077 -1.014 . . . . 0.0 110.115 -179.935 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -59.68 -40.02 86.47 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.158 -0.964 . . . . 0.0 110.128 179.943 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 51.3 tp60 -59.5 -39.56 84.2 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.063 -1.023 . . . . 0.0 110.186 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 49' ' ' LEU . 12.5 mt -59.62 -39.66 85.01 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.137 -0.977 . . . . 0.0 110.181 -179.923 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.498 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.3 m0 -59.14 -37.19 76.68 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.186 -0.947 . . . . 0.0 110.164 179.827 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -59.94 -30.95 69.42 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.015 -1.053 . . . . 0.0 110.139 179.119 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.726 HG23 ' CD2' ' A' ' 30' ' ' LEU . 77.6 mt -71.28 -58.4 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.286 0 O-C-N 120.989 -1.069 . . . . 0.0 109.102 179.355 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.1 ptm -62.84 -29.94 71.12 Favored 'General case' 0 N--CA 1.507 2.408 0 C-N-CA 118.646 -1.221 . . . . 0.0 109.883 178.851 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.6 mm100 -69.43 -36.82 77.05 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.867 -1.146 . . . . 0.0 109.157 178.117 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.717 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.4 mt -53.24 -32.16 46.93 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.018 -1.052 . . . . 0.0 110.196 179.032 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.459 ' NE2' ' CB ' ' A' ' 88' ' ' ASP . 41.2 t60 -54.6 -39.76 68.18 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.09 -1.006 . . . . 0.0 110.07 179.859 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.428 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 4.9 m170 -62.41 -49.15 76.63 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.668 179.213 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -59.22 -36.23 75.05 Favored 'General case' 0 N--CA 1.508 2.438 0 C-N-CA 119.355 -0.938 . . . . 0.0 109.523 179.154 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.453 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -68.71 -52.09 34.58 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.085 -1.009 . . . . 0.0 108.761 178.769 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 91.7 p -61.21 -38.57 87.05 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.268 -0.895 . . . . 0.0 109.263 178.862 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 57.6 ttp85 -64.05 -38.49 91.26 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.094 -1.004 . . . . 0.0 109.456 179.028 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.738 ' OH ' HG22 ' A' ' 19' ' ' ILE . 48.1 t80 -60.31 -47.2 87.03 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.083 -1.011 . . . . 0.0 109.617 179.565 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.606 HD12 ' HB2' ' A' ' 87' ' ' ALA . 82.8 mt -77.77 -42.47 28.93 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.365 0 O-C-N 121.242 -0.911 . . . . 0.0 109.098 179.16 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.506 ' CE1' HG23 ' A' ' 92' ' ' ILE . 18.7 t80 -61.35 -23.37 65.7 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.354 -0.841 . . . . 0.0 110.659 179.01 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 97.2 m -91.02 -38.78 12.59 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.643 -1.286 . . . . 0.0 110.198 179.831 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.517 ' C ' HD12 ' A' ' 66' ' ' LEU . 3.5 pp -83.04 -30.28 28.19 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.893 -1.13 . . . . 0.0 111.924 -179.429 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.464 ' HD2' HG23 ' A' ' 73' ' ' ILE . 39.9 t80 -86.25 -35.96 19.68 Favored 'General case' 0 N--CA 1.511 2.591 0 O-C-N 120.573 -1.329 . . . . 0.0 111.467 -179.81 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.419 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 15.1 m-85 -94.08 -29.88 14.96 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.828 -1.17 . . . . 0.0 112.422 -178.158 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.8 mtpp -105.52 -59.46 1.76 Allowed 'General case' 0 N--CA 1.504 2.268 0 O-C-N 120.684 -1.26 . . . . 0.0 110.42 -179.81 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.407 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 29.9 ttt85 -57.13 -33.27 67.21 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 121.109 -0.994 . . . . 0.0 110.366 -179.996 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.6 mttt 57.47 45.84 18.99 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.887 -1.133 . . . . 0.0 110.328 179.965 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -111.11 -57.17 2.28 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.372 -0.83 . . . . 0.0 109.38 179.289 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.786 HG13 HD23 ' A' ' 77' ' ' LEU . 15.1 tt -56.17 162.21 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.574 0 O-C-N 121.443 -0.786 . . . . 0.0 110.121 179.533 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.8 t -111.62 149.76 31.06 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.07 -1.019 . . . . 0.0 109.921 179.106 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.39 -32.71 1.42 Allowed 'General case' 0 N--CA 1.517 2.902 0 O-C-N 121.282 -0.886 . . . . 0.0 111.984 -179.709 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -61.68 -50.94 70.48 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 120.941 -1.099 . . . . 0.0 109.36 179.635 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.786 HD23 HG13 ' A' ' 73' ' ' ILE . 52.1 tp -67.96 -42.88 80.22 Favored 'General case' 0 N--CA 1.506 2.345 0 C-N-CA 119.139 -1.024 . . . . 0.0 108.466 178.727 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.709 ' HA ' HD12 ' A' ' 81' ' ' LEU . 21.8 t80 -60.1 -38.54 83.28 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.324 -0.86 . . . . 0.0 109.479 178.869 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -70.58 -42.67 70.74 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.067 -1.021 . . . . 0.0 108.73 178.745 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.691 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 72.0 t90 -59.03 -38.41 79.24 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.262 -0.899 . . . . 0.0 109.545 178.926 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.709 HD12 ' HA ' ' A' ' 78' ' ' TYR . 11.8 mt -64.86 -51.27 62.95 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.167 -0.958 . . . . 0.0 109.519 179.365 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.4 mm -57.75 -33.13 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.592 0 O-C-N 121.169 -0.957 . . . . 0.0 110.102 179.645 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -89.23 -9.03 52.27 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 120.898 -1.126 . . . . 0.0 112.437 -179.862 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.438 ' HB2' ' CE1' ' A' ' 86' ' ' TYR . 4.3 mm-40 -111.16 22.11 15.6 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 120.449 -1.407 . . . . 0.0 111.974 -179.984 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.4 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 0.0 OUTLIER 74.94 73.58 0.1 Allowed 'General case' 0 N--CA 1.51 2.562 0 O-C-N 121.031 -1.043 . . . . 0.0 111.66 179.451 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.714 ' HE2' HD13 ' A' ' 23' ' ' LEU . 32.6 m-85 -134.2 -62.8 0.74 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.557 -0.715 . . . . 0.0 109.215 179.456 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.606 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -131.16 163.04 28.59 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.478 -0.764 . . . . 0.0 109.248 179.313 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.459 ' CB ' ' NE2' ' A' ' 56' ' ' HIS . 30.7 t0 -111.27 118.27 35.43 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.084 -1.01 . . . . 0.0 110.314 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -57.67 -35.76 71.02 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 121.34 -0.85 . . . . 0.0 110.194 179.72 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.423 HD12 ' HA ' ' A' ' 90' ' ' LEU . 7.9 tp -60.68 -38.51 85.19 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.121 -0.987 . . . . 0.0 109.684 179.481 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.691 HD12 ' CZ3' ' A' ' 95' ' ' TRP . 0.3 OUTLIER -66.56 -56.71 9.5 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.085 -1.009 . . . . 0.0 108.829 179.078 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.506 HG23 ' CE1' ' A' ' 64' ' ' TYR . 38.8 mt -61.0 -33.74 57.03 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.416 0 C-N-CA 119.339 -0.944 . . . . 0.0 109.165 178.851 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.24 -41.1 86.2 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 120.985 -1.072 . . . . 0.0 109.239 178.854 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.474 ' HB3' HD22 ' A' ' 103' ' ' LEU . 10.0 mmtm -57.62 -44.25 85.38 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.177 -0.952 . . . . 0.0 109.49 179.387 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.691 ' CZ3' HD12 ' A' ' 91' ' ' LEU . 2.3 m0 -59.05 -26.37 64.54 Favored 'General case' 0 N--CA 1.508 2.44 0 C-N-CA 119.148 -1.021 . . . . 0.0 110.786 179.165 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.18 -35.51 25.43 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 120.736 -1.227 . . . . 0.0 110.671 179.587 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -51.1 175.79 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.803 0 O-C-N 121.025 -1.047 . . . . 0.0 110.831 179.89 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 60.8 m -103.79 138.83 39.85 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.168 -0.957 . . . . 0.0 109.487 179.219 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 103.47 -29.15 12.87 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.84 -1.304 . . . . 0.0 109.84 -178.881 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -94.43 58.16 2.37 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.867 -1.372 . . . . 0.0 109.898 179.658 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -73.0 -38.76 66.49 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.026 -1.046 . . . . 0.0 109.864 179.717 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.01 73.86 1.05 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.157 -0.964 . . . . 0.0 110.143 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.474 HD22 ' HB3' ' A' ' 94' ' ' LYS . 1.1 pp -110.1 148.77 31.1 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.068 -1.02 . . . . 0.0 110.149 179.941 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.428 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.7 p -110.21 -30.08 7.89 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.238 -0.914 . . . . 0.0 112.997 -179.727 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.625 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.3 m -143.56 -168.13 2.75 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 120.256 -1.527 . . . . 0.0 109.884 179.159 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.425 HD23 ' HA ' ' A' ' 106' ' ' LEU . 44.4 mt -96.73 -38.14 10.02 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.088 -1.007 . . . . 0.0 110.066 178.986 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 18.0 ttp180 -102.45 30.56 4.53 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 120.972 -1.08 . . . . 0.0 109.826 178.051 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.625 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.304 1.8 t -128.65 18.43 6.27 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.11 -0.994 . . . . 0.0 108.97 -179.575 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.469 HG23 ' C ' ' A' ' 108' ' ' CYS . 1.7 pt -156.39 36.81 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.158 0 O-C-N 120.78 -1.2 . . . . 0.0 110.493 -178.631 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.503 ' C ' HG23 ' A' ' 119' ' ' THR . 9.5 tt0 . . . . . 0 N--CA 1.51 2.554 0 O-C-N 120.995 -1.066 . . . . 0.0 110.788 -178.854 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.503 HG23 ' C ' ' A' ' 110' ' ' GLN . 7.1 m . . . . . 0 N--CA 1.494 1.774 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 41.5 t -82.21 153.93 25.7 Favored 'General case' 0 N--CA 1.501 2.109 0 C-N-CA 119.321 -0.952 . . . . 0.0 108.802 178.766 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.71 HG23 ' CE1' ' A' ' 142' ' ' PHE . 14.1 tt -81.11 -29.33 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 O-C-N 121.047 -1.033 . . . . 0.0 112.448 -178.787 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.489 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 14.4 p -53.97 -35.14 61.47 Favored 'General case' 0 N--CA 1.512 2.647 0 O-C-N 120.707 -1.246 . . . . 0.0 110.658 -178.736 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -58.54 -26.85 63.98 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.118 -0.988 . . . . 0.0 109.836 177.707 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 48.9 t -73.89 118.24 67.74 Favored Pre-proline 0 N--CA 1.509 2.48 0 O-C-N 120.866 -1.146 . . . . 0.0 110.584 179.975 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.473 ' HB3' ' HB1' ' A' ' 154' ' ' ALA . 37.4 Cg_endo -64.79 168.11 14.15 Favored 'Trans proline' 0 N--CA 1.489 1.224 0 O-C-N 123.026 1.013 . . . . 0.0 110.553 178.611 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.18 -38.81 60.67 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.203 -0.935 . . . . 0.0 110.189 179.971 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.28 -40.65 82.48 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.034 -1.041 . . . . 0.0 110.053 -179.811 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 -67.08 -41.1 86.96 Favored 'General case' 0 N--CA 1.507 2.42 0 C-N-CA 119.359 -0.936 . . . . 0.0 109.399 179.46 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.478 ' O ' HG11 ' A' ' 140' ' ' VAL . 5.4 mt -64.27 -40.66 96.43 Favored 'General case' 0 N--CA 1.507 2.389 0 C-N-CA 119.446 -0.902 . . . . 0.0 109.552 179.318 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.68 -39.91 86.1 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.16 -0.962 . . . . 0.0 109.936 179.78 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -60.93 -40.02 91.67 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.148 -0.97 . . . . 0.0 109.964 179.781 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -62.19 -41.92 98.8 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.201 -0.937 . . . . 0.0 109.872 179.797 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.558 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -61.37 -41.6 97.34 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.215 -0.928 . . . . 0.0 109.886 179.955 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 6.9 mmt85 -59.65 -38.55 81.72 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.143 -0.973 . . . . 0.0 109.991 179.658 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 13.9 mttp -61.63 -35.68 78.61 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.18 -0.95 . . . . 0.0 110.567 -179.902 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -105.45 21.68 16.77 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.007 -1.058 . . . . 0.0 111.836 -179.913 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.39 46.06 58.14 Favored Glycine 0 N--CA 1.498 2.812 0 O-C-N 120.641 -1.287 . . . . 0.0 110.773 179.315 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.558 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 9.5 t -138.74 -165.31 1.8 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.113 -1.228 . . . . 0.0 110.189 179.747 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.4 mp0 -133.34 167.72 19.88 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.188 -0.945 . . . . 0.0 110.471 -179.896 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.478 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.6 p -159.82 161.14 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.041 0 O-C-N 121.336 -0.853 . . . . 0.0 110.646 -179.981 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 38.8 t -169.05 113.92 0.57 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.18 -0.95 . . . . 0.0 111.256 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.71 ' CE1' HG23 ' A' ' 121' ' ' ILE . 85.1 t80 -102.97 158.79 16.04 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.234 -0.916 . . . . 0.0 110.156 179.586 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 15.2 m80 -137.17 -61.54 0.65 Allowed 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.822 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -148.01 149.33 31.93 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.576 -0.702 . . . . 0.0 109.247 178.81 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . 0.462 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 26.3 p -93.67 155.24 17.37 Favored 'General case' 0 N--CA 1.505 2.275 0 C-N-CA 119.038 -1.065 . . . . 0.0 110.813 -179.485 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.9 p -71.86 -25.15 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.493 0 O-C-N 121.287 -0.883 . . . . 0.0 111.77 -179.252 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -50.25 -59.78 3.62 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 120.832 -1.168 . . . . 0.0 110.171 -179.898 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.498 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.8 p -126.95 -165.11 1.42 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.213 -0.929 . . . . 0.0 110.491 179.424 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . 0.441 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.51 60.99 0.65 Allowed Glycine 0 N--CA 1.492 2.38 0 N-CA-C 107.945 -2.062 . . . . 0.0 107.945 178.3 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 16.9 t -99.15 138.69 35.9 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.353 -1.087 . . . . 0.0 109.64 -179.182 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.63 49.45 1.03 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.23 -0.919 . . . . 0.0 109.882 179.398 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 75.16 93.58 0.16 Allowed Glycine 0 N--CA 1.488 2.156 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 179.757 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.4 p -104.83 127.25 52.58 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.237 -1.154 . . . . 0.0 109.665 179.107 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . 0.473 ' HB1' ' HB3' ' A' ' 125' ' ' PRO . . . -153.98 149.51 27.31 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.052 -1.03 . . . . 0.0 110.554 -179.057 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.502 2.141 0 O-C-N 121.269 -0.895 . . . . 0.0 110.422 179.949 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.737 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.503 2.212 0 CA-C-O 120.466 0.174 . . . . 0.0 110.62 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -74.02 161.11 41.79 Favored 'Trans proline' 0 N--CA 1.485 1.0 0 O-C-N 123.192 1.101 . . . . 0.0 110.611 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -49.15 -31.81 8.97 Favored 'General case' 0 N--CA 1.515 2.815 0 O-C-N 121.431 -0.793 . . . . 0.0 111.318 -179.82 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.2 -33.37 45.42 Favored Glycine 0 N--CA 1.499 2.851 0 O-C-N 121.031 -1.043 . . . . 0.0 110.635 179.855 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -54.18 -32.01 54.32 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 120.962 -1.317 . . . . 0.0 110.766 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -54.93 -37.34 66.29 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 121.037 -1.04 . . . . 0.0 110.242 179.868 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.8 mtpp -57.68 -35.39 70.52 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.152 -0.968 . . . . 0.0 110.359 179.588 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.726 HD12 HD11 ' A' ' 23' ' ' LEU . 3.1 pt -116.26 36.73 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.15 -0.969 . . . . 0.0 110.428 179.592 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.441 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -82.53 -43.03 0.95 Allowed Pre-proline 0 N--CA 1.508 2.459 0 O-C-N 121.078 -1.014 . . . . 0.0 113.003 -179.436 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.441 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.2 Cg_endo -76.14 -34.73 2.74 Favored 'Trans proline' 0 N--CA 1.486 1.07 0 O-C-N 122.571 0.774 . . . . 0.0 111.875 -178.366 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.959 HG21 ' CE2' ' A' ' 62' ' ' TYR . 91.4 m -61.3 -47.99 83.41 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.885 -1.135 . . . . 0.0 109.833 -179.762 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.726 HD11 HD12 ' A' ' 19' ' ' ILE . 7.8 mt -62.07 -40.21 95.03 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.465 179.555 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.426 ' O ' HD12 ' A' ' 28' ' ' ILE . 7.7 m -57.56 -35.41 70.31 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.155 -0.966 . . . . 0.0 110.187 179.229 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -56.72 -37.9 71.62 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.041 -1.037 . . . . 0.0 110.128 179.691 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.59 ' CD2' HD22 ' A' ' 55' ' ' LEU . 14.1 m-85 -58.69 -39.05 79.64 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.101 -1.0 . . . . 0.0 110.284 179.965 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -59.81 -40.14 87.38 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.17 -0.956 . . . . 0.0 110.362 -179.512 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.429 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.2 mp -65.65 -42.07 91.94 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.376 0 C-N-CA 119.12 -1.032 . . . . 0.0 108.668 179.48 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.7 tp60 -68.03 -50.99 51.99 Favored 'General case' 0 N--CA 1.506 2.337 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 178.494 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.11 HD11 HG23 ' A' ' 52' ' ' ILE . 5.6 tp -59.09 -36.28 74.84 Favored 'General case' 0 N--CA 1.509 2.516 0 C-N-CA 119.546 -0.861 . . . . 0.0 109.471 178.403 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.6 mtt85 -57.93 -37.79 74.73 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.124 -0.985 . . . . 0.0 110.333 179.675 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -62.74 -50.42 71.14 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.094 -1.003 . . . . 0.0 109.748 -179.636 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.544 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -71.46 -40.0 70.58 Favored 'General case' 0 N--CA 1.503 2.188 0 C-N-CA 118.829 -1.149 . . . . 0.0 108.827 178.796 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -62.1 -32.7 73.28 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.21 -0.931 . . . . 0.0 110.246 179.207 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.3 mtpt -96.42 -35.85 11.02 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 120.934 -1.104 . . . . 0.0 111.065 -179.818 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 . . . . . 0 N--CA 1.511 2.612 0 O-C-N 120.955 -1.09 . . . . 0.0 110.359 179.975 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 5.6 m . . . . . 0 N--CA 1.503 2.187 0 CA-C-O 120.525 0.202 . . . . 0.0 110.578 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.417 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 34.7 m120 -60.28 -45.03 94.75 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.126 -0.984 . . . . 0.0 109.828 179.937 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -60.16 -44.89 94.65 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.144 -0.973 . . . . 0.0 109.708 179.867 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.56 -43.78 92.85 Favored 'General case' 0 N--CA 1.506 2.375 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.272 179.29 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 20.6 mt -61.46 -35.65 78.21 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.332 -0.855 . . . . 0.0 110.185 179.818 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.51 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 49.4 m0 -58.7 -39.28 80.31 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 120.962 -1.086 . . . . 0.0 109.742 179.762 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -62.16 -31.25 71.72 Favored 'General case' 0 N--CA 1.504 2.257 0 C-N-CA 119.144 -1.022 . . . . 0.0 109.715 178.409 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 1.11 HG23 HD11 ' A' ' 30' ' ' LEU . 17.8 mt -71.81 -58.19 5.68 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.145 0 O-C-N 120.93 -1.106 . . . . 0.0 109.157 179.298 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.0 ptm -61.48 -29.58 70.06 Favored 'General case' 0 N--CA 1.508 2.458 0 C-N-CA 118.57 -1.252 . . . . 0.0 109.787 178.81 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -69.11 -38.17 78.78 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 120.793 -1.192 . . . . 0.0 109.009 178.078 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.59 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.1 mt -53.34 -32.05 47.33 Favored 'General case' 0 N--CA 1.513 2.681 0 O-C-N 120.951 -1.093 . . . . 0.0 110.163 178.963 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.467 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 67.6 t60 -56.19 -38.9 71.6 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.061 -1.025 . . . . 0.0 110.24 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.405 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 7.4 m170 -60.13 -47.99 83.61 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.103 -0.998 . . . . 0.0 109.449 179.361 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -60.38 -35.88 76.77 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.262 -0.899 . . . . 0.0 109.651 178.974 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.441 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -64.97 -49.11 71.61 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.045 -1.034 . . . . 0.0 109.615 179.385 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.7 p -62.77 -38.56 91.09 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.139 -0.976 . . . . 0.0 109.409 179.329 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 19.5 ttt85 -63.13 -40.31 97.22 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.064 -1.022 . . . . 0.0 109.342 179.281 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.959 ' CE2' HG21 ' A' ' 22' ' ' THR . 43.0 t80 -62.35 -50.87 69.86 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.181 -0.949 . . . . 0.0 109.379 179.506 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.748 HD12 ' HB2' ' A' ' 87' ' ' ALA . 86.9 mt -69.5 -39.53 78.67 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.345 0 C-N-CA 119.271 -0.972 . . . . 0.0 109.126 179.351 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 9.5 t80 -64.48 -42.39 95.92 Favored 'General case' 0 N--CA 1.503 2.216 0 C-N-CA 119.409 -0.917 . . . . 0.0 109.055 179.022 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.417 ' HA ' ' CD ' ' A' ' 69' ' ' LYS . 87.4 m -60.89 -42.01 97.14 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.055 -1.028 . . . . 0.0 110.5 -179.575 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.581 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.29 -33.16 26.03 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 118.923 -1.111 . . . . 0.0 112.759 -178.766 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.498 ' N ' HD12 ' A' ' 66' ' ' LEU . 51.0 t80 -86.32 -32.43 21.04 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 120.599 -1.313 . . . . 0.0 111.734 -179.363 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -98.38 -16.75 19.17 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 120.827 -1.171 . . . . 0.0 112.713 -178.872 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.417 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 4.8 mttt -124.15 -59.31 1.5 Allowed 'General case' 0 N--CA 1.501 2.114 0 O-C-N 120.46 -1.4 . . . . 0.0 111.008 179.79 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.413 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 4.8 tpt180 -61.87 -30.21 70.71 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.147 -0.971 . . . . 0.0 110.825 -179.649 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.2 tttp 57.87 42.05 23.75 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 120.754 -1.216 . . . . 0.0 110.093 -179.592 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.38 35.72 3.88 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.369 -0.832 . . . . 0.0 109.952 179.303 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.825 HG13 HD23 ' A' ' 77' ' ' LEU . 14.0 tt -154.64 162.37 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 O-C-N 121.214 -0.929 . . . . 0.0 109.905 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.8 m -110.02 147.82 32.83 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.172 -0.955 . . . . 0.0 110.18 179.791 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.9 ttmt -45.42 -32.27 2.06 Favored 'General case' 0 N--CA 1.516 2.835 0 O-C-N 121.401 -0.812 . . . . 0.0 111.656 -179.971 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -62.25 -50.99 69.54 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 120.938 -1.101 . . . . 0.0 109.3 179.559 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.825 HD23 HG13 ' A' ' 73' ' ' ILE . 50.1 tp -65.63 -46.03 80.82 Favored 'General case' 0 N--CA 1.505 2.306 0 C-N-CA 119.106 -1.038 . . . . 0.0 108.481 178.959 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.434 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 18.8 t80 -59.8 -38.98 83.47 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.276 -0.89 . . . . 0.0 109.545 179.224 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -72.73 -42.14 64.41 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.112 -0.993 . . . . 0.0 108.971 178.933 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.737 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 83.0 t90 -57.48 -37.27 72.64 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.218 -0.927 . . . . 0.0 109.717 179.091 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.777 HD22 ' CD2' ' A' ' 86' ' ' TYR . 62.9 mt -68.5 -48.12 65.22 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.19 -0.944 . . . . 0.0 108.981 179.149 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.456 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 34.4 mm -56.01 -33.36 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.56 0 O-C-N 121.206 -0.934 . . . . 0.0 109.941 179.374 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -89.29 -16.23 31.65 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.004 -1.06 . . . . 0.0 112.082 179.929 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.451 ' HB2' ' CE1' ' A' ' 86' ' ' TYR . 8.4 mm-40 -102.88 21.61 15.29 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.547 -1.345 . . . . 0.0 112.05 -179.829 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 17.1 tttp 75.54 72.04 0.09 Allowed 'General case' 0 N--CA 1.511 2.599 0 O-C-N 121.201 -0.937 . . . . 0.0 111.735 179.443 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.777 ' CD2' HD22 ' A' ' 81' ' ' LEU . 33.9 m-85 -134.2 -62.89 0.74 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.519 -0.738 . . . . 0.0 109.119 179.267 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.748 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -129.09 160.15 33.72 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.507 -0.745 . . . . 0.0 109.4 179.243 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.467 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 8.2 t70 -107.61 115.25 29.82 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.035 -1.041 . . . . 0.0 110.346 -179.866 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -58.64 -37.22 75.47 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.255 -0.903 . . . . 0.0 110.03 179.668 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.482 HD23 HD22 ' A' ' 106' ' ' LEU . 7.1 tp -60.79 -38.79 86.5 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.124 -0.985 . . . . 0.0 109.601 179.504 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.598 HD12 ' CZ3' ' A' ' 95' ' ' TRP . 0.3 OUTLIER -65.13 -55.54 18.1 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.094 -1.004 . . . . 0.0 108.856 179.155 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 57.7 mt -61.67 -36.97 76.75 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.41 0 C-N-CA 119.401 -0.919 . . . . 0.0 109.038 178.974 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.74 -39.3 90.99 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.164 -0.96 . . . . 0.0 109.428 178.891 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.43 ' HD2' ' CE1' ' A' ' 100' ' ' TYR . 12.8 mmtm -59.36 -43.94 92.78 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.115 -0.99 . . . . 0.0 109.635 179.543 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.598 ' CZ3' HD12 ' A' ' 91' ' ' LEU . 2.9 m0 -63.86 -33.86 76.65 Favored 'General case' 0 N--CA 1.51 2.526 0 C-N-CA 119.311 -0.956 . . . . 0.0 110.343 179.461 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.54 -30.49 29.69 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.043 -1.036 . . . . 0.0 110.993 179.722 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -54.15 -176.57 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.68 0 O-C-N 120.912 -1.118 . . . . 0.0 110.601 179.87 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -104.16 136.54 43.59 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.16 -0.962 . . . . 0.0 109.874 179.296 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 94.09 13.17 55.28 Favored Glycine 0 N--CA 1.494 2.501 0 C-N-CA 120.295 -0.955 . . . . 0.0 110.938 -179.418 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.584 ' HB3' HD23 ' A' ' 103' ' ' LEU . 49.6 m-85 -120.14 71.34 0.9 Allowed 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 119.322 1.561 . . . . 0.0 110.003 179.748 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -92.84 -36.66 12.71 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.08 -1.012 . . . . 0.0 110.474 179.89 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.28 76.94 1.52 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.051 -1.031 . . . . 0.0 110.698 -179.854 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.584 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.2 pp -122.58 147.34 46.52 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.06 -1.025 . . . . 0.0 109.957 179.536 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.405 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.6 p -111.58 -32.06 6.8 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 119.491 -0.884 . . . . 0.0 112.988 -179.447 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.617 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.1 m -142.22 -168.15 2.65 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 120.26 -1.525 . . . . 0.0 110.156 179.246 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.482 HD22 HD23 ' A' ' 90' ' ' LEU . 44.2 mt -95.97 -38.26 10.31 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.153 -0.967 . . . . 0.0 110.021 179.018 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 18.0 ttt85 -102.46 30.83 4.37 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.958 -1.089 . . . . 0.0 109.721 178.109 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.617 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.311 1.8 t -130.51 20.07 5.19 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.168 -0.958 . . . . 0.0 108.746 -179.429 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.492 HG22 ' HD3' ' A' ' 123' ' ' ARG . 2.1 pt -156.63 38.17 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 O-C-N 120.938 -1.101 . . . . 0.0 110.107 -178.574 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.784 ' C ' HG23 ' A' ' 119' ' ' THR . 31.0 mt-30 . . . . . 0 N--CA 1.508 2.474 0 O-C-N 120.953 -1.092 . . . . 0.0 110.869 -178.639 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.784 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.6 m . . . . . 0 N--CA 1.5 2.03 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.439 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 43.0 t -70.27 153.23 43.3 Favored 'General case' 0 N--CA 1.501 2.087 0 C-N-CA 118.895 -1.122 . . . . 0.0 108.244 178.527 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.941 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -70.41 -31.74 47.78 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.391 0 O-C-N 121.072 -1.017 . . . . 0.0 111.523 -178.667 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.5 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.4 p -60.95 -35.98 78.18 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 120.701 -1.249 . . . . 0.0 110.28 -179.8 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.492 ' HD3' HG22 ' A' ' 109' ' ' ILE . 23.5 tpt85 -57.31 -36.93 71.71 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 120.905 -1.122 . . . . 0.0 109.603 178.539 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 49.1 t -75.13 119.5 77.23 Favored Pre-proline 0 N--CA 1.505 2.302 0 O-C-N 121.204 -0.935 . . . . 0.0 109.85 179.718 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -64.43 178.9 1.43 Allowed 'Trans proline' 0 N--CA 1.488 1.188 0 O-C-N 123.133 1.07 . . . . 0.0 110.768 179.584 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.7 mmm-85 -74.99 -37.53 61.85 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.193 -0.942 . . . . 0.0 110.596 -179.784 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.46 -40.61 83.14 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.071 -1.018 . . . . 0.0 109.968 -179.867 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -69.92 -41.49 74.56 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 119.382 -0.927 . . . . 0.0 109.266 179.246 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.501 HD11 HD11 ' A' ' 121' ' ' ILE . 11.1 mt -65.34 -38.69 90.87 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.272 -0.893 . . . . 0.0 109.576 179.188 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -60.98 -38.75 87.07 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.179 -0.951 . . . . 0.0 109.924 179.653 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.26 -36.21 72.91 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.148 -0.97 . . . . 0.0 110.416 179.845 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -63.77 -49.42 73.02 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.182 -0.949 . . . . 0.0 109.807 179.973 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.496 ' HB1' ' CA ' ' A' ' 139' ' ' GLN . . . -61.25 -38.25 86.01 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.122 -0.986 . . . . 0.0 109.84 179.733 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 15.6 mtp85 -61.69 -36.24 80.32 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.114 -0.991 . . . . 0.0 110.12 179.562 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 6.7 mttm -87.13 -34.96 18.9 Favored 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.029 -1.044 . . . . 0.0 110.747 179.798 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -82.48 -35.99 26.92 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 120.987 -1.07 . . . . 0.0 110.667 179.776 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.87 34.78 8.09 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.804 -1.319 . . . . 0.0 109.804 -179.861 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.9 t -131.17 23.14 4.85 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.992 -1.299 . . . . 0.0 111.531 179.702 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . 0.496 ' CA ' ' HB1' ' A' ' 133' ' ' ALA . 5.2 mt-30 48.62 -179.06 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.862 -1.149 . . . . 0.0 111.928 179.462 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.7 p -174.07 159.28 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.307 0 O-C-N 121.051 -1.031 . . . . 0.0 110.698 -179.841 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 41.5 t -171.98 92.5 0.13 Allowed 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.219 -0.926 . . . . 0.0 110.939 179.787 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.941 ' CD1' HD12 ' A' ' 121' ' ' ILE . 80.8 t80 -99.79 158.9 15.46 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.24 -0.912 . . . . 0.0 110.724 -179.881 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -139.46 -61.33 0.55 Allowed 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 178.615 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 1.6 pm0 -137.67 150.81 47.65 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.49 -0.756 . . . . 0.0 108.972 178.621 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . 0.411 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.4 p -91.99 153.88 19.16 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.973 -1.08 . . . . 0.0 111.034 -179.735 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.3 p -72.4 -23.4 21.21 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.416 0 C-N-CA 119.733 -0.787 . . . . 0.0 111.51 -179.76 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -51.55 -60.6 2.96 Favored 'General case' 0 N--CA 1.514 2.746 0 O-C-N 120.711 -1.243 . . . . 0.0 110.044 179.921 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.51 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 21.6 p -125.8 -164.11 1.28 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.265 -0.897 . . . . 0.0 110.395 179.327 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -101.64 61.53 0.55 Allowed Glycine 0 N--CA 1.492 2.384 0 N-CA-C 107.958 -2.057 . . . . 0.0 107.958 178.202 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 18.9 t -100.32 146.38 27.02 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.293 -1.122 . . . . 0.0 109.866 -179.13 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 6.7 ttm-85 -100.42 45.65 0.97 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.254 -0.904 . . . . 0.0 109.566 179.349 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 74.08 97.03 0.1 OUTLIER Glycine 0 N--CA 1.486 2.015 0 N-CA-C 109.806 -1.318 . . . . 0.0 109.806 179.993 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 26.3 p -109.47 125.74 52.77 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.275 -1.132 . . . . 0.0 110.133 179.606 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -144.79 144.93 31.41 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.088 -1.008 . . . . 0.0 110.181 -179.414 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.503 2.18 0 O-C-N 121.235 -0.916 . . . . 0.0 111.025 -179.824 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.655 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.514 2.728 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -70.97 160.43 49.38 Favored 'Trans proline' 0 C--N 1.316 -1.152 0 O-C-N 123.314 1.165 . . . . 0.0 110.831 -179.538 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -48.72 -32.06 7.87 Favored 'General case' 0 N--CA 1.515 2.816 0 O-C-N 121.384 -0.822 . . . . 0.0 111.403 -179.718 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.63 -33.27 41.12 Favored Glycine 0 N--CA 1.498 2.773 0 O-C-N 121.011 -1.055 . . . . 0.0 110.653 179.751 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.445 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 16.6 t80 -55.3 -34.23 63.96 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 120.939 -1.33 . . . . 0.0 110.701 179.888 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -55.17 -37.22 66.74 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 121.05 -1.031 . . . . 0.0 110.239 179.727 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.3 mtpt -57.65 -35.51 70.62 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.237 -0.915 . . . . 0.0 110.319 179.604 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.894 HD12 HD11 ' A' ' 23' ' ' LEU . 3.2 pt -115.25 36.33 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 O-C-N 121.186 -0.947 . . . . 0.0 110.328 179.548 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.445 ' HD2' ' CE2' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -84.98 -42.93 0.67 Allowed Pre-proline 0 N--CA 1.511 2.59 0 O-C-N 121.149 -0.969 . . . . 0.0 113.509 -179.143 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.8 Cg_endo -75.06 -37.23 2.09 Favored 'Trans proline' 0 N--CA 1.488 1.188 0 O-C-N 122.63 0.805 . . . . 0.0 111.921 -177.828 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.756 HG21 ' CE2' ' A' ' 62' ' ' TYR . 70.6 m -61.32 -43.38 98.96 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.019 -1.051 . . . . 0.0 110.139 -179.569 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.894 HD11 HD12 ' A' ' 19' ' ' ILE . 34.1 mt -65.07 -40.18 94.32 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.219 -0.926 . . . . 0.0 109.58 179.746 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -34.17 69.2 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.107 -0.995 . . . . 0.0 110.276 179.337 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -56.72 -36.36 69.62 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.004 -1.06 . . . . 0.0 110.288 179.628 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.742 ' CD1' HD22 ' A' ' 55' ' ' LEU . 26.2 m-85 -57.2 -39.89 76.33 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.098 -1.001 . . . . 0.0 110.325 179.866 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -60.06 -23.63 63.92 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.316 -0.865 . . . . 0.0 111.483 -179.461 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.568 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.7 mp -81.19 -34.72 13.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.426 0 O-C-N 120.767 -1.208 . . . . 0.0 109.727 179.623 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.429 ' OE1' HD21 ' A' ' 55' ' ' LEU . 25.3 tt0 -82.53 -36.21 26.56 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 120.951 -1.093 . . . . 0.0 109.179 178.543 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.726 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -74.18 -31.65 62.75 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.134 -0.979 . . . . 0.0 110.054 178.864 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -69.56 -36.71 76.57 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 120.808 -1.183 . . . . 0.0 109.911 179.419 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -64.19 -42.09 96.82 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.104 -1.038 . . . . 0.0 109.168 179.277 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.589 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -68.43 -41.95 79.59 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.272 -0.893 . . . . 0.0 109.096 178.964 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -59.41 -35.13 73.4 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.226 -0.922 . . . . 0.0 110.218 179.579 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -82.79 -39.73 21.39 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.009 -1.057 . . . . 0.0 110.147 179.818 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.6 t0 . . . . . 0 N--CA 1.509 2.49 0 O-C-N 121.214 -0.929 . . . . 0.0 109.959 179.681 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.0 m . . . . . 0 N--CA 1.497 1.888 0 CA-C-O 120.676 0.274 . . . . 0.0 110.501 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -56.25 -38.36 71.02 Favored 'General case' 0 N--CA 1.511 2.599 0 O-C-N 121.138 -0.976 . . . . 0.0 110.06 179.884 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -62.01 -40.84 97.05 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.211 -0.931 . . . . 0.0 109.804 179.773 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 48.9 tp60 -62.21 -40.49 96.26 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.183 -0.948 . . . . 0.0 109.782 179.805 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.442 HD23 ' HA ' ' A' ' 49' ' ' LEU . 12.6 mt -59.32 -39.28 82.61 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.142 -0.974 . . . . 0.0 110.092 179.87 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.482 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.8 m0 -61.17 -36.22 79.24 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.114 -0.991 . . . . 0.0 110.149 179.86 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.96 -31.21 68.52 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.988 -1.07 . . . . 0.0 110.107 178.871 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.726 HG23 ' CG ' ' A' ' 30' ' ' LEU . 79.6 mt -72.08 -60.29 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.286 0 O-C-N 120.921 -1.112 . . . . 0.0 108.816 179.148 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 5.6 ptm -61.67 -29.32 70.0 Favored 'General case' 0 N--CA 1.508 2.443 0 C-N-CA 118.771 -1.171 . . . . 0.0 109.685 178.568 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -70.39 -38.32 74.65 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.832 -1.168 . . . . 0.0 109.001 178.307 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.742 HD22 ' CD1' ' A' ' 26' ' ' PHE . 11.7 mt -53.72 -33.39 55.42 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.057 -1.027 . . . . 0.0 110.067 178.959 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.471 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 38.4 t60 -54.63 -38.79 67.28 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 120.961 -1.087 . . . . 0.0 109.943 179.816 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.427 ' CD2' HD21 ' A' ' 91' ' ' LEU . 5.2 m170 -59.15 -46.14 89.14 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.152 -0.967 . . . . 0.0 109.321 179.354 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 -61.64 -37.36 83.71 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.406 -0.917 . . . . 0.0 109.272 178.93 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.442 ' HG2' ' CE1' ' A' ' 26' ' ' PHE . 3.5 mmm-85 -64.51 -50.46 67.29 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.125 -0.984 . . . . 0.0 109.216 178.999 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 89.4 p -62.82 -40.11 96.39 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.197 -0.939 . . . . 0.0 109.193 179.455 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 12.5 ttm-85 -64.72 -38.25 90.34 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.127 -0.983 . . . . 0.0 109.399 178.995 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.756 ' CE2' HG21 ' A' ' 22' ' ' THR . 37.7 t80 -60.61 -48.69 80.66 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.094 -1.004 . . . . 0.0 109.583 179.542 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.728 HD12 ' HB2' ' A' ' 87' ' ' ALA . 84.7 mt -76.51 -42.25 35.32 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.338 0 O-C-N 121.222 -0.924 . . . . 0.0 108.875 179.119 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.463 ' CE1' HG23 ' A' ' 92' ' ' ILE . 44.4 t80 -61.44 -22.74 65.31 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.402 -0.811 . . . . 0.0 110.507 178.824 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 86.9 m -90.73 -36.0 14.56 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.609 -1.307 . . . . 0.0 110.503 179.955 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.548 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.6 pp -82.9 -32.3 27.37 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.898 -1.126 . . . . 0.0 112.343 -179.179 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.491 ' N ' HD12 ' A' ' 66' ' ' LEU . 34.3 t80 -86.21 -37.87 18.21 Favored 'General case' 0 N--CA 1.512 2.648 0 O-C-N 120.738 -1.226 . . . . 0.0 111.299 -179.375 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.408 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 12.9 m-85 -89.68 -21.63 22.64 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.977 -1.077 . . . . 0.0 112.548 -178.647 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.6 mttm -119.87 -60.71 1.68 Allowed 'General case' 0 N--CA 1.501 2.104 0 O-C-N 120.489 -1.382 . . . . 0.0 111.153 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.41 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 31.8 ttt85 -60.38 -30.33 69.51 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.079 -1.013 . . . . 0.0 110.92 -179.464 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.1 tttt 57.5 42.04 25.03 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.859 -1.15 . . . . 0.0 110.025 -179.462 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -111.93 35.31 3.76 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.342 -0.849 . . . . 0.0 109.87 179.219 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.781 HG13 HD23 ' A' ' 77' ' ' LEU . 13.6 tt -156.14 162.1 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.214 -0.929 . . . . 0.0 109.913 -179.956 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 40.5 m -108.78 149.56 28.88 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.117 -0.989 . . . . 0.0 110.211 179.967 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.0 tttt -46.83 -32.08 3.48 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.307 -0.871 . . . . 0.0 111.462 -179.972 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.19 -50.6 71.14 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 120.893 -1.129 . . . . 0.0 109.39 179.521 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.781 HD23 HG13 ' A' ' 73' ' ' ILE . 38.0 tp -66.9 -44.3 81.17 Favored 'General case' 0 N--CA 1.505 2.301 0 C-N-CA 119.108 -1.037 . . . . 0.0 108.488 178.856 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.653 ' HA ' HD12 ' A' ' 81' ' ' LEU . 17.5 t80 -60.24 -38.64 84.05 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.305 -0.872 . . . . 0.0 109.425 178.933 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -72.75 -42.7 63.78 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.04 -1.037 . . . . 0.0 108.656 178.495 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.655 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 75.0 t90 -57.68 -37.13 72.91 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.271 -0.893 . . . . 0.0 109.576 178.825 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.653 HD12 ' HA ' ' A' ' 78' ' ' TYR . 12.7 mt -67.6 -51.44 50.27 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.18 -0.95 . . . . 0.0 109.113 179.178 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 36.3 mm -57.34 -31.64 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.507 0 O-C-N 121.246 -0.909 . . . . 0.0 110.228 179.559 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -89.26 -13.13 38.81 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 120.907 -1.12 . . . . 0.0 112.222 -179.804 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.441 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 76.4 mm-40 -108.84 23.12 15.0 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 120.535 -1.353 . . . . 0.0 111.977 -179.879 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.65 74.18 0.11 Allowed 'General case' 0 N--CA 1.512 2.671 0 O-C-N 121.188 -0.945 . . . . 0.0 111.71 179.227 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.496 ' HE2' HD13 ' A' ' 23' ' ' LEU . 32.0 m-85 -134.05 -62.94 0.75 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.512 -0.743 . . . . 0.0 109.22 179.433 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.728 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -131.2 163.06 28.56 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.472 -0.768 . . . . 0.0 109.418 179.315 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.471 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 8.3 t0 -107.93 108.65 19.89 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.091 -1.006 . . . . 0.0 110.417 -179.911 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -58.7 -37.54 76.32 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.249 -0.907 . . . . 0.0 110.19 179.742 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.626 HD23 HD13 ' A' ' 106' ' ' LEU . 18.4 tp -59.03 -39.01 80.63 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.102 -0.999 . . . . 0.0 110.19 -179.973 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.587 ' HA ' HD21 ' A' ' 106' ' ' LEU . 58.4 tp -71.02 -45.5 63.8 Favored 'General case' 0 N--CA 1.505 2.29 0 C-N-CA 119.123 -1.031 . . . . 0.0 108.884 179.318 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.463 HG23 ' CE1' ' A' ' 64' ' ' TYR . 20.6 mt -60.91 -39.09 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.384 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 178.358 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.77 -39.88 95.57 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.116 -0.99 . . . . 0.0 109.355 178.741 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.552 ' HB3' HD22 ' A' ' 103' ' ' LEU . 13.5 mmtm -59.54 -47.73 84.4 Favored 'General case' 0 N--CA 1.51 2.575 0 O-C-N 121.137 -0.977 . . . . 0.0 109.287 179.455 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.6 m0 -59.68 -35.18 73.96 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.364 -0.835 . . . . 0.0 110.244 179.549 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.429 ' HD2' ' OH ' ' A' ' 64' ' ' TYR . 8.9 mtp85 -81.94 -33.02 30.53 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.112 -0.992 . . . . 0.0 110.757 179.76 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 7.9 mmtt -51.82 178.01 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.782 0 O-C-N 121.007 -1.058 . . . . 0.0 110.851 -179.855 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 28.5 m -105.38 140.43 38.5 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.252 -0.905 . . . . 0.0 109.395 179.188 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.88 -22.85 37.84 Favored Glycine 0 N--CA 1.494 2.534 0 C-N-CA 119.709 -1.234 . . . . 0.0 110.465 -179.26 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.649 ' HB3' HD23 ' A' ' 103' ' ' LEU . 70.0 m-85 -91.22 58.43 3.68 Favored 'General case' 0 N--CA 1.505 2.277 0 CA-C-N 119.181 1.49 . . . . 0.0 110.056 179.831 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -66.6 -36.08 81.75 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.076 -1.015 . . . . 0.0 110.272 179.891 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.1 mmmt -127.95 97.36 4.77 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.054 -1.029 . . . . 0.0 110.819 -179.708 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.649 HD23 ' HB3' ' A' ' 100' ' ' TYR . 2.2 pp -134.64 136.62 42.98 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.111 -0.993 . . . . 0.0 109.983 179.24 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.427 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.9 p -103.9 -28.42 11.6 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.193 -0.942 . . . . 0.0 112.337 -179.787 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.705 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 14.3 m -145.46 -166.63 2.48 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.301 -1.499 . . . . 0.0 109.547 178.955 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.626 HD13 HD23 ' A' ' 90' ' ' LEU . 25.6 mt -99.0 -45.84 5.81 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.111 -0.993 . . . . 0.0 109.63 178.613 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 61.8 ttt-85 -93.42 -1.67 55.5 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 120.977 -1.077 . . . . 0.0 111.498 178.911 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.705 ' HB2' ' HB2' ' A' ' 105' ' ' CYS . 1.6 t -83.04 -48.13 10.94 Favored 'General case' 0 N--CA 1.512 2.635 0 N-CA-C 105.331 -2.1 . . . . 0.0 105.331 178.61 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.787 ' O ' HG21 ' A' ' 119' ' ' THR . 14.4 pt -76.13 -25.21 16.69 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.553 0 O-C-N 121.208 -0.933 . . . . 0.0 110.83 177.568 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.469 ' C ' HG23 ' A' ' 119' ' ' THR . 7.1 mt-30 . . . . . 0 N--CA 1.494 1.744 0 O-C-N 121.004 -1.06 . . . . 0.0 110.127 -179.767 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.787 HG21 ' O ' ' A' ' 109' ' ' ILE . 0.3 OUTLIER . . . . . 0 N--CA 1.495 1.804 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 . . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.408 ' HB3' ' O ' ' A' ' 108' ' ' CYS . 34.3 t -58.72 153.91 15.76 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.172 -0.955 . . . . 0.0 109.87 179.802 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.799 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -72.87 -34.53 46.78 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.394 0 O-C-N 121.126 -0.984 . . . . 0.0 111.217 -179.207 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.493 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 12.3 p -55.64 -33.82 64.39 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 120.817 -1.177 . . . . 0.0 111.165 -178.788 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 6.6 ttp85 -59.56 -35.15 73.7 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 120.882 -1.136 . . . . 0.0 109.55 178.382 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 58.7 t -79.95 125.19 82.43 Favored Pre-proline 0 N--CA 1.503 2.18 0 O-C-N 121.121 -0.987 . . . . 0.0 109.653 179.468 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.595 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.3 Cg_endo -65.12 177.12 2.66 Favored 'Trans proline' 0 N--CA 1.488 1.155 0 O-C-N 123.104 1.055 . . . . 0.0 110.814 179.734 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 3.8 tpp85 -75.01 -38.12 61.64 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.257 -0.902 . . . . 0.0 110.529 -179.818 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.18 -40.67 82.08 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.066 -1.021 . . . . 0.0 110.031 -179.946 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 14.8 tm0? -69.94 -42.28 73.46 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.21 -0.931 . . . . 0.0 109.17 179.25 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.595 HD12 ' O ' ' A' ' 125' ' ' PRO . 8.2 mt -65.5 -38.44 89.72 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 119.526 -0.869 . . . . 0.0 109.464 179.08 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -59.81 -38.53 82.22 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.113 -0.992 . . . . 0.0 110.013 179.563 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -58.44 -37.29 75.11 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.133 -0.98 . . . . 0.0 110.379 179.895 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -60.19 -43.38 95.96 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.091 -1.006 . . . . 0.0 110.041 -179.969 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.682 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -61.91 -45.79 92.16 Favored 'General case' 0 N--CA 1.509 2.487 0 C-N-CA 119.305 -0.958 . . . . 0.0 109.726 179.875 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 3.3 mmt85 -58.19 -34.28 70.18 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.207 -0.933 . . . . 0.0 110.373 179.618 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -76.73 -31.42 57.13 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.116 -0.99 . . . . 0.0 110.914 179.919 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 42.0 mttt -98.73 23.93 8.16 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 120.812 -1.18 . . . . 0.0 111.642 -179.9 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.71 47.02 53.68 Favored Glycine 0 N--CA 1.5 2.905 0 O-C-N 120.696 -1.252 . . . . 0.0 110.717 179.212 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.682 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.7 t -153.47 -171.06 3.78 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.087 -1.243 . . . . 0.0 110.726 179.822 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -123.65 176.77 6.03 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.232 -0.917 . . . . 0.0 110.241 -179.831 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.2 p -158.89 161.17 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.193 -0.942 . . . . 0.0 110.765 -179.953 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 31.6 t -166.3 97.62 0.6 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.325 -0.859 . . . . 0.0 110.971 -179.999 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.728 ' CG ' HD12 ' A' ' 121' ' ' ILE . 59.4 t80 -101.08 158.65 15.85 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.295 -0.878 . . . . 0.0 110.483 -179.87 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 21.0 m170 -137.59 -60.51 0.65 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.437 -0.789 . . . . 0.0 109.102 179.04 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -138.0 149.13 45.82 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.374 -0.829 . . . . 0.0 109.139 178.793 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . 0.425 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.3 p -88.88 154.98 19.81 Favored 'General case' 0 N--CA 1.507 2.397 0 C-N-CA 119.112 -1.035 . . . . 0.0 111.033 -179.553 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.1 p -74.89 -23.78 17.71 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.327 0 O-C-N 121.318 -0.864 . . . . 0.0 111.678 -179.382 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -52.01 -61.5 2.22 Favored 'General case' 0 N--CA 1.515 2.791 0 O-C-N 120.659 -1.276 . . . . 0.0 110.115 -179.933 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.482 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.9 p -125.61 -167.12 1.65 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.224 -0.923 . . . . 0.0 110.404 179.711 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -97.79 66.93 0.8 Allowed Glycine 0 N--CA 1.493 2.47 0 N-CA-C 108.076 -2.009 . . . . 0.0 108.076 178.54 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 36.7 t -102.97 144.18 31.58 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.305 -1.115 . . . . 0.0 110.111 -179.165 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 32.5 mtp85 -99.29 48.39 0.95 Allowed 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.156 -0.965 . . . . 0.0 109.38 178.993 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.17 96.39 0.05 OUTLIER Glycine 0 N--CA 1.486 1.994 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 -179.814 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 22.8 p -109.17 127.88 54.57 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.151 -1.205 . . . . 0.0 110.339 179.72 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -141.96 141.99 32.96 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.115 -0.991 . . . . 0.0 109.863 -179.734 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.499 1.98 0 O-C-N 121.252 -0.905 . . . . 0.0 110.563 -179.801 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.655 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.5 2.071 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -68.36 164.24 33.35 Favored 'Trans proline' 0 C--N 1.317 -1.131 0 O-C-N 123.282 1.148 . . . . 0.0 110.94 -179.772 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -48.11 -31.65 5.85 Favored 'General case' 0 N--CA 1.516 2.825 0 O-C-N 121.484 -0.76 . . . . 0.0 111.544 -179.739 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.76 -36.15 40.3 Favored Glycine 0 N--CA 1.498 2.8 0 O-C-N 120.898 -1.126 . . . . 0.0 110.548 179.887 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.601 ' HB2' HD11 ' A' ' 77' ' ' LEU . 23.0 t80 -57.48 -34.18 68.76 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.983 -1.304 . . . . 0.0 110.504 179.76 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -52.58 -36.64 56.47 Favored 'General case' 0 N--CA 1.513 2.697 0 O-C-N 120.912 -1.117 . . . . 0.0 110.212 179.743 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.9 mtmt -58.56 -36.09 73.37 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.216 -0.927 . . . . 0.0 110.259 179.534 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.865 HD12 HD11 ' A' ' 23' ' ' LEU . 1.7 pt -120.7 35.01 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 O-C-N 121.109 -0.995 . . . . 0.0 110.77 179.881 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.436 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.7 OUTLIER -83.7 -43.33 0.8 Allowed Pre-proline 0 N--CA 1.51 2.557 0 O-C-N 121.031 -1.043 . . . . 0.0 113.313 -179.085 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.436 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.5 Cg_endo -75.37 -35.24 3.0 Favored 'Trans proline' 0 N--CA 1.486 1.044 0 O-C-N 122.6 0.789 . . . . 0.0 111.903 -178.094 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.732 HG21 ' CE2' ' A' ' 62' ' ' TYR . 88.6 m -60.16 -43.26 95.94 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 120.95 -1.094 . . . . 0.0 110.1 -179.738 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.865 HD11 HD12 ' A' ' 19' ' ' ILE . 5.9 mt -65.95 -41.16 91.61 Favored 'General case' 0 N--CA 1.507 2.418 0 C-N-CA 119.472 -0.891 . . . . 0.0 109.355 179.512 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.17 -34.63 72.34 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.259 -0.9 . . . . 0.0 110.077 179.277 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -58.49 -36.72 74.19 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.145 -0.972 . . . . 0.0 110.349 179.869 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.693 ' CD2' HD22 ' A' ' 55' ' ' LEU . 11.6 m-85 -55.78 -41.47 74.11 Favored 'General case' 0 N--CA 1.512 2.634 0 O-C-N 120.905 -1.122 . . . . 0.0 109.869 179.56 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -58.24 -25.98 62.35 Favored 'General case' 0 N--CA 1.506 2.352 0 C-N-CA 119.302 -0.959 . . . . 0.0 110.501 179.05 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 15.2 mm -68.41 -52.23 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.342 0 O-C-N 120.923 -1.111 . . . . 0.0 109.162 179.488 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -66.89 -42.47 85.45 Favored 'General case' 0 N--CA 1.508 2.451 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.018 179.31 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.686 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -64.69 -35.53 81.35 Favored 'General case' 0 N--CA 1.506 2.358 0 C-N-CA 119.44 -0.904 . . . . 0.0 109.106 178.744 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.71 -40.38 83.54 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.082 -1.011 . . . . 0.0 109.997 179.582 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -62.55 -47.74 82.57 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.202 -0.937 . . . . 0.0 109.717 -179.957 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.652 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -69.05 -40.24 78.65 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.164 -0.96 . . . . 0.0 109.278 179.213 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 41.4 mm-40 -67.57 -31.69 71.93 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.248 -0.907 . . . . 0.0 110.398 179.465 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.2 mmmt -92.89 -34.66 13.72 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 120.861 -1.149 . . . . 0.0 110.736 179.965 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 . . . . . 0 N--CA 1.51 2.572 0 O-C-N 121.017 -1.052 . . . . 0.0 110.153 179.836 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.9 t . . . . . 0 N--CA 1.496 1.852 0 CA-C-O 120.694 0.283 . . . . 0.0 110.508 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.7 m-20 -55.12 -38.29 68.0 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.094 -1.004 . . . . 0.0 110.036 179.763 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -59.8 -38.31 81.58 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.274 -0.891 . . . . 0.0 110.144 179.708 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -64.47 -40.71 96.22 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.113 -0.992 . . . . 0.0 109.925 179.947 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.463 HD23 HD12 ' A' ' 52' ' ' ILE . 24.8 mt -67.85 -35.78 79.17 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.223 -0.923 . . . . 0.0 110.344 179.899 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 47.1 m0 -58.79 -37.82 77.16 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.003 -1.06 . . . . 0.0 110.019 179.879 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -62.96 -32.17 73.44 Favored 'General case' 0 N--CA 1.504 2.235 0 C-N-CA 119.074 -1.05 . . . . 0.0 109.494 178.425 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.686 HG23 ' CG ' ' A' ' 30' ' ' LEU . 68.6 mt -71.83 -59.04 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.232 0 O-C-N 120.91 -1.119 . . . . 0.0 108.999 179.216 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -60.69 -29.11 69.12 Favored 'General case' 0 N--CA 1.511 2.605 0 C-N-CA 118.483 -1.287 . . . . 0.0 109.918 178.9 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.4 mm-40 -68.75 -37.9 79.72 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 120.846 -1.159 . . . . 0.0 109.138 178.215 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.693 HD22 ' CD2' ' A' ' 26' ' ' PHE . 10.9 mt -53.74 -32.18 51.22 Favored 'General case' 0 N--CA 1.511 2.6 0 O-C-N 120.92 -1.112 . . . . 0.0 110.375 179.026 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.444 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 17.6 t60 -56.62 -37.0 70.09 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.004 -1.06 . . . . 0.0 110.302 179.91 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.495 ' NE2' HD21 ' A' ' 91' ' ' LEU . 5.5 m170 -61.41 -51.13 70.04 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.141 -0.974 . . . . 0.0 109.458 179.407 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -57.98 -35.92 71.88 Favored 'General case' 0 N--CA 1.509 2.478 0 C-N-CA 119.377 -0.929 . . . . 0.0 109.715 179.206 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.435 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -65.48 -50.27 65.95 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.102 -0.999 . . . . 0.0 109.353 179.272 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 60.7 p -62.24 -39.12 91.77 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.097 -1.002 . . . . 0.0 109.209 179.24 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -63.78 -37.39 87.2 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.292 -0.963 . . . . 0.0 109.416 179.001 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.732 ' CE2' HG21 ' A' ' 22' ' ' THR . 36.0 t80 -61.0 -50.6 72.71 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.154 -0.966 . . . . 0.0 109.344 179.504 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.64 HD12 ' HB2' ' A' ' 87' ' ' ALA . 92.0 mt -74.5 -41.91 49.23 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 C-N-CA 119.329 -0.949 . . . . 0.0 108.872 179.193 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.435 ' OH ' ' NH1' ' A' ' 96' ' ' ARG . 58.6 t80 -59.77 -36.21 76.21 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.3 -0.875 . . . . 0.0 109.821 179.032 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 76.2 m -75.04 -38.77 61.34 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.943 -1.098 . . . . 0.0 110.356 180.0 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.529 ' C ' HD12 ' A' ' 66' ' ' LEU . 3.5 pp -83.23 -31.47 26.99 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.85 -1.156 . . . . 0.0 112.142 -179.275 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.472 ' HD2' HG23 ' A' ' 73' ' ' ILE . 40.8 t80 -86.4 -41.47 14.44 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 120.658 -1.277 . . . . 0.0 111.874 -179.575 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -90.39 -26.36 19.94 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 120.89 -1.131 . . . . 0.0 112.818 -177.723 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.42 ' HE2' ' CD2' ' A' ' 64' ' ' TYR . 0.7 OUTLIER -109.11 -58.2 2.06 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.673 -1.267 . . . . 0.0 110.668 -179.988 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.418 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 8.1 tpt180 -58.32 -33.58 69.66 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.015 -1.053 . . . . 0.0 110.364 179.721 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.7 tttp 59.26 47.21 11.8 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 120.896 -1.128 . . . . 0.0 110.37 179.903 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.8 -58.1 2.2 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.378 -0.826 . . . . 0.0 109.507 179.339 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.705 HG13 HD23 ' A' ' 77' ' ' LEU . 14.8 tt -54.91 162.39 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.601 0 O-C-N 121.366 -0.834 . . . . 0.0 110.224 179.55 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.0 t -110.53 147.36 34.32 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.188 -0.945 . . . . 0.0 109.805 178.975 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -43.15 -33.83 0.98 Allowed 'General case' 0 N--CA 1.52 3.04 0 O-C-N 121.376 -0.828 . . . . 0.0 111.986 -179.594 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.6 -48.04 83.52 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 120.956 -1.09 . . . . 0.0 109.474 179.556 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.705 HD23 HG13 ' A' ' 73' ' ' ILE . 23.9 tp -70.52 -41.79 72.12 Favored 'General case' 0 N--CA 1.504 2.233 0 C-N-CA 119.236 -0.986 . . . . 0.0 108.705 178.611 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.54 ' HA ' HD12 ' A' ' 81' ' ' LEU . 26.2 t80 -61.71 -36.56 81.29 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.27 -0.894 . . . . 0.0 109.478 178.821 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -71.96 -43.77 64.63 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.024 -1.048 . . . . 0.0 108.905 179.047 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.655 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 72.8 t90 -59.42 -37.97 79.42 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.227 -0.921 . . . . 0.0 109.428 178.979 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.54 HD12 ' HA ' ' A' ' 78' ' ' TYR . 18.8 mt -65.74 -49.77 67.21 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.247 -0.908 . . . . 0.0 109.55 179.531 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.527 HD12 ' HG3' ' A' ' 89' ' ' LYS . 39.7 mm -59.6 -33.16 50.92 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.515 0 O-C-N 121.258 -0.901 . . . . 0.0 110.164 179.68 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.13 -6.3 57.11 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 120.909 -1.119 . . . . 0.0 112.379 -179.802 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.42 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 7.6 mm-40 -114.46 21.81 14.24 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.537 -1.352 . . . . 0.0 111.899 -179.941 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.01 77.74 0.12 Allowed 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.014 -1.054 . . . . 0.0 111.433 179.371 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.578 ' HE2' HD13 ' A' ' 23' ' ' LEU . 33.0 m-85 -136.7 -63.46 0.62 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.499 -0.75 . . . . 0.0 109.418 179.653 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.64 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -125.6 -174.26 3.03 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.431 -0.793 . . . . 0.0 109.293 179.342 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.444 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 5.4 t0 -121.67 102.76 8.43 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.098 -1.001 . . . . 0.0 110.343 -179.956 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.527 ' HG3' HD12 ' A' ' 82' ' ' ILE . 19.5 mtpt -60.37 -40.38 90.6 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.143 -0.973 . . . . 0.0 109.874 179.618 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.581 HD23 HD13 ' A' ' 106' ' ' LEU . 30.9 tp -59.97 -42.78 94.88 Favored 'General case' 0 N--CA 1.508 2.425 0 C-N-CA 119.408 -0.917 . . . . 0.0 109.67 179.711 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.746 ' HA ' HD21 ' A' ' 106' ' ' LEU . 37.0 tp -64.97 -50.44 66.34 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.168 -0.957 . . . . 0.0 108.927 179.529 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 55.9 mt -59.25 -36.04 61.19 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.413 0 O-C-N 121.188 -0.945 . . . . 0.0 108.797 178.593 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -64.53 -44.93 89.29 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.135 -0.978 . . . . 0.0 109.341 178.726 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.507 ' HD3' HD23 ' A' ' 106' ' ' LEU . 8.7 mttp -59.66 -44.68 93.46 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.087 -1.008 . . . . 0.0 109.862 179.163 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.5 m0 -59.04 -35.49 73.4 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.158 -0.964 . . . . 0.0 110.105 179.262 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.435 ' NH1' ' OH ' ' A' ' 64' ' ' TYR . 13.2 mtp85 -85.04 -30.4 24.16 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.07 -1.019 . . . . 0.0 110.513 179.269 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.43 -176.93 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.719 0 O-C-N 120.987 -1.07 . . . . 0.0 110.697 179.865 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 12.0 m -102.23 135.11 44.4 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.208 -0.933 . . . . 0.0 109.594 179.012 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 97.04 10.42 54.92 Favored Glycine 0 N--CA 1.494 2.522 0 O-C-N 121.132 -0.98 . . . . 0.0 111.081 -179.345 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.579 ' HB3' HD23 ' A' ' 103' ' ' LEU . 48.5 m-85 -118.35 71.87 0.85 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 119.339 1.57 . . . . 0.0 109.641 179.576 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -94.62 -33.75 12.88 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.158 -0.964 . . . . 0.0 110.871 -179.804 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.68 77.08 1.77 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.99 -1.069 . . . . 0.0 110.997 -179.49 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.579 HD23 ' HB3' ' A' ' 100' ' ' TYR . 2.3 pp -125.44 159.36 32.1 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.031 -1.043 . . . . 0.0 109.83 179.042 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.441 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.6 p -120.3 -33.06 3.98 Favored 'General case' 0 N--CA 1.501 2.101 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -178.709 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.636 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.3 m -140.27 -168.04 2.45 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 120.056 -1.653 . . . . 0.0 110.254 179.573 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.746 HD21 ' HA ' ' A' ' 91' ' ' LEU . 46.1 mt -95.65 -39.45 9.9 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.166 -0.959 . . . . 0.0 110.069 179.134 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.86 28.26 5.36 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 120.934 -1.104 . . . . 0.0 110.042 178.006 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.636 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.8 t -126.32 15.55 7.75 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.093 -1.004 . . . . 0.0 108.855 -179.669 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.497 HG22 ' HG3' ' A' ' 123' ' ' ARG . 1.2 pt -157.81 36.86 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.292 0 O-C-N 120.803 -1.185 . . . . 0.0 110.55 -178.776 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.599 ' O ' HG23 ' A' ' 119' ' ' THR . 3.5 tt0 . . . . . 0 N--CA 1.501 2.09 0 O-C-N 120.73 -1.231 . . . . 0.0 111.824 -178.071 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.599 HG23 ' O ' ' A' ' 110' ' ' GLN . 1.5 m . . . . . 0 N--CA 1.509 2.493 0 N-CA-C 109.978 -0.378 . . . . 0.0 109.978 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 49.3 t -95.2 154.13 17.33 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 119.555 -0.858 . . . . 0.0 109.186 178.913 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.803 HD12 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -71.56 -37.18 62.85 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.441 0 O-C-N 121.115 -0.99 . . . . 0.0 110.987 -179.053 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.455 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 10.8 p -53.97 -34.35 59.49 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 120.932 -1.105 . . . . 0.0 111.127 -178.703 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.497 ' HG3' HG22 ' A' ' 109' ' ' ILE . 10.9 ttp85 -59.53 -34.88 73.18 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 120.966 -1.084 . . . . 0.0 109.542 178.38 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 49.5 t -79.9 124.75 83.07 Favored Pre-proline 0 N--CA 1.505 2.29 0 O-C-N 121.14 -0.975 . . . . 0.0 109.925 179.614 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.628 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.0 Cg_endo -65.13 178.7 1.81 Allowed 'Trans proline' 0 N--CA 1.488 1.205 0 O-C-N 123.113 1.06 . . . . 0.0 110.804 179.517 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.2 mmt85 -75.05 -37.73 61.61 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.233 -0.917 . . . . 0.0 110.489 -179.803 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.64 -42.81 89.18 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.043 -1.035 . . . . 0.0 109.971 -179.752 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -68.79 -41.65 78.44 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.281 -0.968 . . . . 0.0 109.128 179.256 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.628 HD12 ' O ' ' A' ' 125' ' ' PRO . 5.6 mt -64.17 -38.57 91.54 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.172 -0.955 . . . . 0.0 109.701 179.166 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -60.61 -40.15 90.81 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.095 -1.003 . . . . 0.0 109.853 179.765 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -59.62 -37.07 77.64 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.12 -0.987 . . . . 0.0 110.16 179.739 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -60.67 -45.15 95.23 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.114 -0.991 . . . . 0.0 109.843 179.859 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.458 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -62.13 -46.41 89.12 Favored 'General case' 0 N--CA 1.507 2.389 0 C-N-CA 119.337 -0.945 . . . . 0.0 109.687 179.759 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.79 -35.2 74.16 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.192 -0.943 . . . . 0.0 110.11 179.559 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -73.89 -32.64 63.69 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.101 -1.0 . . . . 0.0 110.773 179.887 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 1.4 ttmt -98.87 23.32 9.0 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.944 -1.098 . . . . 0.0 111.685 179.996 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.92 46.73 55.06 Favored Glycine 0 N--CA 1.499 2.873 0 O-C-N 120.69 -1.256 . . . . 0.0 110.702 179.288 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.458 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.8 t -148.79 -165.15 2.2 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.154 -1.204 . . . . 0.0 110.468 179.848 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -131.62 153.52 49.84 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.214 -0.929 . . . . 0.0 110.186 -179.874 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.447 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.1 p -131.55 160.66 42.2 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 O-C-N 121.193 -0.942 . . . . 0.0 110.349 179.964 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 47.7 t -168.57 86.68 0.19 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.232 -0.917 . . . . 0.0 110.744 179.99 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.803 ' CG ' HD12 ' A' ' 121' ' ' ILE . 57.8 t80 -102.47 161.72 13.49 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.181 -0.949 . . . . 0.0 110.821 -179.483 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 3.3 m170 -139.5 -60.96 0.55 Allowed 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 178.995 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -134.86 150.17 50.42 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.339 -0.85 . . . . 0.0 108.774 178.47 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 28.3 p -92.65 154.09 18.58 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.096 -1.042 . . . . 0.0 111.117 -179.42 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.9 p -73.31 -25.19 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 O-C-N 121.39 -0.819 . . . . 0.0 111.475 -179.603 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -49.73 -55.79 12.61 Favored 'General case' 0 N--CA 1.516 2.835 0 O-C-N 120.828 -1.17 . . . . 0.0 110.231 -179.875 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 23.1 p -131.55 -163.41 1.32 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.218 -0.926 . . . . 0.0 110.226 179.651 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -102.23 63.47 0.48 Allowed Glycine 0 N--CA 1.492 2.394 0 N-CA-C 108.015 -2.034 . . . . 0.0 108.015 178.4 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 31.6 t -104.01 141.48 36.11 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.362 -1.081 . . . . 0.0 110.162 -178.993 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 6.0 ttt-85 -96.33 53.26 1.31 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.303 -0.873 . . . . 0.0 109.423 178.995 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.23 96.87 0.03 OUTLIER Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.714 -1.355 . . . . 0.0 109.714 -179.857 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.2 p -107.24 127.21 53.33 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.165 -1.197 . . . . 0.0 110.34 179.608 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -152.99 148.82 27.53 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.167 -0.958 . . . . 0.0 110.355 -179.546 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.501 2.096 0 O-C-N 121.191 -0.943 . . . . 0.0 110.759 -179.727 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.663 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.51 2.566 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -72.45 160.41 46.85 Favored 'Trans proline' 0 C--N 1.317 -1.116 0 O-C-N 123.346 1.182 . . . . 0.0 110.722 -179.823 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -49.37 -31.55 9.67 Favored 'General case' 0 N--CA 1.515 2.789 0 O-C-N 121.394 -0.816 . . . . 0.0 111.361 -179.869 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.55 -33.4 40.76 Favored Glycine 0 N--CA 1.498 2.798 0 O-C-N 120.941 -1.099 . . . . 0.0 110.686 179.888 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -55.21 -33.08 62.75 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 120.938 -1.331 . . . . 0.0 110.665 179.939 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -54.16 -37.71 64.73 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 120.981 -1.074 . . . . 0.0 110.325 179.776 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.3 mtpp -59.74 -36.94 77.64 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.227 -0.921 . . . . 0.0 110.201 179.545 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.846 ' O ' HD12 ' A' ' 23' ' ' LEU . 1.6 pt -114.96 33.85 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 O-C-N 121.129 -0.982 . . . . 0.0 110.702 179.759 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.427 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 1.1 ttpt -83.81 -43.21 0.79 Allowed Pre-proline 0 N--CA 1.508 2.469 0 O-C-N 121.005 -1.059 . . . . 0.0 113.102 -179.356 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.3 Cg_endo -75.7 -35.14 2.82 Favored 'Trans proline' 0 N--CA 1.487 1.103 0 O-C-N 122.592 0.785 . . . . 0.0 111.563 -178.448 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.778 HG21 ' CE2' ' A' ' 62' ' ' TYR . 90.5 m -58.48 -41.86 86.21 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 120.948 -1.095 . . . . 0.0 110.05 -179.926 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.846 HD12 ' O ' ' A' ' 19' ' ' ILE . 5.0 mt -68.18 -41.3 81.64 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.514 -0.874 . . . . 0.0 109.297 179.398 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.3 m -60.42 -33.95 73.26 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.168 -0.958 . . . . 0.0 109.845 178.926 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -55.57 -34.96 65.24 Favored 'General case' 0 N--CA 1.511 2.579 0 O-C-N 121.01 -1.056 . . . . 0.0 110.198 179.465 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.714 ' CD2' HD22 ' A' ' 55' ' ' LEU . 15.7 m-85 -55.32 -35.79 65.52 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.103 -0.998 . . . . 0.0 110.516 179.704 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -57.16 -38.19 73.2 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.095 -1.003 . . . . 0.0 110.647 -179.628 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.427 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.2 mp -66.36 -40.81 87.66 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 C-N-CA 119.316 -0.954 . . . . 0.0 109.158 179.725 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -70.32 -46.87 63.35 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.125 -0.985 . . . . 0.0 108.784 178.97 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.141 HD11 HG23 ' A' ' 52' ' ' ILE . 2.2 tp -62.07 -35.54 78.94 Favored 'General case' 0 N--CA 1.507 2.419 0 C-N-CA 119.377 -0.929 . . . . 0.0 109.305 178.555 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.92 -36.08 69.78 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.106 -0.996 . . . . 0.0 110.391 179.699 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -62.88 -52.4 63.23 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.054 -1.029 . . . . 0.0 109.458 -179.883 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.535 ' HB1' ' HG2' ' A' ' 48' ' ' GLN . . . -68.91 -41.96 77.48 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 119.042 -1.063 . . . . 0.0 108.589 178.809 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -60.45 -32.42 71.36 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.22 -0.925 . . . . 0.0 110.187 179.309 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 41.8 mtpt -93.6 -30.16 15.1 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 120.939 -1.1 . . . . 0.0 111.037 179.952 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.0 t0 . . . . . 0 N--CA 1.513 2.677 0 O-C-N 120.861 -1.15 . . . . 0.0 110.407 -179.947 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.503 2.213 0 CA-C-O 120.497 0.189 . . . . 0.0 110.616 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -61.34 -40.88 95.89 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.112 -0.992 . . . . 0.0 109.66 179.99 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -61.03 -39.45 89.81 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.217 -0.927 . . . . 0.0 109.788 179.455 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.535 ' HG2' ' HB1' ' A' ' 33' ' ' ALA . 0.3 OUTLIER -59.44 -44.59 92.9 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.187 -0.946 . . . . 0.0 109.53 179.694 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.466 HD23 ' HA ' ' A' ' 49' ' ' LEU . 20.8 mt -59.41 -35.97 74.97 Favored 'General case' 0 N--CA 1.508 2.449 0 C-N-CA 119.318 -0.953 . . . . 0.0 110.296 -179.736 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.536 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.1 m0 -54.0 -38.62 65.28 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 120.885 -1.135 . . . . 0.0 109.52 179.195 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -67.83 -37.27 81.71 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.328 -0.857 . . . . 0.0 109.553 178.817 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 1.141 HG23 HD11 ' A' ' 30' ' ' LEU . 16.6 mt -66.97 -42.84 89.27 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.329 0 O-C-N 121.038 -1.039 . . . . 0.0 109.42 179.604 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.457 ' CE ' ' HB3' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -68.68 -29.44 67.9 Favored 'General case' 0 N--CA 1.502 2.166 0 C-N-CA 118.66 -1.216 . . . . 0.0 109.864 179.285 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.427 ' N ' ' HG3' ' A' ' 53' ' ' MET . 23.4 mt-30 -66.24 -37.69 86.12 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.997 -1.065 . . . . 0.0 109.282 178.896 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.714 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.6 mt -52.77 -32.83 45.68 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.013 -1.054 . . . . 0.0 109.959 179.187 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.435 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 8.4 t60 -56.93 -37.27 71.25 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.058 -1.026 . . . . 0.0 109.966 179.247 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.44 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 5.5 m170 -59.42 -49.35 78.15 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.097 -1.002 . . . . 0.0 109.103 179.215 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -58.78 -35.99 73.69 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.305 -0.872 . . . . 0.0 109.43 178.856 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.459 ' HD3' ' CD1' ' A' ' 26' ' ' PHE . 32.6 mmm-85 -62.81 -51.98 64.97 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.159 -0.963 . . . . 0.0 109.078 178.978 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.443 ' HA ' ' HB1' ' A' ' 87' ' ' ALA . 92.9 p -63.7 -39.23 93.79 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.237 -0.914 . . . . 0.0 109.127 179.262 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 58.7 ttt-85 -64.48 -37.88 89.06 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 121.094 -1.004 . . . . 0.0 109.634 179.195 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.778 ' CE2' HG21 ' A' ' 22' ' ' THR . 48.3 t80 -62.3 -49.54 75.22 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.075 -1.016 . . . . 0.0 109.485 179.528 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.905 HD12 ' HB2' ' A' ' 87' ' ' ALA . 86.9 mt -75.43 -40.62 42.25 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.328 0 O-C-N 121.168 -0.957 . . . . 0.0 109.313 179.382 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.481 ' CE1' HG23 ' A' ' 92' ' ' ILE . 38.6 t80 -63.03 -22.06 66.59 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.202 -0.937 . . . . 0.0 110.551 178.758 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 87.4 m -90.78 -35.51 14.81 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 120.665 -1.272 . . . . 0.0 110.39 179.751 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.531 ' C ' HD12 ' A' ' 66' ' ' LEU . 3.7 pp -82.87 -31.95 27.67 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.917 -1.114 . . . . 0.0 112.207 -179.246 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.467 ' N ' HD12 ' A' ' 66' ' ' LEU . 40.3 t80 -86.13 -38.01 18.18 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 120.657 -1.277 . . . . 0.0 111.271 -179.477 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.403 ' CD2' ' CD1' ' A' ' 64' ' ' TYR . 17.2 m-85 -89.65 -21.93 22.53 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.896 -1.128 . . . . 0.0 112.614 -178.663 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.7 mttm -119.58 -61.07 1.66 Allowed 'General case' 0 N--CA 1.501 2.093 0 O-C-N 120.466 -1.396 . . . . 0.0 111.211 -179.671 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.408 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 0.2 OUTLIER -58.81 -30.65 67.78 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.113 -0.992 . . . . 0.0 110.808 -179.502 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.0 ttmm 57.28 41.59 26.48 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 120.852 -1.155 . . . . 0.0 110.023 -179.498 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.14 35.64 3.87 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.425 -0.797 . . . . 0.0 109.871 179.288 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.81 HG13 HD23 ' A' ' 77' ' ' LEU . 14.1 tt -155.29 162.14 1.89 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.197 -0.939 . . . . 0.0 109.918 -179.975 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.1 148.92 30.09 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.105 -0.997 . . . . 0.0 110.245 179.966 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -46.38 -32.29 3.12 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 121.35 -0.843 . . . . 0.0 111.553 179.97 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -62.02 -50.55 71.57 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 120.843 -1.16 . . . . 0.0 109.349 179.427 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.81 HD23 HG13 ' A' ' 73' ' ' ILE . 54.4 tp -66.37 -45.4 80.25 Favored 'General case' 0 N--CA 1.506 2.336 0 C-N-CA 119.141 -1.024 . . . . 0.0 108.465 178.818 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.588 ' HA ' HD12 ' A' ' 81' ' ' LEU . 18.4 t80 -59.78 -38.26 81.36 Favored 'General case' 0 N--CA 1.506 2.331 0 C-N-CA 119.694 -0.802 . . . . 0.0 109.551 179.112 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -73.75 -42.43 61.11 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.102 -0.999 . . . . 0.0 108.764 178.726 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.663 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 72.1 t90 -57.88 -36.12 71.93 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.228 -0.92 . . . . 0.0 109.772 178.943 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.588 HD12 ' HA ' ' A' ' 78' ' ' TYR . 11.9 mt -69.56 -50.28 46.29 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.119 -0.988 . . . . 0.0 108.84 179.213 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.448 HG21 ' HG3' ' A' ' 89' ' ' LYS . 35.5 mm -57.16 -30.88 35.88 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.639 0 O-C-N 121.205 -0.934 . . . . 0.0 110.117 179.362 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -89.18 -20.87 23.68 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 120.886 -1.134 . . . . 0.0 112.159 -179.549 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.45 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 77.9 mm-40 -101.63 22.19 13.17 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 120.659 -1.276 . . . . 0.0 112.08 -179.767 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 73.46 77.75 0.13 Allowed 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.05 -1.031 . . . . 0.0 111.659 179.079 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.516 ' HE2' HD13 ' A' ' 23' ' ' LEU . 29.0 m-85 -134.64 -64.71 0.66 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.553 -0.717 . . . . 0.0 109.468 179.721 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.905 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -120.63 -174.06 2.72 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.378 -0.826 . . . . 0.0 109.513 179.336 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.435 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 5.9 t0 -124.7 102.86 7.8 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.165 -0.96 . . . . 0.0 110.348 -179.878 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.448 ' HG3' HG21 ' A' ' 82' ' ' ILE . 4.2 mmmt -60.22 -40.28 89.6 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.226 -0.921 . . . . 0.0 109.806 179.646 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.2 tp -60.33 -37.85 81.89 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 121.204 -0.935 . . . . 0.0 110.045 179.829 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.689 HD21 ' CH2' ' A' ' 95' ' ' TRP . 45.2 tp -70.63 -49.3 49.01 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.078 -1.014 . . . . 0.0 108.813 179.179 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.481 HG23 ' CE1' ' A' ' 64' ' ' TYR . 34.5 mt -59.0 -34.03 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 121.255 -0.903 . . . . 0.0 109.098 178.556 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.12 -46.64 76.84 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.089 -1.007 . . . . 0.0 109.356 178.933 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.512 ' HD3' HD23 ' A' ' 106' ' ' LEU . 10.9 mttp -60.5 -44.36 96.06 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.129 -0.982 . . . . 0.0 109.804 179.32 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.689 ' CH2' HD21 ' A' ' 91' ' ' LEU . 3.3 m0 -58.66 -28.66 65.92 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.086 -1.009 . . . . 0.0 109.966 178.926 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.405 ' CD ' ' OH ' ' A' ' 64' ' ' TYR . 0.0 OUTLIER -99.69 22.53 10.81 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 120.939 -1.101 . . . . 0.0 110.886 178.676 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -109.41 -174.28 2.47 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.732 -1.23 . . . . 0.0 109.851 179.366 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 29.2 m -104.6 137.8 41.9 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.214 -0.929 . . . . 0.0 109.441 179.149 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 102.2 -25.77 26.6 Favored Glycine 0 N--CA 1.493 2.496 0 C-N-CA 119.815 -1.184 . . . . 0.0 110.2 -179.004 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.679 ' HB3' HD23 ' A' ' 103' ' ' LEU . 73.4 m-85 -92.37 58.63 3.25 Favored 'General case' 0 N--CA 1.504 2.258 0 CA-C-N 119.009 1.404 . . . . 0.0 109.994 179.771 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -72.88 -37.64 67.26 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.006 -1.059 . . . . 0.0 110.2 179.909 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.87 82.67 2.1 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.039 -1.038 . . . . 0.0 110.47 179.949 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.679 HD23 ' HB3' ' A' ' 100' ' ' TYR . 0.6 OUTLIER -119.71 148.36 43.48 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.168 -0.958 . . . . 0.0 110.349 179.759 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.44 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.1 p -113.03 -26.66 8.37 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.163 -0.96 . . . . 0.0 113.374 -179.516 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.671 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 11.4 m -143.48 -167.31 2.54 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 120.068 -1.645 . . . . 0.0 109.642 179.065 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.512 HD23 ' HD3' ' A' ' 94' ' ' LYS . 14.4 mt -97.15 -38.28 9.78 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.103 -0.998 . . . . 0.0 110.306 179.224 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 22.7 ttt85 -102.98 31.83 4.02 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 120.893 -1.129 . . . . 0.0 109.678 178.153 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.671 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.308 1.7 t -127.71 16.53 6.93 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.154 -0.966 . . . . 0.0 108.953 -179.257 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.491 HG22 ' HG3' ' A' ' 123' ' ' ARG . 1.1 pt -159.25 38.06 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 120.947 -1.095 . . . . 0.0 110.628 -178.545 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.511 ' C ' HG23 ' A' ' 119' ' ' THR . 1.5 mm-40 . . . . . 0 N--CA 1.502 2.133 0 O-C-N 120.749 -1.22 . . . . 0.0 111.321 -178.49 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.511 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.9 OUTLIER . . . . . 0 N--CA 1.494 1.773 0 CA-C-O 120.704 0.288 . . . . 0.0 110.26 . . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.415 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 48.9 t -106.7 155.02 20.11 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.405 -0.81 . . . . 0.0 109.531 179.231 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.783 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -72.74 -35.72 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.395 0 O-C-N 121.081 -1.012 . . . . 0.0 111.255 -179.172 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.491 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 11.0 p -54.21 -31.86 54.2 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.805 -1.185 . . . . 0.0 111.298 -178.861 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.491 ' HG3' HG22 ' A' ' 109' ' ' ILE . 6.7 ttp85 -58.22 -32.86 68.71 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 120.929 -1.107 . . . . 0.0 109.798 178.375 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 60.8 t -81.87 125.24 78.21 Favored Pre-proline 0 N--CA 1.506 2.328 0 O-C-N 121.124 -0.985 . . . . 0.0 109.923 179.68 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.541 ' HD3' ' HB1' ' A' ' 154' ' ' ALA . 39.0 Cg_endo -66.65 178.99 2.35 Favored 'Trans proline' 0 N--CA 1.488 1.152 0 O-C-N 123.097 1.051 . . . . 0.0 110.551 179.407 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -75.17 -37.77 61.15 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.184 -0.948 . . . . 0.0 110.513 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.06 -41.12 82.64 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.001 -1.062 . . . . 0.0 110.097 -179.732 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -66.91 -41.78 86.5 Favored 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.319 179.494 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.572 HD11 HD11 ' A' ' 121' ' ' ILE . 2.4 mt -63.27 -39.97 96.09 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.226 -0.922 . . . . 0.0 109.693 179.561 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -60.1 -38.31 82.58 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.19 -0.943 . . . . 0.0 109.993 179.782 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -57.79 -36.12 71.75 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.072 -1.018 . . . . 0.0 110.381 179.802 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.36 -49.56 73.39 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.072 -1.017 . . . . 0.0 109.754 179.902 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.704 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -62.11 -38.95 90.85 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.148 -0.97 . . . . 0.0 109.797 179.754 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 43.4 ttp85 -66.78 -35.53 80.31 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.155 -0.966 . . . . 0.0 110.452 179.771 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 25.4 mttm -86.84 -35.04 19.28 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.048 -1.032 . . . . 0.0 110.479 179.86 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 16.8 mttm -80.96 -22.55 39.46 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.086 -1.009 . . . . 0.0 111.472 179.692 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.83 32.91 9.48 Favored Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.673 -1.371 . . . . 0.0 109.673 -179.537 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.704 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.1 t -135.9 -161.22 1.13 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.054 -1.262 . . . . 0.0 109.792 179.946 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -130.85 143.08 50.47 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.07 -1.018 . . . . 0.0 109.959 179.944 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.491 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.1 p -129.85 160.2 41.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.216 -0.927 . . . . 0.0 110.373 -179.981 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 43.6 t -169.94 87.83 0.15 Allowed 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.261 -0.9 . . . . 0.0 111.031 179.96 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.748 ' CG ' HD12 ' A' ' 121' ' ' ILE . 62.3 t80 -99.68 159.81 14.77 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.187 -0.945 . . . . 0.0 110.491 -179.882 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -138.26 -59.76 0.63 Allowed 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 179.015 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -139.47 151.07 45.9 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.341 -0.849 . . . . 0.0 109.05 178.778 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 29.7 p -91.73 154.49 18.93 Favored 'General case' 0 N--CA 1.505 2.282 0 C-N-CA 119.05 -1.06 . . . . 0.0 111.093 -179.502 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.9 p -72.58 -26.26 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 O-C-N 121.379 -0.826 . . . . 0.0 111.57 -179.455 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -51.05 -51.74 50.23 Favored 'General case' 0 N--CA 1.516 2.839 0 O-C-N 120.764 -1.21 . . . . 0.0 110.195 -179.955 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.536 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 31.8 p -135.0 -169.03 2.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.237 -0.914 . . . . 0.0 111.121 179.764 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -98.39 60.97 0.9 Allowed Glycine 0 N--CA 1.491 2.329 0 N-CA-C 107.756 -2.138 . . . . 0.0 107.756 178.366 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 20.8 t -100.98 143.24 31.36 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.39 -1.065 . . . . 0.0 109.971 -179.021 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 50.5 mtm-85 -97.16 51.94 1.12 Allowed 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.237 -0.914 . . . . 0.0 109.308 179.046 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.41 96.72 0.03 OUTLIER Glycine 0 N--CA 1.487 2.095 0 N-CA-C 109.746 -1.342 . . . . 0.0 109.746 -179.726 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.0 p -106.65 125.24 50.76 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.19 -1.182 . . . . 0.0 110.258 179.67 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . 0.541 ' HB1' ' HD3' ' A' ' 125' ' ' PRO . . . -149.28 151.3 33.97 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.199 -0.938 . . . . 0.0 110.162 -179.622 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 4.9 m . . . . . 0 N--CA 1.5 2.074 0 O-C-N 121.326 -0.859 . . . . 0.0 110.48 -179.892 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.66 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.504 2.273 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.403 ' HG2' HD13 ' A' ' 77' ' ' LEU . 45.0 Cg_endo -71.49 162.52 42.0 Favored 'Trans proline' 0 C--N 1.317 -1.081 0 O-C-N 123.273 1.144 . . . . 0.0 110.801 -179.611 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -48.96 -31.76 7.95 Favored 'General case' 0 N--CA 1.515 2.803 0 O-C-N 121.433 -0.792 . . . . 0.0 111.318 -179.874 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.0 -35.11 39.96 Favored Glycine 0 N--CA 1.499 2.873 0 O-C-N 120.951 -1.093 . . . . 0.0 110.388 179.801 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -54.88 -32.44 60.86 Favored 'General case' 0 N--CA 1.512 2.664 0 O-C-N 121.013 -1.286 . . . . 0.0 110.617 179.626 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -54.11 -37.86 64.76 Favored 'General case' 0 N--CA 1.512 2.662 0 O-C-N 121.01 -1.056 . . . . 0.0 110.244 179.823 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.6 mmtp -58.86 -37.93 77.61 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.28 -0.887 . . . . 0.0 110.107 179.59 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.887 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.0 pt -114.4 33.51 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 O-C-N 121.237 -0.914 . . . . 0.0 110.544 179.458 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.423 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 5.7 tmtt? -83.6 -43.57 0.81 Allowed Pre-proline 0 N--CA 1.508 2.466 0 O-C-N 121.005 -1.059 . . . . 0.0 113.019 -179.171 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.4 Cg_endo -76.63 -35.6 1.98 Allowed 'Trans proline' 0 N--CA 1.486 1.069 0 O-C-N 122.545 0.76 . . . . 0.0 111.434 -178.485 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.773 HG21 ' CE2' ' A' ' 62' ' ' TYR . 91.5 m -59.22 -42.32 90.71 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 120.98 -1.075 . . . . 0.0 110.042 -179.752 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.887 HD12 ' O ' ' A' ' 19' ' ' ILE . 4.3 mt -65.73 -40.51 92.23 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.225 -0.922 . . . . 0.0 109.574 179.516 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -59.58 -35.87 75.13 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.145 -0.972 . . . . 0.0 110.048 179.287 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -56.49 -36.4 69.1 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 121.019 -1.05 . . . . 0.0 110.315 179.707 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.52 ' CE1' HD12 ' A' ' 55' ' ' LEU . 12.1 m-85 -57.39 -35.76 70.42 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.162 -0.961 . . . . 0.0 110.877 -179.964 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -61.62 -38.56 88.1 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.092 -1.005 . . . . 0.0 111.006 -179.145 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.414 ' H ' HD12 ' A' ' 28' ' ' ILE . 2.9 mp -62.82 -39.36 84.63 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.499 0 C-N-CA 119.038 -1.065 . . . . 0.0 109.35 -179.989 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.5 tp60 -68.82 -54.63 14.69 Favored 'General case' 0 N--CA 1.506 2.366 0 C-N-CA 119.106 -1.037 . . . . 0.0 108.661 178.9 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.833 HD21 HG23 ' A' ' 52' ' ' ILE . 0.1 OUTLIER -58.72 -33.96 70.8 Favored 'General case' 0 N--CA 1.511 2.616 0 O-C-N 121.193 -0.942 . . . . 0.0 109.342 178.407 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -57.8 -41.94 83.17 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.004 -1.06 . . . . 0.0 109.98 179.655 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 -63.18 -49.91 72.41 Favored 'General case' 0 N--CA 1.508 2.453 0 C-N-CA 119.135 -1.026 . . . . 0.0 109.411 -179.982 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.486 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -64.78 -40.22 94.91 Favored 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 119.306 -0.958 . . . . 0.0 109.179 179.051 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -58.38 -34.16 70.41 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.238 -0.914 . . . . 0.0 110.348 179.707 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 17.5 mmtm -93.59 -38.68 11.24 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.048 -1.032 . . . . 0.0 110.45 179.879 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.7 t0 . . . . . 0 N--CA 1.51 2.571 0 O-C-N 121.139 -0.976 . . . . 0.0 110.531 179.992 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 43.1 m . . . . . 0 N--CA 1.497 1.912 0 CA-C-O 120.64 0.257 . . . . 0.0 110.364 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.402 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 85.8 m-20 -56.82 -39.79 74.82 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.169 -0.957 . . . . 0.0 109.951 179.739 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -60.15 -39.29 85.83 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.243 -0.911 . . . . 0.0 109.98 179.633 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 35.5 tp60 -63.76 -46.56 84.74 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.146 -0.971 . . . . 0.0 109.788 179.858 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.522 HD23 HD12 ' A' ' 52' ' ' ILE . 51.0 mt -60.88 -35.08 75.69 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.188 -0.945 . . . . 0.0 110.339 179.94 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.441 ' CE3' ' HA2' ' A' ' 149' ' ' GLY . 41.2 m0 -58.31 -39.64 79.93 Favored 'General case' 0 N--CA 1.511 2.579 0 O-C-N 120.973 -1.079 . . . . 0.0 109.675 179.623 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.813 ' O ' HD22 ' A' ' 55' ' ' LEU . 21.6 tt0 -63.62 -33.15 74.98 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 119.165 -1.014 . . . . 0.0 109.334 178.186 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.833 HG23 HD21 ' A' ' 30' ' ' LEU . 66.9 mt -70.6 -58.52 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.247 0 O-C-N 121.054 -1.029 . . . . 0.0 109.301 179.303 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.01 -25.18 63.44 Favored 'General case' 0 N--CA 1.511 2.616 0 C-N-CA 118.309 -1.356 . . . . 0.0 110.15 178.77 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.4 mm-40 -65.6 -38.84 90.62 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.795 -1.191 . . . . 0.0 109.396 178.495 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.813 HD22 ' O ' ' A' ' 51' ' ' GLU . 0.2 OUTLIER -54.86 -32.56 60.86 Favored 'General case' 0 N--CA 1.512 2.675 0 O-C-N 120.952 -1.093 . . . . 0.0 110.084 179.308 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.437 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 13.7 t60 -57.5 -40.83 79.54 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.013 -1.054 . . . . 0.0 110.052 -179.666 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.55 ' NE2' HD21 ' A' ' 91' ' ' LEU . 4.8 m170 -64.23 -53.17 53.3 Favored 'General case' 0 N--CA 1.508 2.444 0 C-N-CA 119.338 -0.945 . . . . 0.0 109.342 179.33 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 5.2 tp60 -57.24 -35.08 69.26 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.265 -0.897 . . . . 0.0 109.878 179.547 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.449 ' HG2' ' CE1' ' A' ' 26' ' ' PHE . 1.1 mmt85 -66.44 -49.25 67.32 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.179 -0.951 . . . . 0.0 109.28 179.157 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 84.0 p -64.26 -40.3 95.72 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.187 -0.945 . . . . 0.0 109.152 179.216 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.42 ' O ' ' OG1' ' A' ' 65' ' ' THR . 11.8 ttt85 -62.4 -39.65 93.94 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.155 -0.966 . . . . 0.0 109.413 179.076 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.773 ' CE2' HG21 ' A' ' 22' ' ' THR . 34.2 t80 -62.14 -51.2 68.81 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.094 -1.003 . . . . 0.0 109.431 179.403 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.992 HD12 ' HB2' ' A' ' 87' ' ' ALA . 79.5 mt -70.3 -36.98 69.56 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.341 0 O-C-N 121.18 -0.95 . . . . 0.0 109.449 179.342 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.441 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 10.2 t80 -67.09 -42.26 84.91 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.03 -1.044 . . . . 0.0 108.933 178.97 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.42 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 89.4 m -60.72 -41.08 94.56 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.177 -0.952 . . . . 0.0 110.181 179.91 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.617 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.8 pp -83.1 -36.72 24.61 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.997 -1.064 . . . . 0.0 112.407 -179.081 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.608 ' N ' HD12 ' A' ' 66' ' ' LEU . 51.6 t80 -86.7 -35.06 19.5 Favored 'General case' 0 N--CA 1.512 2.641 0 O-C-N 120.519 -1.363 . . . . 0.0 111.817 -179.508 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.441 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 6.9 m-85 -98.3 -3.51 37.07 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 120.851 -1.155 . . . . 0.0 113.2 -178.474 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.91 -58.98 0.61 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.326 -1.484 . . . . 0.0 110.762 179.502 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.412 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 9.5 ttt85 -62.89 -29.54 70.84 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.048 -1.032 . . . . 0.0 110.722 179.987 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.7 mttt 60.16 43.71 13.77 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.801 -1.187 . . . . 0.0 109.966 -179.569 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.16 37.47 3.67 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.322 -0.861 . . . . 0.0 109.806 179.322 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.769 HG13 HD23 ' A' ' 77' ' ' LEU . 14.4 tt -156.95 162.64 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.165 -0.959 . . . . 0.0 110.221 -179.821 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -110.82 147.97 33.38 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.19 -0.944 . . . . 0.0 110.09 179.554 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -45.17 -32.68 1.95 Allowed 'General case' 0 N--CA 1.517 2.878 0 O-C-N 121.361 -0.837 . . . . 0.0 111.7 -179.779 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -62.14 -49.82 74.34 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 120.978 -1.076 . . . . 0.0 109.494 179.685 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.769 HD23 HG13 ' A' ' 73' ' ' ILE . 31.3 tp -66.54 -46.44 76.1 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.14 -1.024 . . . . 0.0 108.688 179.052 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.443 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 18.9 t80 -60.65 -37.26 80.94 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.3 -0.875 . . . . 0.0 109.535 179.143 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -72.78 -42.76 63.62 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.06 -1.025 . . . . 0.0 108.936 178.986 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.66 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 79.8 t90 -58.48 -36.43 73.72 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.312 -0.867 . . . . 0.0 109.757 179.094 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.678 HD22 ' CD2' ' A' ' 86' ' ' TYR . 30.7 mt -69.28 -47.45 64.56 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.079 -1.013 . . . . 0.0 109.037 179.45 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.2 mm -57.68 -32.91 43.67 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.588 0 O-C-N 121.18 -0.95 . . . . 0.0 110.151 179.231 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.33 -22.33 28.54 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 120.951 -1.093 . . . . 0.0 111.747 -179.886 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.439 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 10.5 mm-40 -100.35 20.29 15.08 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 120.752 -1.217 . . . . 0.0 112.046 179.956 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 71.3 tttt 72.7 83.06 0.13 Allowed 'General case' 0 N--CA 1.51 2.536 0 O-C-N 120.974 -1.079 . . . . 0.0 111.29 179.393 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.678 ' CD2' HD22 ' A' ' 81' ' ' LEU . 28.0 m-85 -139.32 -63.69 0.51 Allowed 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.509 -0.745 . . . . 0.0 110.117 -179.385 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.992 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -114.68 -171.77 1.99 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.395 -0.815 . . . . 0.0 110.147 179.877 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.437 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 21.2 t0 -123.17 102.88 8.21 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.158 -0.964 . . . . 0.0 110.263 -179.839 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.11 -40.41 74.92 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.159 -0.963 . . . . 0.0 109.892 179.753 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.695 HD23 HD13 ' A' ' 106' ' ' LEU . 20.7 tp -62.52 -46.6 87.67 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.156 -0.965 . . . . 0.0 109.611 179.71 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.581 ' HA ' HD21 ' A' ' 106' ' ' LEU . 65.9 tp -65.81 -44.88 84.33 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.261 -0.975 . . . . 0.0 108.947 179.216 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 54.1 mt -58.28 -36.5 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.508 0 O-C-N 121.149 -0.969 . . . . 0.0 108.74 178.654 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.65 -40.21 96.29 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.086 -1.009 . . . . 0.0 109.269 178.733 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.441 ' HD2' ' CZ ' ' A' ' 100' ' ' TYR . 5.2 mmtm -59.15 -47.97 83.34 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.085 -1.009 . . . . 0.0 109.393 179.295 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.9 m0 -59.13 -33.19 70.59 Favored 'General case' 0 N--CA 1.508 2.466 0 C-N-CA 119.542 -0.863 . . . . 0.0 110.301 179.591 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.36 -30.68 30.17 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.053 -1.03 . . . . 0.0 110.851 179.547 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.1 mmtt -53.69 -176.95 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.738 0 O-C-N 120.959 -1.088 . . . . 0.0 110.674 -179.972 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -103.36 134.71 46.28 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.126 -0.984 . . . . 0.0 109.699 179.207 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 95.77 11.19 55.64 Favored Glycine 0 N--CA 1.493 2.475 0 C-N-CA 120.172 -1.013 . . . . 0.0 111.094 -179.465 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.603 ' HB3' HD23 ' A' ' 103' ' ' LEU . 47.8 m-85 -117.82 71.22 0.81 Allowed 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 119.405 1.602 . . . . 0.0 109.876 179.738 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -95.21 -36.16 11.56 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.129 -0.982 . . . . 0.0 110.666 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.65 72.88 1.09 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.025 -1.047 . . . . 0.0 110.736 -179.577 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.603 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.0 OUTLIER -122.24 154.73 37.13 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.032 -1.043 . . . . 0.0 109.945 179.449 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.435 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.7 p -116.11 -31.45 5.68 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -179.15 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.614 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.6 m -141.71 -167.87 2.53 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 120.119 -1.613 . . . . 0.0 109.961 179.257 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.695 HD13 HD23 ' A' ' 90' ' ' LEU . 20.1 mt -95.92 -38.99 10.02 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.12 -0.987 . . . . 0.0 109.929 179.139 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -101.86 28.48 5.66 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 120.969 -1.082 . . . . 0.0 109.999 178.055 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.614 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.297 1.8 t -126.96 15.02 7.4 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.086 -1.009 . . . . 0.0 109.351 -179.631 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.474 HG23 ' O ' ' A' ' 108' ' ' CYS . 1.0 OUTLIER -159.48 37.54 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.375 0 O-C-N 120.832 -1.167 . . . . 0.0 111.018 -178.71 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.564 ' O ' HG23 ' A' ' 119' ' ' THR . 0.8 OUTLIER . . . . . 0 N--CA 1.501 2.12 0 O-C-N 120.643 -1.285 . . . . 0.0 111.652 -178.987 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.564 HG23 ' O ' ' A' ' 110' ' ' GLN . 2.4 m . . . . . 0 N--CA 1.493 1.718 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.438 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 49.5 t -100.67 155.09 18.08 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.2 -0.937 . . . . 0.0 109.526 179.262 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.804 HD12 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -71.4 -37.07 63.47 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.37 0 O-C-N 121.102 -0.999 . . . . 0.0 110.877 -179.444 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.46 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 11.2 p -53.57 -33.36 54.52 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 120.89 -1.131 . . . . 0.0 111.22 -178.824 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.438 ' HG2' HG22 ' A' ' 109' ' ' ILE . 0.0 OUTLIER -60.61 -34.4 74.19 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.051 -1.031 . . . . 0.0 109.539 178.35 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 47.2 t -80.64 125.34 80.78 Favored Pre-proline 0 N--CA 1.504 2.271 0 O-C-N 121.131 -0.98 . . . . 0.0 109.824 179.629 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.507 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.4 Cg_endo -65.41 175.13 4.42 Favored 'Trans proline' 0 N--CA 1.489 1.229 0 O-C-N 123.181 1.095 . . . . 0.0 110.803 179.516 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.12 -36.39 61.64 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.275 -0.891 . . . . 0.0 110.791 -179.721 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.56 -40.69 79.5 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 120.992 -1.067 . . . . 0.0 110.16 -179.657 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -70.07 -41.35 74.24 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.222 179.233 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.579 ' O ' HG11 ' A' ' 140' ' ' VAL . 2.9 mt -65.7 -38.78 90.16 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.579 179.148 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -61.23 -39.35 89.95 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.175 -0.953 . . . . 0.0 109.838 179.645 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -59.75 -38.57 82.11 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.131 -0.981 . . . . 0.0 110.143 179.825 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -60.8 -44.31 97.03 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.127 -0.983 . . . . 0.0 109.917 179.996 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.454 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -61.47 -44.42 97.13 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.168 -0.957 . . . . 0.0 109.833 179.854 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.93 -34.27 71.54 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.258 -0.901 . . . . 0.0 110.288 179.663 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 24.4 mttt -75.9 -31.96 59.42 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.045 -1.035 . . . . 0.0 110.934 179.997 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.14 23.77 8.7 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 120.926 -1.108 . . . . 0.0 111.681 -179.934 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.59 46.62 53.36 Favored Glycine 0 N--CA 1.5 2.945 0 O-C-N 120.663 -1.273 . . . . 0.0 110.722 179.257 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.454 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.9 t -147.61 -164.92 2.12 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.092 -1.24 . . . . 0.0 110.371 179.842 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.6 mp0 -136.27 150.83 49.11 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.227 -0.921 . . . . 0.0 110.285 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.579 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.0 p -130.72 160.93 41.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 121.203 -0.935 . . . . 0.0 110.034 179.79 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 31.9 t -167.98 81.18 0.18 Allowed 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.126 -0.984 . . . . 0.0 111.233 -179.964 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.804 ' CG ' HD12 ' A' ' 121' ' ' ILE . 42.7 t80 -93.86 161.39 14.33 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.197 -0.94 . . . . 0.0 110.099 179.761 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 4.5 m80 -139.47 -60.55 0.56 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.605 -0.684 . . . . 0.0 109.175 179.065 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -132.77 152.21 51.82 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.44 -0.787 . . . . 0.0 109.198 178.967 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . 0.401 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 25.7 p -97.08 156.56 16.32 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.13 -0.981 . . . . 0.0 110.803 -179.84 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 21.3 m -76.48 -24.4 15.88 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 O-C-N 121.315 -0.866 . . . . 0.0 111.859 -179.384 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -49.83 -53.69 23.9 Favored 'General case' 0 N--CA 1.515 2.822 0 O-C-N 120.728 -1.232 . . . . 0.0 110.42 -179.733 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 25.2 p -133.88 -163.05 1.31 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.308 -0.87 . . . . 0.0 110.387 179.851 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . 0.441 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.19 63.46 0.63 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 108.209 -1.956 . . . . 0.0 108.209 178.549 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 38.4 t -104.49 144.77 31.22 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.301 -1.117 . . . . 0.0 110.068 -179.175 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 19.0 mtt85 -101.59 44.63 1.0 Allowed 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.398 -0.813 . . . . 0.0 109.509 179.275 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 76.61 95.93 0.18 Allowed Glycine 0 N--CA 1.488 2.123 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 -179.823 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.3 p -109.02 126.26 52.94 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.093 -1.239 . . . . 0.0 110.435 179.842 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -148.68 150.37 33.09 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.16 -0.962 . . . . 0.0 110.27 -179.543 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.497 1.914 0 O-C-N 121.27 -0.894 . . . . 0.0 110.665 -179.747 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.627 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.507 2.424 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -71.8 166.84 28.29 Favored 'Trans proline' 0 C--N 1.317 -1.083 0 O-C-N 123.174 1.091 . . . . 0.0 110.696 -179.617 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -47.53 -32.61 5.48 Favored 'General case' 0 N--CA 1.516 2.838 0 O-C-N 121.549 -0.719 . . . . 0.0 111.404 -179.814 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.07 -32.31 42.35 Favored Glycine 0 N--CA 1.498 2.822 0 O-C-N 121.047 -1.033 . . . . 0.0 110.571 179.636 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.554 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 26.8 t80 -52.01 -33.2 37.3 Favored 'General case' 0 N--CA 1.514 2.741 0 O-C-N 120.935 -1.332 . . . . 0.0 110.44 179.758 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -53.55 -34.99 60.26 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.108 -0.995 . . . . 0.0 110.208 179.457 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.13 -39.77 83.36 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.264 -0.897 . . . . 0.0 110.034 179.574 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.809 HD12 HD11 ' A' ' 23' ' ' LEU . 2.1 pt -113.51 34.61 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.21 -0.931 . . . . 0.0 110.497 179.658 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.426 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 7.4 tmtt? -85.02 -43.31 0.67 Allowed Pre-proline 0 N--CA 1.51 2.539 0 O-C-N 121.07 -1.019 . . . . 0.0 113.441 -178.993 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.426 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.4 Cg_endo -75.73 -36.74 1.99 Allowed 'Trans proline' 0 N--CA 1.486 1.074 0 O-C-N 122.591 0.785 . . . . 0.0 111.699 -178.134 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.606 HG21 ' CE2' ' A' ' 62' ' ' TYR . 89.4 m -60.61 -42.83 97.59 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 120.942 -1.099 . . . . 0.0 109.934 -179.737 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.809 HD11 HD12 ' A' ' 19' ' ' ILE . 84.8 mt -65.35 -39.66 92.63 Favored 'General case' 0 N--CA 1.507 2.401 0 C-N-CA 119.477 -0.889 . . . . 0.0 109.554 179.51 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -58.39 -35.85 72.65 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.138 -0.976 . . . . 0.0 110.127 179.355 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -56.63 -36.0 68.97 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.058 -1.026 . . . . 0.0 110.368 179.647 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.761 ' CD2' HD22 ' A' ' 55' ' ' LEU . 22.2 m-85 -57.72 -38.78 75.89 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.04 -1.037 . . . . 0.0 110.479 -179.965 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -63.07 -23.35 67.4 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.214 -0.929 . . . . 0.0 111.82 -179.483 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.573 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.6 mp -81.21 -33.59 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.412 0 O-C-N 120.759 -1.213 . . . . 0.0 109.827 179.659 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -82.37 -36.31 26.92 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 120.997 -1.064 . . . . 0.0 109.28 178.557 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.772 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -74.29 -31.88 62.67 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.118 -0.989 . . . . 0.0 110.102 178.843 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -68.75 -35.73 77.47 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 120.842 -1.161 . . . . 0.0 110.01 179.479 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -65.87 -41.8 91.14 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.012 -1.055 . . . . 0.0 109.428 179.583 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.612 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -67.37 -41.94 84.22 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.215 -0.928 . . . . 0.0 109.223 179.142 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.0 mm100 -58.72 -34.39 71.29 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.352 -0.843 . . . . 0.0 110.365 179.812 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.2 mtmm -92.91 -38.88 11.47 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.029 -1.045 . . . . 0.0 110.372 179.887 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.51 2.55 0 O-C-N 121.204 -0.935 . . . . 0.0 110.011 179.847 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.504 2.232 0 CA-C-O 120.43 0.157 . . . . 0.0 110.747 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -58.71 -39.36 80.6 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.181 -0.949 . . . . 0.0 110.132 -179.889 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -60.39 -39.67 88.12 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.15 -0.969 . . . . 0.0 110.086 179.898 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 39.3 tp60 -60.85 -42.23 97.41 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.098 -1.001 . . . . 0.0 110.02 -179.948 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.661 HD23 HD12 ' A' ' 52' ' ' ILE . 12.4 mt -60.08 -38.1 81.9 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.162 -0.961 . . . . 0.0 110.436 179.988 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.51 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 52.6 m0 -57.05 -40.47 76.88 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.094 -1.003 . . . . 0.0 109.574 179.794 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -60.88 -35.47 76.7 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.321 -0.862 . . . . 0.0 109.799 179.007 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.772 HG23 ' CG ' ' A' ' 30' ' ' LEU . 73.8 mt -65.23 -51.45 65.08 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 121.109 -0.994 . . . . 0.0 109.394 179.585 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.443 ' HG3' ' N ' ' A' ' 54' ' ' GLN . 0.0 OUTLIER -64.8 -30.78 71.79 Favored 'General case' 0 N--CA 1.501 2.123 0 C-N-CA 118.65 -1.22 . . . . 0.0 109.692 179.307 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.443 ' N ' ' HG3' ' A' ' 53' ' ' MET . 5.0 mm100 -64.95 -36.79 85.52 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.089 -1.007 . . . . 0.0 109.358 178.733 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.761 HD22 ' CD2' ' A' ' 26' ' ' PHE . 13.9 mt -52.78 -33.71 50.0 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.081 -1.012 . . . . 0.0 109.928 179.217 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.43 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 19.6 t60 -56.71 -38.02 71.73 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.086 -1.009 . . . . 0.0 109.771 179.235 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.553 ' CD2' HD21 ' A' ' 91' ' ' LEU . 5.9 m170 -60.0 -49.64 76.88 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.027 -1.046 . . . . 0.0 109.048 178.999 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 26.2 tp60 -59.69 -38.17 80.82 Favored 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 119.634 -0.826 . . . . 0.0 109.427 179.134 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.441 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.86 -48.83 75.16 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.233 -0.987 . . . . 0.0 108.879 179.03 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.454 ' HA ' ' HB1' ' A' ' 87' ' ' ALA . 92.1 p -64.58 -42.14 95.81 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.148 -0.97 . . . . 0.0 108.763 178.834 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 46.8 ttt85 -62.54 -39.83 94.86 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.185 -0.947 . . . . 0.0 109.303 178.803 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.606 ' CE2' HG21 ' A' ' 22' ' ' THR . 44.2 t80 -61.96 -49.55 75.66 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.261 -0.9 . . . . 0.0 109.386 179.494 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.83 HD12 ' HB2' ' A' ' 87' ' ' ALA . 90.2 mt -71.76 -39.16 68.14 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.36 0 O-C-N 121.26 -0.9 . . . . 0.0 109.022 179.153 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.507 ' CE1' HG23 ' A' ' 92' ' ' ILE . 40.3 t80 -62.77 -41.17 99.11 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.136 -0.977 . . . . 0.0 109.005 178.901 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 51.8 m -67.1 -38.19 85.25 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.202 -0.936 . . . . 0.0 110.793 -179.825 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.661 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.17 -36.35 24.78 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 120.949 -1.094 . . . . 0.0 112.489 -178.875 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.611 ' N ' HD12 ' A' ' 66' ' ' LEU . 66.1 t80 -86.55 -35.4 19.53 Favored 'General case' 0 N--CA 1.512 2.652 0 O-C-N 120.54 -1.35 . . . . 0.0 111.907 -179.299 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.401 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 17.2 m-85 -98.35 -3.39 37.16 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 120.873 -1.142 . . . . 0.0 113.077 -178.649 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -139.25 -60.27 0.57 Allowed 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.383 -1.448 . . . . 0.0 111.04 179.698 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.423 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 6.9 tpt85 -59.66 -29.59 68.16 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.081 -1.012 . . . . 0.0 110.754 -179.749 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.8 tttt 59.68 43.44 15.58 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.866 -1.146 . . . . 0.0 109.947 -179.609 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -117.99 37.34 4.0 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.425 -0.797 . . . . 0.0 109.925 179.401 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.661 HG21 ' CD1' ' A' ' 66' ' ' LEU . 14.2 tt -157.19 162.27 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.19 -0.944 . . . . 0.0 110.345 -179.88 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.5 t -110.7 149.46 30.45 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.184 -0.948 . . . . 0.0 109.788 179.356 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.0 ttmt -45.31 -33.11 2.28 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.273 -0.892 . . . . 0.0 111.587 -179.78 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -62.36 -49.31 76.06 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 120.928 -1.108 . . . . 0.0 109.479 179.379 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.18 -47.62 76.32 Favored 'General case' 0 N--CA 1.507 2.395 0 C-N-CA 119.149 -1.02 . . . . 0.0 108.6 178.917 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.701 ' HA ' HD12 ' A' ' 81' ' ' LEU . 18.1 t80 -60.21 -38.72 84.18 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 119.661 -0.815 . . . . 0.0 109.692 179.436 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -69.59 -42.05 74.97 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.065 -1.022 . . . . 0.0 108.825 178.766 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.627 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 67.9 t90 -58.27 -38.88 77.83 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.243 -0.911 . . . . 0.0 109.595 179.116 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.701 HD12 ' HA ' ' A' ' 78' ' ' TYR . 9.5 mt -65.65 -52.11 54.28 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.234 -0.916 . . . . 0.0 109.282 179.425 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.401 HG21 ' HG3' ' A' ' 89' ' ' LYS . 35.6 mm -59.12 -32.73 48.58 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.521 0 O-C-N 121.23 -0.919 . . . . 0.0 110.098 179.466 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 20.0 tttp -85.84 -14.3 45.43 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 120.938 -1.101 . . . . 0.0 112.032 -179.913 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.433 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 22.3 mm-40 -108.53 21.39 17.35 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 120.554 -1.341 . . . . 0.0 112.076 -179.97 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 73.25 78.4 0.14 Allowed 'General case' 0 N--CA 1.511 2.576 0 O-C-N 120.981 -1.074 . . . . 0.0 111.418 179.278 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.671 ' HE2' HD13 ' A' ' 23' ' ' LEU . 25.9 m-85 -134.04 -65.0 0.68 Allowed 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.493 -0.755 . . . . 0.0 109.808 -179.869 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.83 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -121.16 -175.61 3.1 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.304 -0.873 . . . . 0.0 109.937 179.68 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.43 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 7.9 t0 -117.3 122.08 42.92 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.145 -0.972 . . . . 0.0 110.134 179.906 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.401 ' HG3' HG21 ' A' ' 82' ' ' ILE . 12.3 mtmt -74.71 -40.57 61.25 Favored 'General case' 0 N--CA 1.506 2.37 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.725 179.742 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.578 HD12 ' CD2' ' A' ' 106' ' ' LEU . 0.1 OUTLIER -62.16 -42.96 99.76 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.157 -0.964 . . . . 0.0 109.341 179.514 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.553 HD21 ' CD2' ' A' ' 57' ' ' HIS . 22.1 tp -63.73 -48.4 77.2 Favored 'General case' 0 N--CA 1.507 2.381 0 C-N-CA 119.289 -0.964 . . . . 0.0 109.14 179.737 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.507 HG23 ' CE1' ' A' ' 64' ' ' TYR . 49.0 mt -60.95 -37.14 76.37 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.447 0 O-C-N 121.081 -1.012 . . . . 0.0 108.336 178.198 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.79 -39.55 76.53 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.125 -0.984 . . . . 0.0 108.694 177.907 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.439 ' HD2' ' CZ ' ' A' ' 100' ' ' TYR . 5.7 mmtm -58.72 -45.32 89.86 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.175 -0.953 . . . . 0.0 109.295 178.933 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.0 m0 -64.12 -35.37 80.55 Favored 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 119.485 -0.886 . . . . 0.0 110.079 179.356 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.23 -29.66 34.41 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.064 -1.023 . . . . 0.0 110.71 179.369 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.8 mmtt -53.72 -176.85 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.681 0 O-C-N 121.0 -1.062 . . . . 0.0 110.607 179.802 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 36.8 m -103.66 131.83 50.46 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.137 -0.977 . . . . 0.0 109.687 179.175 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.27 9.55 50.82 Favored Glycine 0 N--CA 1.493 2.47 0 C-N-CA 120.242 -0.98 . . . . 0.0 111.053 -179.458 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.598 ' HB3' HD23 ' A' ' 103' ' ' LEU . 51.4 m-85 -118.22 71.13 0.82 Allowed 'General case' 0 N--CA 1.493 1.724 0 CA-C-N 119.459 1.629 . . . . 0.0 109.921 179.697 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -95.17 -32.41 13.07 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.087 -1.008 . . . . 0.0 110.872 179.979 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -126.55 68.42 1.23 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.923 -1.11 . . . . 0.0 110.883 -179.516 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.598 HD23 ' HB3' ' A' ' 100' ' ' TYR . 0.9 OUTLIER -116.53 155.12 29.22 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.907 -1.121 . . . . 0.0 109.85 179.225 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.432 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.8 p -115.96 -34.8 4.63 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.156 -0.965 . . . . 0.0 113.473 -178.852 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.64 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.0 m -139.59 -167.6 2.3 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 120.18 -1.575 . . . . 0.0 110.088 179.501 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.578 ' CD2' HD12 ' A' ' 90' ' ' LEU . 14.8 mt -96.65 -39.51 9.46 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.204 -0.935 . . . . 0.0 110.048 179.338 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -100.86 28.03 5.53 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 120.967 -1.083 . . . . 0.0 109.98 177.903 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.64 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.301 1.8 t -125.68 14.81 8.12 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.107 -0.995 . . . . 0.0 109.017 -179.707 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.472 HG22 ' HG3' ' A' ' 123' ' ' ARG . 1.1 pt -158.11 36.06 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.263 0 O-C-N 120.832 -1.168 . . . . 0.0 110.955 -178.492 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.579 ' O ' HG23 ' A' ' 119' ' ' THR . 60.7 tp60 . . . . . 0 N--CA 1.499 1.998 0 O-C-N 120.707 -1.246 . . . . 0.0 111.45 -178.671 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.579 HG23 ' O ' ' A' ' 110' ' ' GLN . 6.6 m . . . . . 0 N--CA 1.494 1.772 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.427 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 37.5 t -86.19 154.7 21.13 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.273 -0.892 . . . . 0.0 109.73 179.482 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.949 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -76.68 -29.85 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.383 0 O-C-N 121.139 -0.976 . . . . 0.0 111.593 -179.201 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.444 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.7 p -58.01 -35.38 71.17 Favored 'General case' 0 N--CA 1.511 2.607 0 O-C-N 120.655 -1.278 . . . . 0.0 110.659 -179.163 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.472 ' HG3' HG22 ' A' ' 109' ' ' ILE . 1.2 ttt-85 -55.84 -32.92 64.04 Favored 'General case' 0 N--CA 1.513 2.686 0 O-C-N 121.023 -1.048 . . . . 0.0 110.071 178.904 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.629 HG13 ' CD ' ' A' ' 128' ' ' GLN . 60.8 t -79.44 124.6 83.93 Favored Pre-proline 0 N--CA 1.504 2.243 0 O-C-N 121.119 -0.988 . . . . 0.0 109.936 179.729 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.21 178.76 2.3 Favored 'Trans proline' 0 N--CA 1.488 1.203 0 O-C-N 123.11 1.058 . . . . 0.0 110.81 179.71 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -75.21 -36.93 61.33 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.255 -0.903 . . . . 0.0 110.574 179.979 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.17 -40.54 77.52 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 120.981 -1.074 . . . . 0.0 110.066 -179.761 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . 0.629 ' CD ' HG13 ' A' ' 124' ' ' VAL . 53.6 tt0 -69.48 -42.32 74.98 Favored 'General case' 0 N--CA 1.505 2.301 0 C-N-CA 119.402 -0.919 . . . . 0.0 109.075 179.247 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.685 HD11 HD11 ' A' ' 121' ' ' ILE . 2.9 mt -64.41 -38.79 92.25 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.52 -0.872 . . . . 0.0 109.476 179.184 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -60.13 -39.39 86.12 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.16 -0.962 . . . . 0.0 109.929 179.728 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -58.89 -38.55 79.11 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.187 -0.946 . . . . 0.0 110.263 179.903 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -63.48 -39.76 95.3 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.144 -0.973 . . . . 0.0 109.993 179.783 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.84 -41.95 97.71 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 121.211 -0.931 . . . . 0.0 109.82 179.891 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -60.21 -38.1 82.33 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.158 -0.964 . . . . 0.0 109.823 179.515 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -58.0 -35.37 71.13 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.132 -0.98 . . . . 0.0 110.555 179.859 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -105.08 16.63 25.51 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 120.963 -1.085 . . . . 0.0 112.061 -179.993 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 58.01 44.44 94.59 Favored Glycine 0 N--CA 1.497 2.731 0 O-C-N 120.635 -1.291 . . . . 0.0 110.174 179.448 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 7.4 t -137.83 -162.7 1.33 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.136 -1.214 . . . . 0.0 110.028 179.957 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -136.97 147.11 46.12 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.104 -0.997 . . . . 0.0 110.29 179.963 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.599 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.5 p -133.67 161.62 40.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.165 -0.959 . . . . 0.0 110.288 -179.858 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 45.6 t -164.06 111.16 1.1 Allowed 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.302 -0.874 . . . . 0.0 110.926 179.948 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.949 ' CD1' HD12 ' A' ' 121' ' ' ILE . 81.7 t80 -104.83 137.24 42.92 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.226 -0.921 . . . . 0.0 110.869 -179.783 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 11.3 m-70 -111.93 -56.76 2.35 Favored 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 178.122 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -151.71 156.03 39.5 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.5 -0.75 . . . . 0.0 109.574 179.115 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . 0.438 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 27.3 p -95.0 155.24 16.81 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.07 -1.019 . . . . 0.0 111.036 -179.553 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.9 p -72.38 -24.09 21.8 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.461 0 O-C-N 121.391 -0.818 . . . . 0.0 111.696 -179.528 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -51.79 -53.08 43.9 Favored 'General case' 0 N--CA 1.513 2.714 0 O-C-N 120.749 -1.219 . . . . 0.0 110.182 -179.918 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.51 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 28.3 p -135.41 -164.94 1.61 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.208 -0.932 . . . . 0.0 111.026 -179.997 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.39 59.42 0.71 Allowed Glycine 0 N--CA 1.491 2.315 0 N-CA-C 107.9 -2.08 . . . . 0.0 107.9 178.539 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 21.0 t -100.59 138.34 37.78 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.401 -1.058 . . . . 0.0 109.809 -179.228 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -96.44 51.58 1.19 Allowed 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.233 -0.917 . . . . 0.0 109.623 179.108 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 72.0 99.37 0.06 OUTLIER Glycine 0 N--CA 1.487 2.071 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 179.761 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 p -110.73 127.16 55.23 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.261 -1.14 . . . . 0.0 110.099 179.38 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -152.03 148.9 28.25 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.061 -1.024 . . . . 0.0 110.479 -179.391 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.495 1.785 0 O-C-N 121.135 -0.978 . . . . 0.0 110.261 -179.891 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.743 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.509 2.5 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -70.91 161.79 44.89 Favored 'Trans proline' 0 C--N 1.316 -1.175 0 O-C-N 123.374 1.197 . . . . 0.0 110.63 -179.928 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -48.51 -31.93 7.16 Favored 'General case' 0 N--CA 1.515 2.799 0 O-C-N 121.366 -0.833 . . . . 0.0 111.441 -179.761 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.21 -34.13 46.92 Favored Glycine 0 N--CA 1.499 2.845 0 O-C-N 120.95 -1.094 . . . . 0.0 110.588 179.939 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -54.57 -31.03 55.96 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 120.913 -1.346 . . . . 0.0 110.879 179.818 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -54.09 -37.61 64.45 Favored 'General case' 0 N--CA 1.512 2.664 0 O-C-N 120.984 -1.073 . . . . 0.0 110.169 179.756 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.2 mptt -59.11 -36.4 75.12 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.154 -0.966 . . . . 0.0 110.224 179.492 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.666 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.7 pt -116.9 36.04 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.973 0 O-C-N 121.089 -1.007 . . . . 0.0 110.527 179.705 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.434 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.6 OUTLIER -83.97 -42.71 0.77 Allowed Pre-proline 0 N--CA 1.509 2.499 0 O-C-N 121.095 -1.003 . . . . 0.0 113.264 -179.092 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.434 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.7 Cg_endo -75.95 -38.57 1.17 Allowed 'Trans proline' 0 N--CA 1.487 1.126 0 O-C-N 122.596 0.787 . . . . 0.0 111.631 -178.292 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.735 HG21 ' CE2' ' A' ' 62' ' ' TYR . 68.2 m -60.27 -43.86 95.81 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 120.991 -1.068 . . . . 0.0 109.99 -179.768 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.666 HD12 ' O ' ' A' ' 19' ' ' ILE . 2.2 mt -62.88 -37.92 88.8 Favored 'General case' 0 N--CA 1.507 2.387 0 C-N-CA 119.331 -0.947 . . . . 0.0 109.689 179.435 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 4.1 m -57.5 -37.51 73.1 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.101 -0.999 . . . . 0.0 110.24 179.627 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -58.01 -38.64 76.55 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.075 -1.015 . . . . 0.0 109.997 179.699 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.763 ' CD2' HD22 ' A' ' 55' ' ' LEU . 13.9 m-85 -57.76 -39.32 77.14 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.178 -0.951 . . . . 0.0 110.26 179.821 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.64 -22.53 65.35 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.199 -0.938 . . . . 0.0 111.668 -179.554 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.54 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.7 mp -80.22 -34.12 14.69 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.469 0 O-C-N 120.842 -1.161 . . . . 0.0 109.978 179.931 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 40.4 tt0 -81.29 -34.11 32.19 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.908 -1.12 . . . . 0.0 109.514 178.786 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.748 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -76.64 -32.7 58.17 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.062 -1.024 . . . . 0.0 109.841 178.769 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -68.76 -34.94 76.44 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 120.969 -1.082 . . . . 0.0 109.878 179.307 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.74 -41.07 79.47 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.047 -1.033 . . . . 0.0 109.647 179.564 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.468 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -65.57 -40.98 93.37 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.181 -0.95 . . . . 0.0 109.499 179.342 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 -58.33 -34.64 70.84 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.212 -0.93 . . . . 0.0 110.507 -179.996 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.37 -39.17 10.16 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 120.939 -1.101 . . . . 0.0 110.678 -179.904 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 N--CA 1.511 2.576 0 O-C-N 121.128 -0.982 . . . . 0.0 110.139 -179.963 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 67.1 m . . . . . 0 N--CA 1.496 1.856 0 CA-C-O 120.64 0.257 . . . . 0.0 110.393 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -55.1 -36.87 66.15 Favored 'General case' 0 N--CA 1.512 2.652 0 O-C-N 121.19 -0.944 . . . . 0.0 110.069 179.628 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -58.98 -39.99 83.46 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.124 -0.985 . . . . 0.0 109.985 179.651 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.2 tp60 -61.49 -40.27 93.97 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.121 -0.987 . . . . 0.0 109.82 179.695 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.43 HD23 HD12 ' A' ' 52' ' ' ILE . 94.3 mt -66.51 -34.63 78.35 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.213 -0.929 . . . . 0.0 110.371 179.783 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.488 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 37.3 m0 -58.52 -36.83 74.45 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.037 -1.039 . . . . 0.0 109.449 179.703 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -66.66 -33.7 76.23 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.757 -1.214 . . . . 0.0 109.227 177.96 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.748 HG23 ' CG ' ' A' ' 30' ' ' LEU . 75.5 mt -70.33 -54.61 17.77 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 O-C-N 120.986 -1.071 . . . . 0.0 109.323 179.285 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.501 ' CE ' ' HB2' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -60.71 -32.64 71.87 Favored 'General case' 0 N--CA 1.508 2.465 0 C-N-CA 118.61 -1.236 . . . . 0.0 109.54 178.868 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.38 -39.59 87.82 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 120.875 -1.14 . . . . 0.0 109.398 179.022 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.763 HD22 ' CD2' ' A' ' 26' ' ' PHE . 21.2 mt -54.59 -34.31 61.77 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.097 -1.002 . . . . 0.0 110.012 179.242 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.453 ' CE1' ' HB2' ' A' ' 88' ' ' ASP . 82.2 t60 -56.46 -40.23 74.49 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 120.991 -1.068 . . . . 0.0 109.626 179.184 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.43 ' CD2' HD21 ' A' ' 91' ' ' LEU . 7.5 m170 -61.23 -49.1 78.49 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.206 -0.934 . . . . 0.0 108.991 178.966 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -62.72 -41.01 98.95 Favored 'General case' 0 N--CA 1.504 2.249 0 C-N-CA 119.417 -0.913 . . . . 0.0 108.87 178.747 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.456 ' HD2' ' CD2' ' A' ' 26' ' ' PHE . 2.5 mtp85 -61.18 -45.9 92.7 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.247 -0.908 . . . . 0.0 109.302 179.087 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 93.2 p -65.9 -40.02 91.13 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.231 -0.918 . . . . 0.0 109.194 179.226 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 24.0 ttt85 -65.17 -38.73 91.48 Favored 'General case' 0 N--CA 1.508 2.452 0 C-N-CA 119.212 -0.995 . . . . 0.0 109.453 179.082 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.735 ' CE2' HG21 ' A' ' 22' ' ' THR . 43.0 t80 -61.21 -48.3 82.14 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.124 -0.985 . . . . 0.0 109.52 179.507 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.707 HD12 ' HB2' ' A' ' 87' ' ' ALA . 86.9 mt -76.77 -41.66 33.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.3 0 O-C-N 121.217 -0.927 . . . . 0.0 109.216 179.399 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.443 ' OH ' ' NH1' ' A' ' 96' ' ' ARG . 46.8 t80 -59.54 -31.14 69.13 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.253 -0.904 . . . . 0.0 109.831 178.71 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 59.7 m -80.67 -37.52 30.7 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 120.917 -1.115 . . . . 0.0 110.364 179.837 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.608 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -82.96 -32.44 27.1 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 120.942 -1.099 . . . . 0.0 112.512 -179.061 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.487 ' N ' HD12 ' A' ' 66' ' ' LEU . 62.1 t80 -86.52 -35.31 19.64 Favored 'General case' 0 N--CA 1.512 2.654 0 O-C-N 120.696 -1.253 . . . . 0.0 111.916 -179.207 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -98.37 -23.83 15.44 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.851 -1.156 . . . . 0.0 112.8 -178.29 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.421 ' HE2' ' CD2' ' A' ' 64' ' ' TYR . 0.7 OUTLIER -114.8 -56.45 2.38 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.617 -1.302 . . . . 0.0 111.26 -179.311 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.424 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 6.6 ttt85 -67.67 -30.65 70.24 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.067 -1.02 . . . . 0.0 110.63 -179.906 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 tttm 59.08 44.72 15.67 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 120.829 -1.169 . . . . 0.0 110.164 -179.817 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -114.24 37.05 3.47 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.307 -0.871 . . . . 0.0 109.716 179.181 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.809 HG13 HD23 ' A' ' 77' ' ' LEU . 14.6 tt -157.83 162.65 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.253 -0.904 . . . . 0.0 110.14 -179.694 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -108.74 148.89 29.81 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.098 -1.001 . . . . 0.0 110.226 179.759 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.7 tttm -46.6 -32.26 3.36 Favored 'General case' 0 N--CA 1.516 2.864 0 O-C-N 121.392 -0.818 . . . . 0.0 111.495 -179.859 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.29 -51.76 66.38 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.869 -1.145 . . . . 0.0 109.253 179.478 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.809 HD23 HG13 ' A' ' 73' ' ' ILE . 44.8 tp -65.34 -44.16 88.6 Favored 'General case' 0 N--CA 1.505 2.292 0 C-N-CA 119.19 -1.004 . . . . 0.0 108.504 178.812 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.686 ' HA ' HD12 ' A' ' 81' ' ' LEU . 18.0 t80 -59.57 -40.61 87.91 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.397 -0.814 . . . . 0.0 109.36 178.979 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -72.68 -42.95 63.7 Favored 'General case' 0 N--CA 1.504 2.249 0 C-N-CA 119.369 -0.932 . . . . 0.0 108.687 178.603 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.743 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 85.9 t90 -56.86 -35.76 69.25 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.228 -0.92 . . . . 0.0 109.432 178.462 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.686 HD12 ' HA ' ' A' ' 78' ' ' TYR . 13.9 mt -66.89 -59.43 3.53 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.159 -0.963 . . . . 0.0 108.963 178.898 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mt -56.83 -27.02 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.614 0 O-C-N 120.938 -1.101 . . . . 0.0 109.99 179.577 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 6.3 mmtm -82.53 -18.54 41.12 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.793 -1.192 . . . . 0.0 111.105 178.669 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.444 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 72.4 mm-40 -108.72 23.32 14.7 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.731 -1.23 . . . . 0.0 111.968 179.983 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.413 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 2.6 tptp 76.51 71.2 0.07 Allowed 'General case' 0 N--CA 1.514 2.76 0 O-C-N 121.198 -0.939 . . . . 0.0 111.827 179.326 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.625 ' HE2' HD13 ' A' ' 23' ' ' LEU . 26.4 m-85 -133.13 -62.43 0.8 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.45 -0.781 . . . . 0.0 109.202 179.354 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.707 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -131.09 162.38 29.99 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.495 -0.753 . . . . 0.0 109.738 179.736 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.453 ' HB2' ' CE1' ' A' ' 56' ' ' HIS . 9.8 t70 -115.12 112.93 23.31 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.109 -0.995 . . . . 0.0 110.093 179.7 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 11.2 mttt -58.07 -37.17 73.94 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.212 -0.93 . . . . 0.0 110.286 -179.975 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.621 HD23 HD22 ' A' ' 106' ' ' LEU . 11.2 tp -60.61 -37.12 80.37 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.122 -0.986 . . . . 0.0 110.385 -179.734 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.43 HD21 ' CD2' ' A' ' 57' ' ' HIS . 55.2 tp -71.42 -49.11 45.07 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.998 -1.064 . . . . 0.0 108.835 179.343 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.415 ' CG2' ' CE1' ' A' ' 64' ' ' TYR . 51.7 mt -62.02 -38.93 81.99 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.307 0 O-C-N 121.124 -0.985 . . . . 0.0 108.347 178.245 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.32 -37.74 83.8 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.179 -0.95 . . . . 0.0 109.157 178.333 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.415 ' HB3' ' CD2' ' A' ' 103' ' ' LEU . 7.2 mmtm -57.89 -42.42 84.58 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.062 -1.024 . . . . 0.0 109.754 179.469 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.9 m0 -67.01 -31.65 72.35 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.231 -0.918 . . . . 0.0 110.869 -179.778 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.443 ' NH1' ' OH ' ' A' ' 64' ' ' TYR . 0.0 OUTLIER -77.39 -32.62 54.96 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.926 -1.109 . . . . 0.0 110.426 178.89 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 15.6 mmtt -54.98 -176.57 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.677 0 O-C-N 120.935 -1.103 . . . . 0.0 110.367 179.575 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 68.1 m -106.56 139.71 40.58 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.238 -0.914 . . . . 0.0 109.658 179.37 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.99 -22.05 41.98 Favored Glycine 0 N--CA 1.494 2.507 0 C-N-CA 119.83 -1.176 . . . . 0.0 110.735 -179.365 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -92.35 58.17 3.16 Favored 'General case' 0 N--CA 1.504 2.248 0 CA-C-N 119.254 1.527 . . . . 0.0 110.193 179.909 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -78.39 -38.61 41.31 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.076 -1.015 . . . . 0.0 109.865 179.39 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -113.99 79.66 1.28 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.095 -1.003 . . . . 0.0 109.753 179.664 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.953 HD13 HD13 ' A' ' 109' ' ' ILE . 14.3 tp -115.9 137.1 52.41 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.217 -0.927 . . . . 0.0 109.991 -179.49 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.423 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.9 p -108.39 -38.76 5.63 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.262 -0.899 . . . . 0.0 112.025 179.81 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.859 ' O ' HD11 ' A' ' 103' ' ' LEU . 5.4 m -139.29 -170.31 2.86 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 120.36 -1.463 . . . . 0.0 109.718 178.881 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.621 HD22 HD23 ' A' ' 90' ' ' LEU . 12.4 mt -97.88 -35.58 10.45 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 120.896 -1.128 . . . . 0.0 110.84 179.32 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 -102.49 33.69 3.06 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.819 -1.176 . . . . 0.0 109.264 177.819 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.665 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.313 1.7 t -128.48 16.42 6.52 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.186 -0.946 . . . . 0.0 108.988 -179.017 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.953 HD13 HD13 ' A' ' 103' ' ' LEU . 1.3 pt -157.91 35.94 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 120.68 -1.263 . . . . 0.0 111.114 -178.732 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.728 ' C ' HG23 ' A' ' 119' ' ' THR . 6.1 mt-30 . . . . . 0 N--CA 1.501 2.111 0 O-C-N 120.637 -1.29 . . . . 0.0 111.558 -178.743 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.728 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.2 OUTLIER . . . . . 0 N--CA 1.5 2.073 0 CA-C-O 121.105 0.478 . . . . 0.0 110.938 . . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.427 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 46.0 t -113.71 156.53 23.61 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.509 -0.744 . . . . 0.0 109.251 179.466 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.721 HG23 ' CE1' ' A' ' 142' ' ' PHE . 15.4 tt -75.0 -29.88 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.338 0 C-N-CA 119.097 -1.041 . . . . 0.0 111.708 -179.517 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.505 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 12.3 p -55.14 -33.56 63.02 Favored 'General case' 0 N--CA 1.514 2.746 0 O-C-N 120.444 -1.41 . . . . 0.0 109.875 -179.902 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 7.5 tpt180 -59.49 -34.01 72.05 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.042 -1.036 . . . . 0.0 108.698 176.885 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.3 t -68.7 116.55 41.9 Favored Pre-proline 0 N--CA 1.507 2.389 0 O-C-N 121.147 -0.971 . . . . 0.0 109.801 179.271 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -66.11 179.48 1.89 Allowed 'Trans proline' 0 N--CA 1.488 1.189 0 O-C-N 123.015 1.008 . . . . 0.0 110.597 179.1 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.9 tpt180 -75.1 -40.26 60.08 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.259 -0.901 . . . . 0.0 110.154 179.979 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.96 -41.4 91.85 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.141 -0.975 . . . . 0.0 109.945 -179.929 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -63.72 -40.82 97.7 Favored 'General case' 0 N--CA 1.507 2.394 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.724 179.761 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.449 HD22 HG21 ' A' ' 140' ' ' VAL . 12.3 mt -62.19 -40.92 97.67 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.174 -0.954 . . . . 0.0 109.696 179.665 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -57.71 -37.52 73.67 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.132 -0.98 . . . . 0.0 110.219 179.853 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -58.21 -37.49 74.92 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.045 -1.034 . . . . 0.0 110.42 179.86 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -68.37 -40.08 81.55 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.204 -0.935 . . . . 0.0 109.848 179.798 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.59 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -68.09 -38.24 82.12 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.112 -0.993 . . . . 0.0 109.968 179.59 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 29.9 mtp85 -68.07 -32.03 72.07 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.107 -0.996 . . . . 0.0 110.586 179.59 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 4.3 mtmp? -79.62 -31.19 41.63 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 120.99 -1.069 . . . . 0.0 110.992 -179.934 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 2.6 mmtt -100.57 22.94 11.04 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 120.884 -1.135 . . . . 0.0 111.761 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.08 46.92 42.03 Favored Glycine 0 N--CA 1.501 2.969 0 O-C-N 120.745 -1.222 . . . . 0.0 110.998 179.201 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.59 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.7 t -146.46 -167.65 2.8 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.095 -1.239 . . . . 0.0 110.5 179.855 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -123.61 171.11 9.79 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.304 -0.872 . . . . 0.0 110.357 -179.913 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.449 HG21 HD22 ' A' ' 129' ' ' LEU . 9.1 p -157.99 161.0 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 O-C-N 121.359 -0.838 . . . . 0.0 110.672 -179.926 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 29.4 t -169.9 100.99 0.3 Allowed 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.137 -0.977 . . . . 0.0 111.074 179.859 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.721 ' CE1' HG23 ' A' ' 121' ' ' ILE . 87.8 t80 -97.85 156.72 16.46 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.231 -0.918 . . . . 0.0 110.203 179.643 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 20.3 m80 -136.23 -61.74 0.69 Allowed 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.782 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -145.84 147.67 32.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.563 -0.711 . . . . 0.0 109.373 178.896 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . 0.436 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 29.5 p -88.33 157.04 18.85 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.074 -1.016 . . . . 0.0 111.152 -179.344 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.2 p -74.91 -24.1 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.403 0 O-C-N 121.319 -0.863 . . . . 0.0 111.753 -179.488 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -52.73 -44.89 66.7 Favored 'General case' 0 N--CA 1.516 2.836 0 O-C-N 120.715 -1.241 . . . . 0.0 109.274 179.559 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.501 ' HB2' ' CE ' ' A' ' 53' ' ' MET . 29.4 p -142.66 -178.89 6.0 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 121.451 -0.78 . . . . 0.0 110.564 179.619 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . 0.413 ' CA ' ' CE3' ' A' ' 50' ' ' TRP . . . -92.43 61.71 2.45 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 107.526 -2.23 . . . . 0.0 107.526 178.035 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 15.9 t -100.66 138.49 37.65 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.366 -1.079 . . . . 0.0 109.336 -179.053 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -93.27 56.43 2.48 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.163 -0.961 . . . . 0.0 109.648 179.468 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 63.17 96.71 0.01 OUTLIER Glycine 0 N--CA 1.487 2.041 0 N-CA-C 110.055 -1.218 . . . . 0.0 110.055 179.71 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 28.7 p -104.82 118.55 36.84 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.282 -1.128 . . . . 0.0 110.128 179.291 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -118.97 136.16 54.24 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.758 -1.214 . . . . 0.0 110.099 -179.433 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.492 1.635 0 O-C-N 121.269 -0.894 . . . . 0.0 110.285 -179.969 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.692 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.5 2.036 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.4 ' HG2' HD13 ' A' ' 77' ' ' LEU . 44.5 Cg_endo -69.97 160.0 51.24 Favored 'Trans proline' 0 C--N 1.316 -1.166 0 O-C-N 123.353 1.186 . . . . 0.0 110.95 -179.727 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -48.96 -31.92 8.23 Favored 'General case' 0 N--CA 1.515 2.804 0 O-C-N 121.411 -0.805 . . . . 0.0 111.254 -179.821 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.94 -32.81 35.04 Favored Glycine 0 N--CA 1.498 2.819 0 O-C-N 120.997 -1.064 . . . . 0.0 110.711 179.782 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -55.24 -33.64 63.31 Favored 'General case' 0 N--CA 1.511 2.596 0 O-C-N 120.876 -1.367 . . . . 0.0 110.709 179.861 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -54.09 -37.17 63.97 Favored 'General case' 0 N--CA 1.512 2.639 0 O-C-N 121.048 -1.033 . . . . 0.0 110.313 179.772 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.5 mttt -58.58 -36.44 73.97 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.234 -0.917 . . . . 0.0 110.279 179.592 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.875 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.3 pt -116.5 36.73 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.066 -1.022 . . . . 0.0 110.524 179.747 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.427 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -83.75 -44.3 0.8 Allowed Pre-proline 0 N--CA 1.509 2.507 0 O-C-N 121.119 -0.988 . . . . 0.0 113.161 -179.087 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.0 Cg_endo -75.97 -36.36 2.05 Favored 'Trans proline' 0 N--CA 1.486 1.069 0 O-C-N 122.606 0.792 . . . . 0.0 111.872 -178.016 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.809 HG21 ' CE2' ' A' ' 62' ' ' TYR . 89.9 m -59.51 -41.35 89.71 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 120.926 -1.109 . . . . 0.0 110.044 -179.691 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.875 HD12 ' O ' ' A' ' 19' ' ' ILE . 4.9 mt -66.34 -40.85 90.11 Favored 'General case' 0 N--CA 1.508 2.428 0 C-N-CA 119.351 -0.94 . . . . 0.0 109.364 179.318 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.08 -34.9 70.64 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.214 -0.929 . . . . 0.0 110.221 179.4 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -56.84 -36.53 70.12 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 121.069 -1.019 . . . . 0.0 110.327 179.691 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.598 ' CD1' HD22 ' A' ' 55' ' ' LEU . 11.3 m-85 -57.84 -38.35 75.48 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.117 -0.989 . . . . 0.0 110.527 179.882 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -58.54 -34.7 71.3 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.156 -0.965 . . . . 0.0 110.648 -179.875 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.2 mp -70.14 -40.73 78.59 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.117 -0.989 . . . . 0.0 108.823 179.409 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 26.1 tp60 -69.06 -47.14 66.06 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.306 -0.958 . . . . 0.0 108.769 178.794 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.018 HD11 HG23 ' A' ' 52' ' ' ILE . 2.3 tp -60.52 -36.84 79.37 Favored 'General case' 0 N--CA 1.509 2.501 0 C-N-CA 119.401 -0.92 . . . . 0.0 109.525 178.759 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.1 -37.46 71.96 Favored 'General case' 0 N--CA 1.51 2.525 0 O-C-N 121.093 -1.004 . . . . 0.0 110.326 179.788 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -63.36 -50.36 70.23 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.194 -1.002 . . . . 0.0 109.662 -179.777 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.482 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -68.69 -40.36 80.11 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 119.058 -1.057 . . . . 0.0 109.057 178.944 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -60.94 -33.2 72.81 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.285 -0.884 . . . . 0.0 110.223 179.396 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.2 mmmt -93.83 -36.84 12.05 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.063 -1.023 . . . . 0.0 110.709 179.924 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.5 t70 . . . . . 0 N--CA 1.511 2.583 0 O-C-N 121.097 -1.002 . . . . 0.0 110.451 -179.945 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.494 1.762 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.3 m-80 -57.6 -40.0 78.11 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.239 -0.913 . . . . 0.0 109.752 179.611 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -60.81 -37.61 82.58 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.273 -0.892 . . . . 0.0 109.906 179.421 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.4 ' CG ' ' HA ' ' A' ' 33' ' ' ALA . 38.0 tp60 -60.15 -44.05 95.27 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 121.137 -0.977 . . . . 0.0 109.912 179.881 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 83.3 mt -60.19 -38.04 82.07 Favored 'General case' 0 N--CA 1.509 2.505 0 C-N-CA 119.368 -0.933 . . . . 0.0 109.98 179.731 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.505 ' O ' ' HE3' ' A' ' 53' ' ' MET . 39.6 m0 -58.98 -34.03 71.35 Favored 'General case' 0 N--CA 1.509 2.505 0 C-N-CA 119.338 -0.945 . . . . 0.0 109.469 179.548 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -66.6 -33.47 75.73 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 120.628 -1.295 . . . . 0.0 109.443 178.073 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 1.018 HG23 HD11 ' A' ' 30' ' ' LEU . 16.5 mt -70.47 -55.37 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.234 0 O-C-N 120.971 -1.081 . . . . 0.0 109.49 179.336 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.505 ' HE3' ' O ' ' A' ' 50' ' ' TRP . 0.0 OUTLIER -58.97 -32.2 69.43 Favored 'General case' 0 N--CA 1.509 2.475 0 C-N-CA 118.763 -1.175 . . . . 0.0 109.78 179.212 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -61.09 -40.39 93.55 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.886 -1.134 . . . . 0.0 109.267 178.96 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.598 HD22 ' CD1' ' A' ' 26' ' ' PHE . 30.4 mt -55.0 -31.95 61.41 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.206 -0.934 . . . . 0.0 110.117 179.084 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.446 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 23.6 t60 -58.04 -39.64 78.93 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 120.984 -1.073 . . . . 0.0 110.038 179.645 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.442 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 8.7 m170 -59.58 -47.12 86.8 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.066 -1.022 . . . . 0.0 109.224 179.329 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -62.77 -38.54 91.0 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.299 -0.876 . . . . 0.0 109.176 178.789 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.443 ' HG2' ' CE1' ' A' ' 26' ' ' PHE . 0.7 OUTLIER -62.07 -47.07 86.33 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.193 -0.942 . . . . 0.0 109.555 179.441 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 82.9 p -66.64 -40.31 88.65 Favored 'General case' 0 N--CA 1.501 2.125 0 C-N-CA 119.253 -0.979 . . . . 0.0 109.032 179.142 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -63.74 -37.65 88.16 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.261 -0.976 . . . . 0.0 109.427 178.883 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.809 ' CE2' HG21 ' A' ' 22' ' ' THR . 41.6 t80 -62.18 -52.37 64.07 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.093 -1.004 . . . . 0.0 109.372 179.522 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.841 HD12 ' HB2' ' A' ' 87' ' ' ALA . 81.1 mt -72.27 -38.64 62.41 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.38 0 C-N-CA 119.371 -0.932 . . . . 0.0 109.298 179.274 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.497 ' CD1' ' CD2' ' A' ' 68' ' ' TYR . 68.2 t80 -63.94 -37.49 87.6 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.257 -0.902 . . . . 0.0 109.645 179.001 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 80.0 m -72.06 -37.04 69.74 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 120.949 -1.094 . . . . 0.0 110.811 -179.74 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.573 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.6 pp -82.87 -31.03 28.17 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 120.894 -1.128 . . . . 0.0 112.144 -179.109 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.447 ' HD2' HG23 ' A' ' 73' ' ' ILE . 60.5 t80 -85.95 -33.97 21.0 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 120.674 -1.266 . . . . 0.0 111.663 -179.35 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.497 ' CD2' ' CD1' ' A' ' 64' ' ' TYR . 21.7 m-85 -95.97 -27.07 15.31 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.859 -1.151 . . . . 0.0 112.355 -178.77 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.2 mttt -111.92 -61.2 1.75 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.676 -1.265 . . . . 0.0 111.269 -179.626 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.407 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 0.3 OUTLIER -60.11 -31.79 70.38 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 121.037 -1.04 . . . . 0.0 110.708 -179.532 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.5 mttt 56.63 41.6 28.2 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.803 -1.186 . . . . 0.0 110.177 -179.61 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.25 36.12 3.68 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.411 -0.806 . . . . 0.0 109.882 179.123 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.703 HG13 HD23 ' A' ' 77' ' ' LEU . 14.2 tt -153.77 162.74 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.932 0 O-C-N 121.254 -0.904 . . . . 0.0 109.889 -179.825 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 4.3 m -108.15 146.96 31.96 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.064 -1.022 . . . . 0.0 110.273 179.941 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -46.7 -32.37 3.52 Favored 'General case' 0 N--CA 1.515 2.798 0 O-C-N 121.34 -0.85 . . . . 0.0 111.457 -179.938 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -61.69 -50.19 73.45 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.034 -1.041 . . . . 0.0 109.285 179.488 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.703 HD23 HG13 ' A' ' 73' ' ' ILE . 31.7 tp -67.51 -43.64 80.37 Favored 'General case' 0 N--CA 1.504 2.253 0 C-N-CA 119.091 -1.044 . . . . 0.0 108.505 178.774 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.44 ' CE1' HG22 ' A' ' 63' ' ' ILE . 13.3 t80 -60.58 -38.24 83.96 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.3 -0.875 . . . . 0.0 109.501 179.201 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.468 ' O ' HG22 ' A' ' 82' ' ' ILE . 13.6 t0 -76.17 -41.72 48.79 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.08 -1.013 . . . . 0.0 108.829 178.813 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.692 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 84.9 t90 -59.2 -38.99 81.23 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.202 -0.937 . . . . 0.0 109.226 178.795 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.509 HD11 ' HG ' ' A' ' 77' ' ' LEU . 16.5 mt -66.33 -55.56 15.37 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.198 -0.939 . . . . 0.0 109.147 179.04 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.62 HD12 ' HB3' ' A' ' 87' ' ' ALA . 0.9 OUTLIER -56.2 -27.24 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.517 0 O-C-N 121.115 -0.99 . . . . 0.0 110.644 -179.788 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.9 mttt -89.08 -20.33 24.47 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 120.917 -1.115 . . . . 0.0 111.54 179.259 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.452 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 10.5 mm-40 -101.53 23.46 11.1 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 120.764 -1.21 . . . . 0.0 111.928 179.985 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.406 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 7.3 ttmm 76.05 70.79 0.08 Allowed 'General case' 0 N--CA 1.512 2.638 0 O-C-N 121.12 -0.987 . . . . 0.0 111.872 179.347 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.503 ' HE2' HD13 ' A' ' 23' ' ' LEU . 30.3 m-85 -133.33 -62.86 0.78 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.454 -0.779 . . . . 0.0 109.075 179.214 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.841 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -128.98 -177.0 4.03 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.496 -0.752 . . . . 0.0 109.216 179.356 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.446 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 5.5 t0 -130.91 108.61 9.95 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.055 -1.028 . . . . 0.0 110.608 -179.849 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.505 ' N ' HD11 ' A' ' 82' ' ' ILE . 3.6 mtpm? -62.97 -38.09 89.72 Favored 'General case' 0 N--CA 1.508 2.425 0 C-N-CA 119.417 -0.913 . . . . 0.0 109.78 179.506 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.858 HD23 HD22 ' A' ' 106' ' ' LEU . 7.1 tp -58.57 -37.95 76.84 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.106 -0.996 . . . . 0.0 110.131 179.936 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.491 ' HA ' HD21 ' A' ' 106' ' ' LEU . 65.4 tp -71.66 -49.08 43.15 Favored 'General case' 0 N--CA 1.506 2.349 0 C-N-CA 119.148 -1.021 . . . . 0.0 108.651 179.043 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.439 HD13 ' CD1' ' A' ' 64' ' ' TYR . 61.5 mt -60.33 -36.15 67.06 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.435 0 C-N-CA 119.389 -0.924 . . . . 0.0 108.764 178.323 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.12 -38.89 75.71 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.084 -1.01 . . . . 0.0 109.01 178.283 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.427 ' HB3' ' CD2' ' A' ' 103' ' ' LEU . 6.0 mmtt -57.44 -41.75 81.07 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.079 -1.013 . . . . 0.0 109.535 179.272 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.5 m0 -68.63 -32.55 72.49 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.248 -0.907 . . . . 0.0 110.54 179.853 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.457 ' NE ' ' OH ' ' A' ' 64' ' ' TYR . 0.1 OUTLIER -82.62 -30.31 29.54 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.952 -1.092 . . . . 0.0 110.611 179.226 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.7 mmtp -54.16 -176.55 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.613 0 O-C-N 120.991 -1.068 . . . . 0.0 110.552 179.798 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -105.44 134.0 49.26 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.203 -0.935 . . . . 0.0 109.736 179.314 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.12 5.5 56.17 Favored Glycine 0 N--CA 1.493 2.456 0 C-N-CA 120.113 -1.041 . . . . 0.0 111.28 -179.54 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.412 ' CZ ' ' HD2' ' A' ' 94' ' ' LYS . 48.4 m-85 -112.83 49.86 0.91 Allowed 'General case' 0 N--CA 1.497 1.922 0 CA-C-N 119.594 1.697 . . . . 0.0 110.036 179.752 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -65.15 -39.85 93.56 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.062 -1.023 . . . . 0.0 110.027 -179.962 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.56 108.44 15.98 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.172 -0.955 . . . . 0.0 110.131 179.942 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.923 HD13 HD13 ' A' ' 109' ' ' ILE . 14.1 tp -143.65 136.09 27.05 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.187 -0.946 . . . . 0.0 110.037 -179.699 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.442 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.6 p -110.53 -38.61 5.15 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.322 -0.861 . . . . 0.0 112.093 179.876 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.853 ' O ' HD11 ' A' ' 103' ' ' LEU . 4.6 m -138.72 -171.6 3.11 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 120.333 -1.479 . . . . 0.0 109.405 178.817 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.858 HD22 HD23 ' A' ' 90' ' ' LEU . 12.5 mt -96.59 -35.51 11.04 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.982 -1.074 . . . . 0.0 110.586 179.401 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 12.0 ttt85 -102.51 33.59 3.1 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 120.899 -1.125 . . . . 0.0 109.19 177.919 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.678 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.303 1.7 t -128.98 17.74 6.15 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.283 -0.886 . . . . 0.0 109.256 -179.109 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.923 HD13 HD13 ' A' ' 103' ' ' LEU . 1.2 pt -158.57 38.39 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 O-C-N 120.897 -1.127 . . . . 0.0 110.369 -178.905 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.632 ' C ' HG23 ' A' ' 119' ' ' THR . 19.9 mt-30 . . . . . 0 N--CA 1.508 2.464 0 O-C-N 120.835 -1.165 . . . . 0.0 110.718 -179.14 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.632 HG23 ' C ' ' A' ' 110' ' ' GLN . 2.9 m . . . . . 0 N--CA 1.497 1.887 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.45 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 46.7 t -100.8 155.16 18.08 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.301 -0.875 . . . . 0.0 109.365 179.151 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.798 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -73.03 -36.26 50.5 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.324 0 O-C-N 121.105 -0.997 . . . . 0.0 110.853 -179.539 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.426 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 5.1 p -54.72 -33.03 60.5 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 120.773 -1.204 . . . . 0.0 110.989 -178.928 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -60.13 -36.64 77.93 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 120.858 -1.151 . . . . 0.0 109.414 178.368 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 57.1 t -78.53 124.9 85.28 Favored Pre-proline 0 N--CA 1.504 2.233 0 O-C-N 121.213 -0.929 . . . . 0.0 109.702 179.612 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.515 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.1 Cg_endo -64.98 175.06 4.08 Favored 'Trans proline' 0 N--CA 1.488 1.18 0 O-C-N 123.154 1.081 . . . . 0.0 110.712 179.623 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 11.1 tpp85 -75.07 -37.34 61.65 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.249 -0.907 . . . . 0.0 110.615 -179.679 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.05 -40.97 82.29 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 120.93 -1.106 . . . . 0.0 109.997 -179.704 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -68.79 -41.48 78.66 Favored 'General case' 0 N--CA 1.506 2.368 0 C-N-CA 119.325 -0.95 . . . . 0.0 109.259 179.252 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.596 HD11 HD11 ' A' ' 121' ' ' ILE . 2.8 mt -64.02 -39.18 93.53 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.295 -0.878 . . . . 0.0 109.633 179.233 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -60.98 -40.04 91.93 Favored 'General case' 0 N--CA 1.508 2.454 0 C-N-CA 119.408 -0.917 . . . . 0.0 109.929 179.765 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.93 -38.38 82.21 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.16 -0.962 . . . . 0.0 110.316 179.958 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -63.99 -43.39 95.84 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.123 -0.985 . . . . 0.0 109.981 179.937 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -64.03 -39.17 93.49 Favored 'General case' 0 N--CA 1.508 2.442 0 C-N-CA 119.373 -0.931 . . . . 0.0 109.943 179.846 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 3.8 ttt85 -68.03 -38.87 83.05 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.128 -0.982 . . . . 0.0 109.975 179.648 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 50.1 mmtt -70.9 -35.34 72.25 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.165 -0.959 . . . . 0.0 110.346 179.655 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 8.6 tttt -82.57 -17.2 45.72 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 120.994 -1.066 . . . . 0.0 111.726 179.714 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 91.5 31.22 9.71 Favored Glycine 0 N--CA 1.494 2.526 0 O-C-N 120.702 -1.249 . . . . 0.0 110.121 -179.744 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.6 t -140.94 -161.48 1.22 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.023 -1.28 . . . . 0.0 109.79 179.677 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -133.73 148.72 51.45 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.123 -0.985 . . . . 0.0 110.179 179.993 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.447 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.9 p -132.64 161.37 41.64 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.211 -0.931 . . . . 0.0 110.326 -179.879 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 31.2 t -166.62 87.87 0.33 Allowed 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.227 -0.921 . . . . 0.0 110.904 179.988 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.788 ' CG ' HD12 ' A' ' 121' ' ' ILE . 53.5 t80 -97.29 160.87 14.08 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.299 -0.875 . . . . 0.0 110.499 -179.823 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 4.5 m80 -137.61 -60.47 0.65 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.553 -0.717 . . . . 0.0 109.075 179.061 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -137.27 149.84 47.39 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.359 -0.838 . . . . 0.0 109.324 178.803 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 26.3 p -92.11 155.31 18.14 Favored 'General case' 0 N--CA 1.505 2.276 0 C-N-CA 119.219 -0.992 . . . . 0.0 110.929 -179.581 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.5 p -73.31 -26.01 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 O-C-N 121.368 -0.833 . . . . 0.0 111.539 -179.489 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -51.0 -45.84 61.31 Favored 'General case' 0 N--CA 1.516 2.849 0 O-C-N 120.784 -1.198 . . . . 0.0 109.736 179.895 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.496 ' HB2' ' CE ' ' A' ' 53' ' ' MET . 29.5 p -142.44 -179.52 6.33 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.341 -0.849 . . . . 0.0 110.766 179.733 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . 0.456 ' CA ' ' CE3' ' A' ' 50' ' ' TRP . . . -90.43 63.1 3.05 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 107.836 -2.106 . . . . 0.0 107.836 178.161 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 27.0 t -105.69 139.37 40.38 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.389 -1.065 . . . . 0.0 109.79 -178.986 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 20.4 mmt85 -92.37 56.9 2.87 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 121.165 -0.959 . . . . 0.0 109.556 179.344 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 60.51 95.22 0.01 OUTLIER Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 -179.852 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 p -103.27 126.88 50.67 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.305 -1.114 . . . . 0.0 110.33 179.693 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -142.19 141.67 32.6 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.153 -0.967 . . . . 0.0 109.919 -179.691 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.5 2.067 0 O-C-N 121.189 -0.944 . . . . 0.0 110.574 -179.952 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.728 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.503 2.188 0 N-CA-C 110.475 -0.195 . . . . 0.0 110.475 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.28 162.5 42.25 Favored 'Trans proline' 0 C--N 1.317 -1.109 0 O-C-N 123.225 1.118 . . . . 0.0 110.794 -179.794 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -48.87 -32.05 8.23 Favored 'General case' 0 N--CA 1.514 2.729 0 O-C-N 121.391 -0.818 . . . . 0.0 111.307 -179.784 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.83 -34.33 44.79 Favored Glycine 0 N--CA 1.499 2.88 0 O-C-N 120.994 -1.066 . . . . 0.0 110.53 179.84 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.441 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 18.0 t80 -55.06 -32.69 62.12 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 120.938 -1.33 . . . . 0.0 110.78 179.873 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -54.65 -37.84 66.19 Favored 'General case' 0 N--CA 1.513 2.69 0 O-C-N 120.933 -1.104 . . . . 0.0 110.21 179.71 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.19 -35.65 71.93 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.29 -0.882 . . . . 0.0 110.252 179.49 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.686 HD12 ' CD1' ' A' ' 23' ' ' LEU . 2.8 pt -115.7 36.05 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 121.068 -1.02 . . . . 0.0 110.563 179.65 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.441 ' HD2' ' CE2' ' A' ' 16' ' ' PHE . 3.5 tptm -82.64 -43.35 0.93 Allowed Pre-proline 0 N--CA 1.508 2.474 0 O-C-N 121.028 -1.045 . . . . 0.0 112.802 -179.506 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.435 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.4 Cg_endo -75.76 -37.66 1.59 Allowed 'Trans proline' 0 N--CA 1.486 1.039 0 O-C-N 122.479 0.726 . . . . 0.0 111.345 -178.393 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.865 HG21 ' CE2' ' A' ' 62' ' ' TYR . 72.4 m -61.39 -42.92 99.5 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.071 -1.018 . . . . 0.0 110.125 -179.788 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.686 ' CD1' HD12 ' A' ' 19' ' ' ILE . 3.1 mt -64.48 -41.2 96.62 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.192 -0.943 . . . . 0.0 109.747 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.11 -34.99 72.66 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.088 -1.008 . . . . 0.0 110.149 179.512 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -58.04 -35.46 71.35 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.067 -1.021 . . . . 0.0 110.22 179.505 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.755 ' CD2' HD12 ' A' ' 55' ' ' LEU . 6.7 m-85 -56.73 -44.17 81.39 Favored 'General case' 0 N--CA 1.513 2.687 0 O-C-N 120.972 -1.08 . . . . 0.0 109.999 179.297 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -57.56 -26.52 61.55 Favored 'General case' 0 N--CA 1.506 2.333 0 C-N-CA 119.317 -0.953 . . . . 0.0 110.527 179.419 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 16.6 mm -65.53 -48.61 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.314 0 O-C-N 120.954 -1.091 . . . . 0.0 109.119 179.426 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -67.39 -51.8 47.64 Favored 'General case' 0 N--CA 1.506 2.336 0 C-N-CA 119.251 -0.98 . . . . 0.0 108.72 179.027 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.807 HD21 HG23 ' A' ' 52' ' ' ILE . 0.1 OUTLIER -58.57 -32.37 68.86 Favored 'General case' 0 N--CA 1.508 2.432 0 C-N-CA 119.439 -0.905 . . . . 0.0 109.608 178.65 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.0 mtt-85 -59.82 -43.25 94.62 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 120.967 -1.083 . . . . 0.0 110.077 179.791 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -61.14 -46.04 92.2 Favored 'General case' 0 N--CA 1.508 2.443 0 C-N-CA 119.281 -0.968 . . . . 0.0 109.735 -179.69 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.504 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -70.26 -42.37 72.23 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 119.311 -0.956 . . . . 0.0 108.994 178.984 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.435 ' HG3' HD23 ' A' ' 30' ' ' LEU . 70.2 mt-30 -61.05 -32.22 71.85 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.28 -0.888 . . . . 0.0 110.158 179.341 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.1 mmmt -91.8 -33.94 14.78 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 120.98 -1.075 . . . . 0.0 110.745 179.894 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.8 t0 . . . . . 0 N--CA 1.512 2.645 0 O-C-N 121.032 -1.042 . . . . 0.0 110.278 -179.997 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 N--CA 1.502 2.164 0 CA-C-O 120.439 0.162 . . . . 0.0 110.632 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -58.17 -40.53 81.7 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.041 -1.037 . . . . 0.0 109.961 179.926 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.412 ' HA ' ' CE3' ' A' ' 50' ' ' TRP . 23.0 mt-10 -67.39 -43.81 80.42 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.166 -0.959 . . . . 0.0 109.268 179.368 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 46.6 tp60 -67.43 -41.17 85.25 Favored 'General case' 0 N--CA 1.505 2.285 0 C-N-CA 119.328 -0.949 . . . . 0.0 109.113 179.095 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.424 HD23 HD12 ' A' ' 52' ' ' ILE . 12.5 mt -60.22 -37.18 79.52 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.236 -0.915 . . . . 0.0 109.713 179.222 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.504 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 51.5 m0 -59.91 -36.03 76.14 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.116 -0.99 . . . . 0.0 109.898 179.474 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.489 ' O ' HD22 ' A' ' 55' ' ' LEU . 5.2 tp10 -62.25 -30.09 70.87 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.037 -1.04 . . . . 0.0 109.986 178.501 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.807 HG23 HD21 ' A' ' 30' ' ' LEU . 63.9 mt -72.25 -58.73 4.42 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.233 0 O-C-N 120.979 -1.076 . . . . 0.0 109.373 179.519 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.6 ptm -57.34 -26.67 61.32 Favored 'General case' 0 N--CA 1.512 2.662 0 C-N-CA 118.298 -1.361 . . . . 0.0 109.814 178.77 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.4 mm-40 -60.6 -36.82 79.51 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 120.753 -1.217 . . . . 0.0 109.314 177.915 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.755 HD12 ' CD2' ' A' ' 26' ' ' PHE . 0.6 OUTLIER -53.0 -34.5 56.53 Favored 'General case' 0 N--CA 1.514 2.771 0 O-C-N 120.981 -1.074 . . . . 0.0 109.522 178.84 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.474 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 33.2 t60 -51.23 -39.04 55.76 Favored 'General case' 0 N--CA 1.511 2.582 0 O-C-N 121.062 -1.024 . . . . 0.0 110.42 179.954 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.529 ' CD2' HD21 ' A' ' 91' ' ' LEU . 6.0 m170 -70.24 -53.21 17.95 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.114 -1.034 . . . . 0.0 109.181 178.945 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.437 ' HB3' ' CE2' ' A' ' 26' ' ' PHE . 35.1 tp60 -60.64 -29.92 69.56 Favored 'General case' 0 N--CA 1.504 2.24 0 C-N-CA 119.395 -0.922 . . . . 0.0 110.119 178.893 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.405 ' HD2' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -74.39 -46.65 38.99 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 120.99 -1.069 . . . . 0.0 109.009 179.163 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 86.8 p -67.05 -37.8 84.7 Favored 'General case' 0 N--CA 1.5 2.046 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.124 178.793 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 7.8 ttm-85 -64.27 -37.96 89.34 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 120.985 -1.072 . . . . 0.0 109.653 179.141 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.865 ' CE2' HG21 ' A' ' 22' ' ' THR . 60.9 t80 -63.4 -50.2 70.8 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.21 -0.931 . . . . 0.0 109.497 179.451 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.901 HD12 ' HB2' ' A' ' 87' ' ' ALA . 80.8 mt -72.82 -40.12 60.21 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.366 0 O-C-N 121.181 -0.949 . . . . 0.0 109.198 179.202 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.471 ' CE1' HG23 ' A' ' 92' ' ' ILE . 46.5 t80 -60.64 -31.19 70.41 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.233 -0.917 . . . . 0.0 109.989 178.878 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 48.6 m -80.87 -36.17 31.68 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.879 -1.138 . . . . 0.0 110.694 -179.904 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.638 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -82.92 -32.71 27.11 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 120.873 -1.142 . . . . 0.0 112.314 -179.078 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.501 ' N ' HD12 ' A' ' 66' ' ' LEU . 77.4 t80 -86.5 -35.75 19.41 Favored 'General case' 0 N--CA 1.511 2.61 0 O-C-N 120.624 -1.297 . . . . 0.0 111.901 -179.281 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -98.36 -21.5 16.58 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.859 -1.15 . . . . 0.0 112.882 -178.324 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.411 ' HE2' ' CD2' ' A' ' 64' ' ' TYR . 0.7 OUTLIER -117.7 -57.99 2.07 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.571 -1.331 . . . . 0.0 111.408 -179.262 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.42 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 1.0 OUTLIER -64.45 -30.81 71.84 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 121.005 -1.059 . . . . 0.0 110.71 -179.83 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp 58.45 43.6 19.34 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.769 -1.207 . . . . 0.0 110.127 -179.708 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.04 38.02 3.48 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.383 -0.823 . . . . 0.0 109.744 179.331 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.771 HG13 HD23 ' A' ' 77' ' ' LEU . 13.9 tt -156.47 162.7 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 O-C-N 121.22 -0.925 . . . . 0.0 110.227 -179.644 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 19.5 p -108.11 146.36 32.76 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.076 -1.015 . . . . 0.0 110.078 179.541 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.8 tttt -45.6 -32.82 2.5 Favored 'General case' 0 N--CA 1.516 2.831 0 O-C-N 121.33 -0.856 . . . . 0.0 111.661 -179.78 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -61.54 -49.98 74.49 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.002 -1.061 . . . . 0.0 109.31 179.535 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.771 HD23 HG13 ' A' ' 73' ' ' ILE . 36.6 tp -67.48 -43.09 81.83 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.19 -1.004 . . . . 0.0 108.538 178.765 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.442 ' HB2' ' CD1' ' A' ' 67' ' ' TYR . 17.8 t80 -60.98 -38.14 84.93 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.343 -0.848 . . . . 0.0 109.333 179.008 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.491 ' O ' HG22 ' A' ' 82' ' ' ILE . 9.9 t70 -75.48 -41.05 56.45 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.076 -1.015 . . . . 0.0 108.963 178.75 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.728 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 88.2 t90 -60.21 -38.37 83.1 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.073 -1.017 . . . . 0.0 109.178 178.758 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.468 HD11 ' HG ' ' A' ' 77' ' ' LEU . 16.1 mt -66.37 -54.8 20.27 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.236 -0.915 . . . . 0.0 109.328 179.072 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.491 HG22 ' O ' ' A' ' 79' ' ' ASP . 0.9 OUTLIER -56.03 -27.21 22.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.47 0 O-C-N 121.114 -0.991 . . . . 0.0 110.71 -179.724 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.75 -20.64 24.51 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.96 -1.088 . . . . 0.0 111.533 179.447 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.437 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 68.0 mm-40 -101.48 23.73 10.68 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 120.678 -1.264 . . . . 0.0 111.886 179.936 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.41 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 3.9 ttmm 75.85 71.76 0.08 Allowed 'General case' 0 N--CA 1.511 2.621 0 O-C-N 121.134 -0.979 . . . . 0.0 111.843 179.324 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.658 ' HE2' HD13 ' A' ' 23' ' ' LEU . 31.9 m-85 -134.42 -62.78 0.74 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.418 -0.801 . . . . 0.0 109.2 179.305 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.901 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -131.42 173.54 10.98 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.427 -0.796 . . . . 0.0 109.46 179.478 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.474 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.0 t70 -127.6 127.55 44.03 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.028 -1.045 . . . . 0.0 110.711 -179.872 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -73.65 -35.73 65.3 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 121.338 -0.851 . . . . 0.0 110.018 179.43 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.771 HD23 HD13 ' A' ' 106' ' ' LEU . 12.9 tp -60.3 -39.32 86.51 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.09 -1.006 . . . . 0.0 110.157 179.981 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.529 HD21 ' CD2' ' A' ' 57' ' ' HIS . 56.3 tp -72.81 -49.78 28.3 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.018 -1.051 . . . . 0.0 108.526 179.039 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.471 HG23 ' CE1' ' A' ' 64' ' ' TYR . 52.2 mt -59.12 -34.91 54.81 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.425 0 C-N-CA 119.189 -1.004 . . . . 0.0 108.783 178.16 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.81 -37.95 76.44 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.01 -1.057 . . . . 0.0 108.885 177.951 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.439 ' HD2' ' CZ ' ' A' ' 100' ' ' TYR . 5.2 mmtt -56.74 -42.49 79.36 Favored 'General case' 0 N--CA 1.51 2.561 0 O-C-N 121.001 -1.062 . . . . 0.0 109.41 179.17 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.3 m0 -66.7 -37.47 84.78 Favored 'General case' 0 N--CA 1.507 2.383 0 C-N-CA 119.404 -0.918 . . . . 0.0 109.824 179.441 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.37 -35.52 71.14 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.167 -0.958 . . . . 0.0 110.233 179.266 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.1 mmtp -54.21 -176.44 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.693 0 O-C-N 121.117 -0.989 . . . . 0.0 110.536 179.919 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.45 139.34 39.53 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.206 -0.934 . . . . 0.0 109.715 179.158 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 93.68 8.8 60.52 Favored Glycine 0 N--CA 1.495 2.574 0 C-N-CA 120.172 -1.013 . . . . 0.0 111.138 -179.436 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.55 ' HB3' HD23 ' A' ' 103' ' ' LEU . 45.0 m-85 -116.7 70.03 0.76 Allowed 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 119.486 1.643 . . . . 0.0 109.839 179.694 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -98.34 -35.83 10.19 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.163 -0.961 . . . . 0.0 111.091 -179.614 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.66 59.49 0.98 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.931 -1.106 . . . . 0.0 111.032 -179.448 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.55 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.2 pp -107.88 152.57 24.24 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.027 -1.046 . . . . 0.0 109.616 179.057 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.44 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.4 p -113.18 -27.04 8.14 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.113 -0.992 . . . . 0.0 113.628 -178.929 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.639 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 10.3 m -144.62 -167.71 2.72 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 120.137 -1.602 . . . . 0.0 109.877 179.18 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.771 HD13 HD23 ' A' ' 90' ' ' LEU . 12.5 mt -95.87 -39.87 9.6 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.091 -1.006 . . . . 0.0 109.915 178.88 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.9 ttm-85 -101.68 29.11 5.09 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.06 -1.025 . . . . 0.0 110.054 178.392 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.639 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.299 1.8 t -126.79 16.33 7.45 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.037 -1.039 . . . . 0.0 109.065 -179.661 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.479 HG23 ' O ' ' A' ' 108' ' ' CYS . 1.0 OUTLIER -159.31 39.31 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 O-C-N 120.969 -1.082 . . . . 0.0 110.184 -178.903 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.736 ' C ' HG23 ' A' ' 119' ' ' THR . 5.9 tt0 . . . . . 0 N--CA 1.503 2.2 0 O-C-N 120.918 -1.114 . . . . 0.0 111.19 -178.784 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.736 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.4 m . . . . . 0 N--CA 1.494 1.773 0 CA-C-O 120.676 0.274 . . . . 0.0 110.279 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.431 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 47.2 t -100.73 155.44 17.9 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.348 -0.845 . . . . 0.0 108.988 178.635 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.72 HG23 ' CE1' ' A' ' 142' ' ' PHE . 14.4 tt -77.8 -29.56 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.441 0 O-C-N 121.078 -1.014 . . . . 0.0 112.099 -179.063 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.487 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 14.1 p -55.05 -34.87 63.92 Favored 'General case' 0 N--CA 1.513 2.688 0 O-C-N 120.586 -1.321 . . . . 0.0 110.382 -179.136 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -27.7 64.01 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.066 -1.021 . . . . 0.0 109.586 177.53 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 49.5 t -73.03 118.75 71.13 Favored Pre-proline 0 N--CA 1.508 2.431 0 O-C-N 120.975 -1.078 . . . . 0.0 110.397 179.845 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.411 ' HB3' ' HB1' ' A' ' 154' ' ' ALA . 37.4 Cg_endo -64.57 171.88 7.59 Favored 'Trans proline' 0 N--CA 1.489 1.234 0 O-C-N 123.053 1.028 . . . . 0.0 110.591 178.646 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.11 -38.44 61.14 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.201 -0.937 . . . . 0.0 110.505 -179.85 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.41 -42.73 92.46 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.115 -0.99 . . . . 0.0 110.082 -179.789 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -64.15 -41.55 97.12 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.214 -0.929 . . . . 0.0 109.551 179.703 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.716 ' O ' HG11 ' A' ' 140' ' ' VAL . 9.4 mt -61.0 -39.76 90.94 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.273 -0.892 . . . . 0.0 109.827 179.662 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -59.32 -39.43 83.08 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.174 -0.954 . . . . 0.0 110.144 -179.929 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.97 -39.02 84.22 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.216 -0.927 . . . . 0.0 110.293 -179.975 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -64.51 -40.41 95.59 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.295 -0.878 . . . . 0.0 110.015 -179.935 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.454 ' HB1' ' HA ' ' A' ' 139' ' ' GLN . . . -67.12 -40.25 86.79 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.128 -0.982 . . . . 0.0 109.914 179.762 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 13.0 ttp85 -67.27 -33.56 75.57 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.166 -0.959 . . . . 0.0 110.403 179.526 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 18.6 mmtp -75.35 -31.6 60.61 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.025 -1.047 . . . . 0.0 111.04 -179.986 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -101.79 23.07 11.87 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 120.896 -1.127 . . . . 0.0 111.845 -179.917 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.84 47.0 48.47 Favored Glycine 0 N--CA 1.5 2.911 0 O-C-N 120.72 -1.238 . . . . 0.0 110.913 179.238 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.445 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 10.1 t -146.07 -162.31 1.49 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.137 -1.214 . . . . 0.0 110.254 179.884 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . 0.454 ' HA ' ' HB1' ' A' ' 133' ' ' ALA . 77.7 mt-30 -132.79 160.61 36.36 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.039 -1.038 . . . . 0.0 110.177 -179.925 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.716 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.8 p -147.56 161.21 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 O-C-N 121.16 -0.962 . . . . 0.0 110.473 -179.794 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 36.1 t -171.62 108.38 0.25 Allowed 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.126 -0.983 . . . . 0.0 111.039 179.727 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.72 ' CE1' HG23 ' A' ' 121' ' ' ILE . 87.0 t80 -104.15 157.07 17.37 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.106 -0.996 . . . . 0.0 110.649 179.906 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.09 -61.9 0.65 Allowed 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 178.662 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -146.43 148.68 32.54 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.54 -0.725 . . . . 0.0 109.164 178.676 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . 0.45 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.4 p -91.68 154.89 18.7 Favored 'General case' 0 N--CA 1.508 2.435 0 C-N-CA 119.011 -1.076 . . . . 0.0 110.983 -179.405 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.4 m -72.6 -25.28 22.48 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.5 0 O-C-N 121.367 -0.833 . . . . 0.0 111.735 -179.362 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -49.74 -59.0 4.22 Favored 'General case' 0 N--CA 1.517 2.88 0 O-C-N 120.879 -1.138 . . . . 0.0 110.219 -179.756 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.504 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.3 p -128.0 -163.91 1.32 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.218 -0.926 . . . . 0.0 110.319 179.356 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . 0.426 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -101.87 64.26 0.48 Allowed Glycine 0 N--CA 1.491 2.307 0 N-CA-C 107.784 -2.126 . . . . 0.0 107.784 178.278 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 27.6 t -98.95 143.9 28.73 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.36 -1.083 . . . . 0.0 109.724 -179.099 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -100.77 44.3 1.02 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.2 -0.937 . . . . 0.0 109.775 179.41 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 77.69 93.93 0.25 Allowed Glycine 0 N--CA 1.485 1.966 0 N-CA-C 109.872 -1.291 . . . . 0.0 109.872 179.897 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.1 p -108.18 129.01 55.2 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.191 -1.182 . . . . 0.0 110.069 179.67 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . 0.411 ' HB1' ' HB3' ' A' ' 125' ' ' PRO . . . -148.36 148.1 29.99 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.187 -0.946 . . . . 0.0 110.245 -179.316 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.495 1.807 0 O-C-N 121.199 -0.938 . . . . 0.0 110.37 179.994 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.784 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.513 2.721 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 . . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -71.91 163.25 39.42 Favored 'Trans proline' 0 C--N 1.318 -1.073 0 O-C-N 123.331 1.174 . . . . 0.0 110.719 -179.889 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -48.36 -32.13 7.09 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.465 -0.772 . . . . 0.0 111.399 -179.784 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.75 -33.35 42.17 Favored Glycine 0 N--CA 1.498 2.802 0 O-C-N 120.994 -1.067 . . . . 0.0 110.59 179.73 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -54.04 -32.43 54.43 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 120.884 -1.363 . . . . 0.0 110.723 179.783 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -54.03 -36.39 62.97 Favored 'General case' 0 N--CA 1.512 2.645 0 O-C-N 121.052 -1.03 . . . . 0.0 110.325 179.682 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.9 mtmt -57.12 -35.14 69.11 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.091 -1.005 . . . . 0.0 110.328 179.507 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.688 ' O ' HD12 ' A' ' 23' ' ' LEU . 3.5 pt -118.21 37.16 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 O-C-N 121.072 -1.018 . . . . 0.0 110.57 179.606 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -82.63 -43.58 0.93 Allowed Pre-proline 0 N--CA 1.508 2.46 0 O-C-N 121.063 -1.023 . . . . 0.0 112.989 -179.545 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.8 Cg_endo -75.44 -38.68 1.32 Allowed 'Trans proline' 0 N--CA 1.486 1.048 0 O-C-N 122.577 0.777 . . . . 0.0 111.529 -178.266 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.864 HG21 ' CE2' ' A' ' 62' ' ' TYR . 89.9 m -58.83 -41.77 87.7 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.025 -1.047 . . . . 0.0 109.808 179.898 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.688 HD12 ' O ' ' A' ' 19' ' ' ILE . 1.5 mt -65.24 -38.72 91.25 Favored 'General case' 0 N--CA 1.506 2.366 0 C-N-CA 119.466 -0.894 . . . . 0.0 109.508 179.216 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.2 m -58.3 -35.71 72.26 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.046 -1.034 . . . . 0.0 110.082 179.314 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -56.55 -34.57 67.22 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.098 -1.001 . . . . 0.0 110.427 179.563 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.726 ' CD2' HD12 ' A' ' 55' ' ' LEU . 8.8 m-85 -57.71 -36.18 71.64 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.088 -1.007 . . . . 0.0 110.432 179.829 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -56.64 -35.61 68.55 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.163 -0.961 . . . . 0.0 110.656 -179.638 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.418 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.1 mp -63.84 -42.17 94.98 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.423 0 O-C-N 120.969 -1.082 . . . . 0.0 108.716 179.372 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -67.69 -57.19 6.81 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 119.133 -1.027 . . . . 0.0 108.298 178.521 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.722 HD12 HD23 ' A' ' 55' ' ' LEU . 1.2 tp -54.74 -33.0 60.58 Favored 'General case' 0 N--CA 1.512 2.632 0 C-N-CA 119.363 -0.935 . . . . 0.0 109.75 178.318 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.05 -36.12 70.13 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.09 -1.006 . . . . 0.0 110.404 179.657 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.68 -52.77 61.99 Favored 'General case' 0 N--CA 1.507 2.381 0 C-N-CA 119.075 -1.05 . . . . 0.0 109.427 179.98 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.612 ' HB1' ' HG2' ' A' ' 48' ' ' GLN . . . -69.39 -42.13 75.54 Favored 'General case' 0 N--CA 1.504 2.236 0 C-N-CA 119.048 -1.061 . . . . 0.0 108.609 178.638 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -61.34 -33.65 73.97 Favored 'General case' 0 N--CA 1.503 2.22 0 C-N-CA 119.525 -0.87 . . . . 0.0 110.069 179.266 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 6.4 mtmt -87.79 -34.48 18.28 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.064 -1.022 . . . . 0.0 110.612 179.754 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 . . . . . 0 N--CA 1.511 2.609 0 O-C-N 120.938 -1.101 . . . . 0.0 110.262 179.692 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.496 1.828 0 CA-C-O 120.694 0.283 . . . . 0.0 110.616 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.446 ' HB3' ' CZ2' ' A' ' 50' ' ' TRP . 74.1 m-80 -56.41 -39.38 72.92 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.124 -0.985 . . . . 0.0 110.014 179.853 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -60.81 -38.55 85.78 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.213 -0.929 . . . . 0.0 109.771 179.482 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.612 ' HG2' ' HB1' ' A' ' 33' ' ' ALA . 4.4 tt0 -57.87 -40.98 81.5 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.077 -1.014 . . . . 0.0 109.894 179.827 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.413 ' HA ' HD23 ' A' ' 49' ' ' LEU . 54.0 mt -75.04 -33.11 61.7 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.256 -0.902 . . . . 0.0 110.502 179.844 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.504 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 45.9 m0 -58.66 -38.85 79.05 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 120.905 -1.122 . . . . 0.0 109.738 179.566 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.45 ' O ' HD22 ' A' ' 55' ' ' LEU . 13.5 mt-10 -66.02 -32.39 73.83 Favored 'General case' 0 N--CA 1.502 2.136 0 C-N-CA 119.035 -1.066 . . . . 0.0 109.371 178.271 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.691 HG23 HD11 ' A' ' 30' ' ' LEU . 4.4 mt -72.44 -55.56 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.214 0 O-C-N 120.981 -1.075 . . . . 0.0 109.7 179.585 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.3 ptm -60.08 -24.36 64.53 Favored 'General case' 0 N--CA 1.509 2.492 0 C-N-CA 118.259 -1.376 . . . . 0.0 110.003 178.883 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -64.98 -35.41 81.08 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 120.756 -1.215 . . . . 0.0 109.76 178.369 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.726 HD12 ' CD2' ' A' ' 26' ' ' PHE . 0.8 OUTLIER -54.62 -35.8 63.8 Favored 'General case' 0 N--CA 1.514 2.73 0 O-C-N 120.846 -1.159 . . . . 0.0 109.834 179.387 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.458 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 26.2 t60 -52.22 -37.15 54.22 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 120.949 -1.095 . . . . 0.0 110.483 -179.746 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.451 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.4 m170 -67.95 -48.53 65.63 Favored 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 119.143 -1.023 . . . . 0.0 109.463 179.494 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -61.81 -37.04 82.93 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 119.286 -0.966 . . . . 0.0 109.594 179.154 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.408 ' HG3' ' CE2' ' A' ' 26' ' ' PHE . 3.0 mtt180 -66.27 -46.48 76.88 Favored 'General case' 0 N--CA 1.508 2.451 0 C-N-CA 119.29 -0.964 . . . . 0.0 109.641 179.364 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.5 p -62.25 -39.53 93.18 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.13 -0.981 . . . . 0.0 109.503 179.526 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 10.7 tpp85 -64.31 -42.61 96.26 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.103 -0.998 . . . . 0.0 109.101 179.307 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.864 ' CE2' HG21 ' A' ' 22' ' ' THR . 59.6 t80 -63.19 -49.04 75.81 Favored 'General case' 0 N--CA 1.507 2.389 0 C-N-CA 119.491 -0.884 . . . . 0.0 109.464 179.422 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.61 HD12 ' HB2' ' A' ' 87' ' ' ALA . 85.2 mt -69.31 -38.74 78.01 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.331 0 C-N-CA 119.305 -0.958 . . . . 0.0 109.238 179.538 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.43 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 9.0 t80 -66.57 -41.7 88.2 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.169 -0.957 . . . . 0.0 108.943 178.978 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.405 ' HA ' ' HD3' ' A' ' 69' ' ' LYS . 86.9 m -60.49 -41.28 93.92 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.126 -0.984 . . . . 0.0 110.366 -179.735 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.593 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.2 -34.8 25.83 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 118.825 -1.15 . . . . 0.0 112.528 -178.978 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.535 ' N ' HD12 ' A' ' 66' ' ' LEU . 32.9 t80 -86.49 -32.59 20.7 Favored 'General case' 0 N--CA 1.513 2.706 0 O-C-N 120.628 -1.295 . . . . 0.0 112.066 -179.184 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.43 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 7.5 m-85 -98.43 -8.84 26.11 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 120.787 -1.196 . . . . 0.0 113.178 -178.524 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.405 ' HD3' ' HA ' ' A' ' 65' ' ' THR . 5.1 mtpm? -127.8 -58.4 1.23 Allowed 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.373 -1.454 . . . . 0.0 110.69 179.693 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.41 ' HB2' ' HA ' ' A' ' 66' ' ' LEU . 67.7 mtp180 -69.84 -28.82 66.01 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.119 -0.988 . . . . 0.0 110.741 -179.802 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.0 ttmt 58.92 43.5 17.91 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.768 -1.207 . . . . 0.0 109.932 -179.451 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.71 34.47 3.96 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.366 -0.834 . . . . 0.0 109.897 179.288 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.708 HG13 HD23 ' A' ' 77' ' ' LEU . 13.9 tt -153.21 162.34 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.144 -0.973 . . . . 0.0 109.856 -179.962 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.6 p -108.61 147.48 31.77 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.103 -0.998 . . . . 0.0 110.128 179.844 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 24.8 ttmt -46.36 -31.7 2.76 Favored 'General case' 0 N--CA 1.514 2.733 0 O-C-N 121.333 -0.854 . . . . 0.0 111.653 -179.978 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -62.2 -51.3 68.33 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.944 -1.097 . . . . 0.0 109.412 179.566 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.708 HD23 HG13 ' A' ' 73' ' ' ILE . 32.4 tp -65.97 -44.36 85.17 Favored 'General case' 0 N--CA 1.504 2.273 0 C-N-CA 119.168 -1.013 . . . . 0.0 108.538 178.902 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 17.0 t80 -60.77 -39.2 87.91 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.369 -0.832 . . . . 0.0 109.344 179.169 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -72.47 -42.04 65.38 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.141 -0.975 . . . . 0.0 108.876 178.771 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.784 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 88.8 t90 -56.28 -36.65 68.86 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 121.195 -0.941 . . . . 0.0 109.734 178.926 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.782 HD22 ' CD2' ' A' ' 86' ' ' TYR . 62.8 mt -70.14 -46.77 64.07 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.177 -0.952 . . . . 0.0 108.897 178.954 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.427 HD13 ' O ' ' A' ' 87' ' ' ALA . 33.3 mm -55.68 -33.02 32.57 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.669 0 O-C-N 121.24 -0.913 . . . . 0.0 109.83 179.261 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.34 -15.11 34.14 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 120.99 -1.069 . . . . 0.0 112.261 -179.909 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.453 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 64.3 mm-40 -104.94 23.15 14.01 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 120.475 -1.391 . . . . 0.0 112.165 -179.609 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.4 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 7.5 tttt 75.99 68.42 0.07 Allowed 'General case' 0 N--CA 1.511 2.62 0 O-C-N 121.051 -1.031 . . . . 0.0 112.028 179.277 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.782 ' CD2' HD22 ' A' ' 81' ' ' LEU . 31.4 m-85 -131.87 -63.35 0.82 Allowed 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 178.784 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.61 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -137.41 162.07 34.62 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.482 -0.761 . . . . 0.0 109.07 178.914 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.458 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 21.8 t0 -113.71 117.07 30.5 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.084 -1.01 . . . . 0.0 110.403 -179.804 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 6.1 mtpt -58.51 -38.76 78.37 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.206 -0.934 . . . . 0.0 109.86 179.742 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 47.4 tp -59.65 -40.22 87.01 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.101 -0.999 . . . . 0.0 109.756 179.629 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.747 ' HA ' HD21 ' A' ' 106' ' ' LEU . 66.1 tp -67.09 -52.45 41.88 Favored 'General case' 0 N--CA 1.508 2.426 0 C-N-CA 119.271 -0.972 . . . . 0.0 108.643 179.227 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 54.6 mt -58.6 -32.53 46.29 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.396 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.103 178.409 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.48 -42.86 78.06 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.046 -1.034 . . . . 0.0 109.521 178.833 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.458 ' HD3' HD23 ' A' ' 106' ' ' LEU . 7.5 mttp -59.6 -41.22 89.82 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.119 -0.988 . . . . 0.0 110.14 179.465 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.3 m0 -65.1 -39.49 93.22 Favored 'General case' 0 N--CA 1.508 2.469 0 C-N-CA 119.125 -1.03 . . . . 0.0 109.836 179.569 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 3.2 mtp85 -75.95 -29.93 58.47 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.268 -0.895 . . . . 0.0 110.566 179.304 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.5 mmtm -54.18 -176.49 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.652 0 O-C-N 120.86 -1.15 . . . . 0.0 110.589 179.771 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 53.7 m -105.07 131.57 52.4 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.166 -0.959 . . . . 0.0 109.772 179.296 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.35 8.33 50.11 Favored Glycine 0 N--CA 1.493 2.489 0 C-N-CA 120.196 -1.002 . . . . 0.0 111.109 -179.449 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -114.75 68.17 0.7 Allowed 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 119.499 1.65 . . . . 0.0 109.946 179.672 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -84.54 -38.53 19.89 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.079 -1.013 . . . . 0.0 109.983 179.787 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.82 90.34 3.31 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.126 -0.984 . . . . 0.0 109.969 179.842 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.927 HD13 HD13 ' A' ' 109' ' ' ILE . 9.9 tp -126.99 134.68 50.31 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.279 -0.888 . . . . 0.0 109.664 -179.647 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.451 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.3 p -108.76 -37.93 5.76 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.201 -0.937 . . . . 0.0 112.356 -179.791 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.828 ' O ' HD11 ' A' ' 103' ' ' LEU . 7.5 m -139.92 -167.93 2.4 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.22 -1.55 . . . . 0.0 109.877 178.905 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.747 HD21 ' HA ' ' A' ' 91' ' ' LEU . 17.3 mt -98.22 -37.76 9.56 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.132 -0.98 . . . . 0.0 110.674 179.493 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 30.8 ttm-85 -102.52 33.33 3.2 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.949 -1.095 . . . . 0.0 109.311 178.055 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.66 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.312 1.7 t -128.61 17.12 6.41 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.322 -0.861 . . . . 0.0 108.838 -179.06 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.927 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -159.1 38.54 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 120.814 -1.179 . . . . 0.0 110.434 -178.904 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.779 ' C ' HG23 ' A' ' 119' ' ' THR . 12.7 mm-40 . . . . . 0 N--CA 1.503 2.194 0 O-C-N 120.74 -1.225 . . . . 0.0 110.913 -178.769 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.779 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.731 0 CA-C-O 120.883 0.373 . . . . 0.0 110.527 . . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.439 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 43.3 t -108.02 155.31 20.5 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.436 -0.79 . . . . 0.0 108.922 178.727 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.794 HD12 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -70.62 -37.15 68.48 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.425 0 O-C-N 121.027 -1.045 . . . . 0.0 110.633 -179.404 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.449 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 6.7 p -55.36 -33.6 63.56 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 120.818 -1.176 . . . . 0.0 110.752 -179.29 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.505 ' HG2' HG22 ' A' ' 109' ' ' ILE . 0.0 OUTLIER -58.92 -33.46 70.59 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 120.924 -1.11 . . . . 0.0 109.71 178.325 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 62.0 t -81.17 125.22 79.96 Favored Pre-proline 0 N--CA 1.504 2.269 0 O-C-N 121.163 -0.961 . . . . 0.0 109.725 179.688 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -65.73 170.26 11.63 Favored 'Trans proline' 0 N--CA 1.487 1.111 0 O-C-N 123.119 1.062 . . . . 0.0 110.659 179.582 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 5.9 tpt180 -75.12 -36.42 61.64 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.303 -0.873 . . . . 0.0 110.721 -179.753 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.76 -41.4 81.87 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 120.963 -1.085 . . . . 0.0 110.093 -179.8 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -68.33 -41.34 80.94 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.215 -0.928 . . . . 0.0 109.232 179.275 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.408 HD22 HG21 ' A' ' 140' ' ' VAL . 2.7 mt -63.63 -39.28 93.95 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.249 -0.907 . . . . 0.0 109.676 179.308 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -59.31 -39.66 83.76 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.13 -0.981 . . . . 0.0 109.924 179.716 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -59.88 -37.9 80.68 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.1 -1.0 . . . . 0.0 110.127 179.724 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -61.81 -46.43 89.55 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.178 -0.952 . . . . 0.0 109.869 179.904 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.544 ' HB1' ' HA ' ' A' ' 139' ' ' GLN . . . -61.07 -40.98 95.73 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.218 -0.926 . . . . 0.0 109.906 -179.998 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 19.9 ttt85 -64.98 -30.96 71.99 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.185 -0.947 . . . . 0.0 110.689 179.798 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.43 -29.03 23.16 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 120.95 -1.094 . . . . 0.0 111.361 -179.811 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 23.6 mttt -98.6 24.12 7.84 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 120.783 -1.198 . . . . 0.0 111.724 -179.909 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.16 46.74 42.73 Favored Glycine 0 N--CA 1.5 2.952 0 O-C-N 120.771 -1.205 . . . . 0.0 111.077 179.26 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.483 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 9.7 t -148.93 -164.18 1.96 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.069 -1.253 . . . . 0.0 110.533 179.846 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . 0.544 ' HA ' ' HB1' ' A' ' 133' ' ' ALA . 53.5 mt-30 -139.52 149.7 44.24 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.224 -0.923 . . . . 0.0 110.302 -179.867 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.408 HG21 HD22 ' A' ' 129' ' ' LEU . 7.4 p -132.66 161.0 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 O-C-N 121.221 -0.924 . . . . 0.0 110.2 -179.979 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 41.0 t -168.19 85.6 0.2 Allowed 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.167 -0.958 . . . . 0.0 111.099 -179.963 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.794 ' CG ' HD12 ' A' ' 121' ' ' ILE . 50.5 t80 -99.38 160.48 14.25 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.261 -0.899 . . . . 0.0 110.486 -179.926 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 -137.06 -61.29 0.66 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.509 -0.744 . . . . 0.0 109.02 178.967 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -134.69 152.04 51.47 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.428 -0.795 . . . . 0.0 108.95 178.669 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 31.5 p -92.85 152.77 19.23 Favored 'General case' 0 N--CA 1.504 2.267 0 C-N-CA 119.028 -1.069 . . . . 0.0 111.085 -179.552 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.9 m -70.61 -26.38 28.35 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.407 0 O-C-N 121.427 -0.795 . . . . 0.0 111.307 -179.522 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -50.49 -58.49 5.65 Favored 'General case' 0 N--CA 1.516 2.841 0 O-C-N 120.855 -1.153 . . . . 0.0 110.213 -179.993 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.504 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 26.0 p -127.59 -166.71 1.64 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.261 -0.899 . . . . 0.0 110.566 179.656 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . 0.44 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.06 57.66 0.8 Allowed Glycine 0 N--CA 1.493 2.442 0 N-CA-C 107.958 -2.057 . . . . 0.0 107.958 178.405 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 19.3 t -101.67 142.61 32.75 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.318 -1.107 . . . . 0.0 109.784 -179.305 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 57.5 mtp85 -95.9 52.45 1.32 Allowed 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.273 -0.892 . . . . 0.0 109.736 179.353 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.89 98.41 0.03 OUTLIER Glycine 0 N--CA 1.488 2.123 0 N-CA-C 109.866 -1.293 . . . . 0.0 109.866 179.956 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 22.6 p -110.44 131.08 55.36 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.266 -1.138 . . . . 0.0 110.356 179.552 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -142.32 141.38 32.37 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.096 -1.003 . . . . 0.0 110.038 -179.802 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.498 1.934 0 O-C-N 121.258 -0.901 . . . . 0.0 110.223 179.972 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.801 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.498 1.966 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 . . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -69.67 164.79 33.12 Favored 'Trans proline' 0 C--N 1.316 -1.134 0 O-C-N 123.377 1.199 . . . . 0.0 110.869 -179.682 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -47.66 -32.48 5.71 Favored 'General case' 0 N--CA 1.516 2.844 0 O-C-N 121.435 -0.791 . . . . 0.0 111.493 -179.743 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.61 -35.39 51.78 Favored Glycine 0 N--CA 1.498 2.812 0 N-CA-C 110.373 -1.091 . . . . 0.0 110.373 179.771 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.46 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 24.3 t80 -55.75 -33.58 64.42 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 120.948 -1.324 . . . . 0.0 110.681 179.713 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -54.99 -38.45 67.87 Favored 'General case' 0 N--CA 1.513 2.676 0 O-C-N 120.993 -1.067 . . . . 0.0 110.106 179.807 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.2 mmtm -58.81 -35.52 73.0 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.359 -0.838 . . . . 0.0 110.192 179.44 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.662 ' O ' HD12 ' A' ' 23' ' ' LEU . 3.2 pt -116.73 36.13 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.135 -0.978 . . . . 0.0 110.616 179.732 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 3.5 tmtt? -82.53 -43.38 0.95 Allowed Pre-proline 0 N--CA 1.509 2.484 0 O-C-N 121.003 -1.06 . . . . 0.0 112.941 -179.43 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 48.8 Cg_endo -76.95 -36.58 1.4 Allowed 'Trans proline' 0 N--CA 1.486 1.08 0 O-C-N 122.639 0.81 . . . . 0.0 111.527 -178.561 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.978 HG21 ' CE2' ' A' ' 62' ' ' TYR . 91.1 m -59.37 -43.45 92.87 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 120.932 -1.105 . . . . 0.0 110.083 -179.664 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.662 HD12 ' O ' ' A' ' 19' ' ' ILE . 1.0 OUTLIER -61.26 -36.33 79.7 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.263 -0.898 . . . . 0.0 110.021 179.642 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.45 -36.52 73.81 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 120.92 -1.112 . . . . 0.0 110.176 179.472 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -58.1 -34.31 70.06 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.049 -1.032 . . . . 0.0 110.379 179.601 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.769 ' CD2' HD12 ' A' ' 55' ' ' LEU . 8.8 m-85 -56.65 -42.49 79.01 Favored 'General case' 0 N--CA 1.512 2.65 0 O-C-N 120.911 -1.118 . . . . 0.0 110.008 179.54 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -57.81 -26.53 62.11 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.367 -0.933 . . . . 0.0 110.453 179.274 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 13.1 mm -67.12 -51.08 57.62 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.291 0 O-C-N 120.945 -1.097 . . . . 0.0 108.485 179.225 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.4 tp60 -64.23 -52.02 60.8 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.227 -0.92 . . . . 0.0 108.546 178.852 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.729 HD12 HD23 ' A' ' 55' ' ' LEU . 1.1 tp -57.03 -36.89 71.0 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.24 -0.913 . . . . 0.0 109.64 178.905 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -57.38 -37.62 72.95 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.084 -1.01 . . . . 0.0 110.123 179.784 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.61 -50.14 72.45 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.11 -0.993 . . . . 0.0 109.517 179.803 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.484 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -68.14 -42.86 79.49 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 119.016 -1.074 . . . . 0.0 108.89 178.96 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -61.3 -32.11 71.96 Favored 'General case' 0 N--CA 1.504 2.266 0 C-N-CA 119.576 -0.849 . . . . 0.0 110.213 179.374 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.5 mmpt? -96.28 -20.46 18.51 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 120.975 -1.078 . . . . 0.0 111.71 -179.96 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 20.4 t0 . . . . . 0 N--CA 1.513 2.681 0 O-C-N 120.672 -1.268 . . . . 0.0 110.534 -179.966 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 63.2 m . . . . . 0 N--CA 1.498 1.931 0 CA-C-O 120.629 0.252 . . . . 0.0 110.482 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.408 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 18.0 m120 -57.29 -40.96 78.87 Favored 'General case' 0 N--CA 1.51 2.561 0 O-C-N 121.205 -0.934 . . . . 0.0 109.844 179.838 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -59.94 -38.67 83.09 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.219 -0.926 . . . . 0.0 109.941 179.62 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.437 ' HG2' ' HB1' ' A' ' 33' ' ' ALA . 0.5 OUTLIER -59.47 -40.23 86.25 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.17 -0.956 . . . . 0.0 110.265 179.985 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 91.4 mt -74.8 -31.69 61.79 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.227 -0.921 . . . . 0.0 110.716 -179.929 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.486 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 40.2 m0 -57.98 -39.69 78.81 Favored 'General case' 0 N--CA 1.512 2.67 0 O-C-N 120.842 -1.161 . . . . 0.0 109.245 179.134 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.0 -34.74 78.4 Favored 'General case' 0 N--CA 1.499 1.985 0 C-N-CA 119.046 -1.062 . . . . 0.0 108.807 177.626 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.693 HG23 HD11 ' A' ' 30' ' ' LEU . 5.1 mt -71.74 -56.75 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.175 0 O-C-N 121.114 -0.991 . . . . 0.0 109.358 179.106 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.554 ' HE1' ' O ' ' A' ' 147' ' ' HIS . 0.3 OUTLIER -58.22 -25.88 62.18 Favored 'General case' 0 N--CA 1.512 2.633 0 C-N-CA 118.208 -1.397 . . . . 0.0 109.884 178.72 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.5 mt-30 -62.17 -37.14 84.11 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.874 -1.141 . . . . 0.0 109.376 178.165 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.769 HD12 ' CD2' ' A' ' 26' ' ' PHE . 1.0 OUTLIER -53.76 -35.67 61.52 Favored 'General case' 0 N--CA 1.513 2.683 0 O-C-N 120.933 -1.105 . . . . 0.0 109.73 179.099 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.466 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 33.5 t60 -51.51 -36.86 46.49 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.039 -1.038 . . . . 0.0 110.449 179.975 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.453 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 15.3 m170 -71.2 -46.77 60.54 Favored 'General case' 0 N--CA 1.505 2.29 0 C-N-CA 119.225 -0.99 . . . . 0.0 109.088 179.222 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.428 ' HB3' ' CE2' ' A' ' 26' ' ' PHE . 5.6 tt0 -63.2 -35.4 80.18 Favored 'General case' 0 N--CA 1.505 2.284 0 C-N-CA 119.249 -0.98 . . . . 0.0 109.41 178.696 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.46 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -68.26 -48.91 63.79 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.138 -0.976 . . . . 0.0 109.292 179.259 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.4 p -63.86 -38.53 91.43 Favored 'General case' 0 N--CA 1.503 2.198 0 C-N-CA 119.356 -0.938 . . . . 0.0 109.231 179.161 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.407 ' O ' ' OG1' ' A' ' 65' ' ' THR . 5.1 ttt-85 -65.73 -42.04 91.52 Favored 'General case' 0 N--CA 1.504 2.275 0 C-N-CA 119.246 -0.982 . . . . 0.0 109.106 179.125 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.978 ' CE2' HG21 ' A' ' 22' ' ' THR . 54.4 t80 -62.8 -48.75 77.75 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.189 -0.944 . . . . 0.0 109.357 179.377 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.677 HD12 ' HB2' ' A' ' 87' ' ' ALA . 89.6 mt -71.02 -39.94 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.328 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.245 179.574 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.424 ' HD2' HD13 ' A' ' 92' ' ' ILE . 10.3 t80 -65.3 -42.12 93.37 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.245 -0.91 . . . . 0.0 108.839 179.027 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.419 HG23 ' HD2' ' A' ' 69' ' ' LYS . 92.0 m -61.27 -41.83 97.6 Favored 'General case' 0 N--CA 1.502 2.135 0 C-N-CA 119.283 -0.967 . . . . 0.0 110.54 -179.614 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.537 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.6 pp -83.09 -32.35 26.82 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 118.811 -1.156 . . . . 0.0 112.323 -178.944 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.426 ' CD2' HG23 ' A' ' 73' ' ' ILE . 31.1 t80 -86.44 -32.53 20.81 Favored 'General case' 0 N--CA 1.511 2.591 0 O-C-N 120.708 -1.245 . . . . 0.0 111.781 -179.454 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.402 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 8.3 m-85 -98.42 -25.38 14.82 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 120.716 -1.24 . . . . 0.0 112.525 -178.661 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.419 ' HD2' HG23 ' A' ' 65' ' ' THR . 63.3 mttt -108.55 -57.52 2.12 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.596 -1.315 . . . . 0.0 110.717 179.968 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.467 HH11 ' HB2' ' A' ' 72' ' ' ALA . 28.4 ttt-85 -72.92 -30.22 63.73 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.242 -0.911 . . . . 0.0 111.009 -179.388 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.5 mttp 56.62 42.39 27.14 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.743 -1.223 . . . . 0.0 110.041 -179.468 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.467 ' HB2' HH11 ' A' ' 70' ' ' ARG . . . -108.84 34.18 3.83 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.423 -0.798 . . . . 0.0 109.845 179.119 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.737 HG13 HD23 ' A' ' 77' ' ' LEU . 13.9 tt -149.21 162.84 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.17 -0.956 . . . . 0.0 109.58 -179.938 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 62.0 m -107.44 144.24 34.64 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.013 -1.054 . . . . 0.0 110.378 179.972 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -45.24 -32.71 2.03 Favored 'General case' 0 N--CA 1.515 2.805 0 O-C-N 121.353 -0.842 . . . . 0.0 111.562 179.988 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -61.82 -51.09 69.66 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 120.908 -1.12 . . . . 0.0 109.19 179.329 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.737 HD23 HG13 ' A' ' 73' ' ' ILE . 37.2 tp -66.13 -43.85 85.91 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.186 -1.006 . . . . 0.0 108.322 178.637 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.683 ' HA ' HD12 ' A' ' 81' ' ' LEU . 15.5 t80 -58.98 -41.45 87.58 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.359 -0.838 . . . . 0.0 109.173 178.956 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -72.32 -42.3 65.59 Favored 'General case' 0 N--CA 1.504 2.271 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 178.222 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.801 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 86.5 t90 -56.12 -36.78 68.6 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.231 -0.918 . . . . 0.0 109.359 178.464 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.683 HD12 ' HA ' ' A' ' 78' ' ' TYR . 11.1 mt -66.59 -59.56 3.51 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.232 -0.917 . . . . 0.0 108.769 178.927 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.46 HG13 ' HB3' ' A' ' 87' ' ' ALA . 2.5 mt -56.27 -27.73 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.584 0 O-C-N 120.907 -1.12 . . . . 0.0 109.927 179.352 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 56.1 tttt -81.5 -21.02 38.91 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.896 -1.127 . . . . 0.0 110.971 178.579 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.442 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 20.3 mm-40 -105.44 22.72 14.96 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.809 -1.182 . . . . 0.0 111.979 179.91 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.416 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 4.2 tmtt? 77.3 67.73 0.05 OUTLIER 'General case' 0 N--CA 1.515 2.811 0 O-C-N 121.207 -0.933 . . . . 0.0 112.075 179.167 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.487 ' HE2' HD13 ' A' ' 23' ' ' LEU . 20.8 m-85 -130.28 -62.59 0.93 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.409 -0.807 . . . . 0.0 108.938 178.839 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.677 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -131.26 167.62 18.9 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.406 -0.809 . . . . 0.0 109.581 179.463 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.466 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 13.3 t0 -120.13 114.6 22.2 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.187 -0.945 . . . . 0.0 110.338 179.897 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -58.1 -38.16 75.93 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.24 -0.912 . . . . 0.0 110.028 179.803 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.637 HD23 HD22 ' A' ' 106' ' ' LEU . 13.5 tp -58.69 -38.19 77.72 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.211 -0.931 . . . . 0.0 110.144 179.842 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.584 ' HA ' HD21 ' A' ' 106' ' ' LEU . 62.8 tp -69.42 -52.34 27.83 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.007 -1.058 . . . . 0.0 108.854 179.41 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.424 HD13 ' HD2' ' A' ' 64' ' ' TYR . 69.0 mt -60.33 -32.7 51.57 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 C-N-CA 119.249 -0.98 . . . . 0.0 108.978 178.33 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.42 -49.27 67.32 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 120.989 -1.069 . . . . 0.0 109.267 178.826 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.491 ' HD3' HD23 ' A' ' 106' ' ' LEU . 11.2 mttp -56.55 -42.11 77.97 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.004 -1.06 . . . . 0.0 109.618 179.243 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.419 ' CZ3' ' HG ' ' A' ' 91' ' ' LEU . 3.8 m0 -62.17 -30.99 71.44 Favored 'General case' 0 N--CA 1.504 2.273 0 C-N-CA 119.142 -1.023 . . . . 0.0 109.634 178.682 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.15 22.58 10.23 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 120.953 -1.092 . . . . 0.0 111.117 179.048 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.458 ' HB2' ' CD2' ' A' ' 100' ' ' TYR . 8.0 mmtp -102.17 -174.06 2.49 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 120.686 -1.259 . . . . 0.0 109.628 179.052 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 56.5 m -102.57 127.43 49.65 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.112 -0.992 . . . . 0.0 109.678 179.244 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.69 9.22 50.37 Favored Glycine 0 N--CA 1.493 2.454 0 C-N-CA 120.187 -1.006 . . . . 0.0 111.038 -179.218 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.458 ' CD2' ' HB2' ' A' ' 97' ' ' LYS . 44.6 m-85 -111.15 48.87 0.91 Allowed 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 119.598 1.699 . . . . 0.0 110.219 179.744 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -59.52 -38.48 81.1 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.112 -0.992 . . . . 0.0 109.988 179.862 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -122.06 121.25 36.56 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.18 -0.95 . . . . 0.0 110.202 -179.966 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.88 HD13 HD13 ' A' ' 109' ' ' ILE . 9.7 tp -153.74 131.3 11.42 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.185 -0.947 . . . . 0.0 110.259 -179.674 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.453 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.4 p -108.98 -37.06 5.93 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.228 -0.92 . . . . 0.0 112.227 179.988 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.79 ' O ' HD11 ' A' ' 103' ' ' LEU . 7.3 m -140.97 -168.62 2.64 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.216 -1.552 . . . . 0.0 110.118 178.943 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.637 HD22 HD23 ' A' ' 90' ' ' LEU . 15.8 mt -97.18 -38.44 9.71 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.97 -1.082 . . . . 0.0 110.368 179.298 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 1.1 ttt85 -101.71 31.57 3.77 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.954 -1.091 . . . . 0.0 109.612 178.195 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.667 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.305 1.7 t -127.72 16.13 6.94 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.123 -0.986 . . . . 0.0 109.021 -179.344 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.88 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -158.88 38.41 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.369 0 O-C-N 120.937 -1.102 . . . . 0.0 110.423 -178.953 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.746 ' C ' HG23 ' A' ' 119' ' ' THR . 4.2 tt0 . . . . . 0 N--CA 1.502 2.164 0 O-C-N 120.838 -1.164 . . . . 0.0 111.314 -178.625 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.746 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.1 m . . . . . 0 N--CA 1.494 1.769 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 . . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.428 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 47.2 t -103.93 155.05 18.95 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.361 -0.837 . . . . 0.0 109.113 178.889 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.807 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -71.72 -36.19 58.16 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.372 0 O-C-N 121.056 -1.027 . . . . 0.0 110.77 -179.344 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.451 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.4 p -54.58 -32.55 58.79 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 120.772 -1.205 . . . . 0.0 110.9 -179.108 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.455 ' HG3' HG22 ' A' ' 109' ' ' ILE . 6.7 ttt-85 -58.75 -35.02 72.07 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 120.974 -1.079 . . . . 0.0 109.409 178.123 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 47.3 t -81.39 125.5 78.71 Favored Pre-proline 0 N--CA 1.504 2.253 0 O-C-N 121.282 -0.886 . . . . 0.0 109.669 179.539 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.635 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.3 Cg_endo -66.01 177.93 2.71 Favored 'Trans proline' 0 N--CA 1.489 1.242 0 O-C-N 123.126 1.067 . . . . 0.0 110.698 179.807 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -75.18 -37.78 61.09 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.23 -0.919 . . . . 0.0 110.548 -179.766 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.51 -41.72 86.06 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.062 -1.024 . . . . 0.0 109.967 -179.804 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -68.6 -41.36 79.71 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.22 -0.925 . . . . 0.0 109.209 179.307 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.635 HD12 ' O ' ' A' ' 125' ' ' PRO . 3.5 mt -64.29 -38.78 92.24 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.265 -0.897 . . . . 0.0 109.651 179.278 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -61.65 -40.56 95.35 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.123 -0.986 . . . . 0.0 109.721 179.802 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -60.42 -39.13 86.33 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.214 -0.929 . . . . 0.0 110.099 179.848 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -59.9 -41.07 90.84 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.232 -0.917 . . . . 0.0 110.038 -179.985 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.0 -45.17 94.8 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.186 -0.946 . . . . 0.0 109.91 179.911 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 3.5 ttt85 -59.33 -38.49 80.46 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.131 -0.98 . . . . 0.0 109.867 179.46 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -58.54 -35.62 72.6 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.223 -0.923 . . . . 0.0 110.509 179.859 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 13.9 mttp -105.37 18.24 22.6 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 120.98 -1.075 . . . . 0.0 111.908 -179.959 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 56.17 44.95 88.77 Favored Glycine 0 N--CA 1.498 2.775 0 O-C-N 120.601 -1.312 . . . . 0.0 110.312 179.374 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.2 t -136.89 -163.0 1.35 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.131 -1.217 . . . . 0.0 109.967 179.848 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -137.12 146.09 44.64 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.075 -1.015 . . . . 0.0 110.276 -179.957 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.556 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.7 p -132.79 161.38 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.226 -0.921 . . . . 0.0 110.117 -179.954 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 42.2 t -167.36 82.1 0.21 Allowed 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.212 -0.93 . . . . 0.0 111.041 179.943 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.794 ' CG ' HD12 ' A' ' 121' ' ' ILE . 44.7 t80 -94.42 161.45 14.23 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.253 -0.904 . . . . 0.0 110.337 179.997 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 -140.67 -60.71 0.51 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.534 -0.728 . . . . 0.0 109.098 179.124 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -131.15 151.56 51.32 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.427 -0.796 . . . . 0.0 109.055 178.871 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 28.1 p -96.73 154.79 17.08 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 121.052 -1.03 . . . . 0.0 110.957 -179.698 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.1 m -73.89 -25.68 20.61 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.464 0 O-C-N 121.382 -0.824 . . . . 0.0 111.813 -179.218 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . 0.554 ' O ' ' HE1' ' A' ' 53' ' ' MET . 4.0 m-70 -49.99 -51.66 39.97 Favored 'General case' 0 N--CA 1.516 2.829 0 O-C-N 120.839 -1.163 . . . . 0.0 110.268 -179.768 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.486 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 28.1 p -134.87 -165.53 1.68 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.198 -0.938 . . . . 0.0 110.606 179.832 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -99.17 58.08 0.87 Allowed Glycine 0 N--CA 1.493 2.441 0 N-CA-C 108.013 -2.035 . . . . 0.0 108.013 178.492 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 27.8 t -103.06 144.05 31.79 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.339 -1.095 . . . . 0.0 109.988 -179.196 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 74.7 mtt85 -99.06 49.02 0.95 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.331 -0.855 . . . . 0.0 109.629 179.298 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.94 98.58 0.05 OUTLIER Glycine 0 N--CA 1.488 2.133 0 N-CA-C 109.866 -1.294 . . . . 0.0 109.866 179.938 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.5 p -111.98 128.01 56.04 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.302 -1.116 . . . . 0.0 110.237 179.652 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . 0.526 ' HB1' ' HD3' ' A' ' 125' ' ' PRO . . . -141.87 146.12 35.41 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.014 -1.054 . . . . 0.0 110.005 -179.626 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.496 1.847 0 O-C-N 121.269 -0.894 . . . . 0.0 110.203 -179.901 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.865 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.507 2.4 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 . . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -76.22 79.14 3.02 Favored 'Trans proline' 0 N--CA 1.487 1.089 0 O-C-N 123.251 1.132 . . . . 0.0 112.168 -178.299 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.9 t70 48.04 90.05 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.332 -0.855 . . . . 0.0 111.826 178.397 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 164.23 -42.19 0.31 Allowed Glycine 0 N--CA 1.501 2.969 0 C-N-CA 119.782 -1.199 . . . . 0.0 110.641 179.58 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.564 ' HE1' HD13 ' A' ' 23' ' ' LEU . 18.7 t80 -55.07 -29.4 57.45 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.183 -1.186 . . . . 0.0 110.801 179.872 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -54.52 -37.81 65.79 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 120.92 -1.113 . . . . 0.0 110.18 179.596 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.08 -35.04 70.82 Favored 'General case' 0 N--CA 1.511 2.585 0 O-C-N 121.231 -0.918 . . . . 0.0 110.376 179.425 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.1 pt -124.4 36.82 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 121.173 -0.954 . . . . 0.0 110.325 179.835 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -83.81 -42.69 0.79 Allowed Pre-proline 0 N--CA 1.509 2.507 0 O-C-N 121.128 -0.982 . . . . 0.0 113.474 -179.168 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.0 Cg_endo -74.41 -33.8 5.14 Favored 'Trans proline' 0 N--CA 1.488 1.166 0 O-C-N 122.623 0.802 . . . . 0.0 112.04 -177.978 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.884 HG21 ' CE2' ' A' ' 62' ' ' TYR . 93.2 m -58.73 -41.46 86.45 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.791 -1.193 . . . . 0.0 110.044 -179.814 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.564 HD13 ' HE1' ' A' ' 16' ' ' PHE . 0.3 OUTLIER -62.22 -37.27 84.7 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.26 -0.9 . . . . 0.0 110.109 179.636 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -57.43 -37.06 72.18 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 120.964 -1.085 . . . . 0.0 110.22 179.809 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -59.91 -35.38 74.74 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.105 -0.997 . . . . 0.0 110.198 179.592 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.712 ' CD2' HD12 ' A' ' 55' ' ' LEU . 6.9 m-85 -57.37 -43.53 83.64 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 120.987 -1.07 . . . . 0.0 110.071 179.355 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -57.49 -26.55 61.46 Favored 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 119.264 -0.974 . . . . 0.0 110.45 179.259 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.6 mm -65.15 -49.63 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.325 0 O-C-N 120.987 -1.07 . . . . 0.0 109.05 179.402 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -66.96 -52.01 48.12 Favored 'General case' 0 N--CA 1.505 2.323 0 C-N-CA 119.201 -1.0 . . . . 0.0 108.61 179.042 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.819 HD21 HG23 ' A' ' 52' ' ' ILE . 0.1 OUTLIER -57.84 -33.25 68.44 Favored 'General case' 0 N--CA 1.51 2.552 0 C-N-CA 119.331 -0.948 . . . . 0.0 109.738 178.802 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.27 -44.9 96.47 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 120.877 -1.139 . . . . 0.0 110.0 179.875 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.34 -43.33 96.56 Favored 'General case' 0 N--CA 1.508 2.468 0 C-N-CA 119.218 -0.993 . . . . 0.0 109.884 -179.629 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.519 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -71.79 -41.69 68.0 Favored 'General case' 0 N--CA 1.503 2.218 0 C-N-CA 119.247 -0.981 . . . . 0.0 109.093 178.954 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -62.48 -32.72 73.66 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.288 -0.883 . . . . 0.0 110.28 179.474 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.4 mmtt -94.96 -38.37 10.72 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 120.896 -1.128 . . . . 0.0 110.723 179.906 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.5 t70 . . . . . 0 N--CA 1.511 2.614 0 O-C-N 121.055 -1.028 . . . . 0.0 109.984 179.836 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.1 m . . . . . 0 N--CA 1.499 2.014 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.403 ' O ' ' CG ' ' A' ' 50' ' ' TRP . 68.5 m-20 -58.51 -39.02 78.93 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.206 -0.934 . . . . 0.0 109.856 179.483 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -66.32 -45.64 79.57 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.164 -0.96 . . . . 0.0 109.333 179.344 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 49.2 tp60 -66.78 -41.66 87.29 Favored 'General case' 0 N--CA 1.505 2.296 0 C-N-CA 119.341 -0.943 . . . . 0.0 109.015 179.048 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.54 HD23 HD12 ' A' ' 52' ' ' ILE . 12.5 mt -61.0 -37.33 82.15 Favored 'General case' 0 N--CA 1.506 2.332 0 C-N-CA 119.506 -0.878 . . . . 0.0 109.78 179.318 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.5 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.4 m0 -58.6 -35.95 73.24 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.947 -1.096 . . . . 0.0 110.259 179.712 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.6 ' O ' HD22 ' A' ' 55' ' ' LEU . 4.3 tt0 -63.92 -29.49 70.66 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.022 -1.049 . . . . 0.0 109.87 178.513 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.819 HG23 HD21 ' A' ' 30' ' ' LEU . 68.1 mt -71.88 -57.9 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.279 0 O-C-N 120.92 -1.112 . . . . 0.0 109.564 179.542 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 ptm -57.93 -26.65 62.52 Favored 'General case' 0 N--CA 1.511 2.602 0 C-N-CA 118.284 -1.366 . . . . 0.0 109.796 178.769 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -62.39 -35.97 80.85 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 120.812 -1.18 . . . . 0.0 109.503 178.19 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.712 HD12 ' CD2' ' A' ' 26' ' ' PHE . 0.5 OUTLIER -53.64 -36.51 62.15 Favored 'General case' 0 N--CA 1.513 2.695 0 O-C-N 120.868 -1.145 . . . . 0.0 109.869 179.378 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.457 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 22.4 t60 -53.14 -38.42 62.69 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.917 -1.114 . . . . 0.0 110.427 -179.684 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.448 ' CD2' HD21 ' A' ' 91' ' ' LEU . 5.5 m170 -67.48 -54.79 17.14 Favored 'General case' 0 N--CA 1.506 2.338 0 C-N-CA 119.207 -0.997 . . . . 0.0 109.318 179.369 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.439 ' HB3' ' CE2' ' A' ' 26' ' ' PHE . 13.7 tt0 -56.76 -32.93 66.1 Favored 'General case' 0 N--CA 1.507 2.381 0 C-N-CA 119.404 -0.918 . . . . 0.0 109.726 178.975 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.407 ' HG3' ' CE2' ' A' ' 26' ' ' PHE . 0.4 OUTLIER -67.18 -52.42 41.54 Favored 'General case' 0 N--CA 1.509 2.475 0 O-C-N 120.965 -1.084 . . . . 0.0 109.184 178.834 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.8 p -63.31 -37.63 88.0 Favored 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 119.253 -0.979 . . . . 0.0 109.318 178.997 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 48.6 ttt85 -65.06 -39.33 93.12 Favored 'General case' 0 N--CA 1.505 2.289 0 C-N-CA 119.251 -0.98 . . . . 0.0 109.355 179.053 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.884 ' CE2' HG21 ' A' ' 22' ' ' THR . 35.7 t80 -62.27 -50.51 71.41 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.013 -1.054 . . . . 0.0 109.375 179.441 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.571 HD12 ' HB2' ' A' ' 87' ' ' ALA . 86.8 mt -71.8 -40.33 69.2 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.34 0 O-C-N 121.188 -0.945 . . . . 0.0 109.232 179.28 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -64.08 -42.59 96.9 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.157 -0.964 . . . . 0.0 109.123 179.272 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.418 ' HA ' ' CD ' ' A' ' 69' ' ' LYS . 94.0 m -61.67 -42.28 98.7 Favored 'General case' 0 N--CA 1.501 2.116 0 C-N-CA 119.3 -0.96 . . . . 0.0 110.297 -179.642 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.56 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.6 pp -83.25 -31.85 26.76 Favored 'General case' 0 N--CA 1.504 2.267 0 C-N-CA 118.828 -1.149 . . . . 0.0 112.485 -179.022 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.456 ' HD1' HG23 ' A' ' 73' ' ' ILE . 66.8 t80 -86.24 -33.16 20.8 Favored 'General case' 0 N--CA 1.514 2.732 0 O-C-N 120.659 -1.275 . . . . 0.0 111.71 -179.508 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -98.37 -18.95 18.03 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 120.813 -1.179 . . . . 0.0 112.726 -178.662 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.418 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 5.6 mttt -120.97 -59.32 1.74 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 120.439 -1.413 . . . . 0.0 110.944 179.844 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.411 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 1.0 OUTLIER -63.1 -30.76 71.85 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.124 -0.985 . . . . 0.0 110.763 -179.648 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 42.0 tttt 57.68 42.35 23.95 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 120.751 -1.218 . . . . 0.0 110.062 -179.554 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -111.9 35.12 3.83 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.406 -0.809 . . . . 0.0 109.879 179.285 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.56 HG21 ' CD1' ' A' ' 66' ' ' LEU . 14.0 tt -154.17 162.48 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 O-C-N 121.234 -0.916 . . . . 0.0 109.895 179.969 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 43.5 m -107.6 145.08 33.75 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.137 -0.977 . . . . 0.0 110.301 179.863 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -46.71 -30.6 2.46 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.293 -0.879 . . . . 0.0 111.772 179.95 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.44 -50.46 73.5 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.781 -1.199 . . . . 0.0 109.462 179.677 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 24.5 tp -69.26 -44.02 72.76 Favored 'General case' 0 N--CA 1.505 2.277 0 C-N-CA 118.918 -1.113 . . . . 0.0 108.232 178.637 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.666 ' HA ' HD12 ' A' ' 81' ' ' LEU . 20.0 t80 -57.41 -38.6 74.59 Favored 'General case' 0 N--CA 1.509 2.475 0 C-N-CA 119.547 -0.861 . . . . 0.0 109.228 178.662 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -74.99 -42.45 57.51 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 177.925 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.865 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 81.4 t90 -55.44 -37.86 68.27 Favored 'General case' 0 N--CA 1.511 2.596 0 O-C-N 121.27 -0.894 . . . . 0.0 109.361 178.444 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.666 HD12 ' HA ' ' A' ' 78' ' ' TYR . 9.2 mt -68.32 -50.2 55.02 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.17 -0.956 . . . . 0.0 108.828 178.917 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.43 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 36.5 mm -56.4 -30.72 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.647 0 O-C-N 121.271 -0.893 . . . . 0.0 110.115 179.36 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 54.1 mttt -89.09 -22.17 23.03 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.932 -1.105 . . . . 0.0 111.753 -179.999 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.435 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 60.2 mm-40 -98.46 21.58 10.95 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 120.618 -1.301 . . . . 0.0 111.941 -179.97 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.6 tttm 74.39 74.1 0.11 Allowed 'General case' 0 N--CA 1.511 2.624 0 O-C-N 121.062 -1.024 . . . . 0.0 111.765 179.258 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.458 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 29.7 m-85 -133.22 -62.4 0.79 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.488 -0.757 . . . . 0.0 109.342 179.603 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.571 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -127.65 161.81 28.01 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.423 -0.798 . . . . 0.0 109.402 179.219 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.457 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 8.5 t0 -108.33 111.39 23.3 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.125 -0.984 . . . . 0.0 110.445 -179.853 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.0 mmtp -58.23 -36.81 73.73 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.313 -0.867 . . . . 0.0 110.109 179.707 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.1 tp -58.2 -38.64 77.14 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.075 -1.016 . . . . 0.0 110.131 179.707 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.623 ' HA ' HD21 ' A' ' 106' ' ' LEU . 64.1 tp -70.24 -53.22 17.89 Favored 'General case' 0 N--CA 1.505 2.311 0 C-N-CA 119.196 -1.002 . . . . 0.0 108.751 179.284 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.449 HG22 ' HD2' ' A' ' 96' ' ' ARG . 54.8 mt -59.38 -31.33 46.19 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.47 0 C-N-CA 119.225 -0.99 . . . . 0.0 109.299 178.469 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.5 -45.57 83.03 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 120.962 -1.086 . . . . 0.0 109.733 179.219 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.497 ' HD3' HD23 ' A' ' 106' ' ' LEU . 7.2 mttp -60.89 -45.03 96.2 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.088 -1.007 . . . . 0.0 109.882 179.376 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.7 m0 -58.31 -37.6 75.4 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.987 -1.071 . . . . 0.0 109.843 179.366 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.449 ' HD2' HG22 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -77.09 -36.75 55.48 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.204 -0.935 . . . . 0.0 109.743 178.864 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 31.1 mmtt -54.36 -177.12 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.641 0 O-C-N 121.075 -1.016 . . . . 0.0 110.226 179.588 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 33.1 m -108.57 141.03 41.08 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.247 -0.908 . . . . 0.0 109.341 178.807 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 106.5 -29.72 10.57 Favored Glycine 0 N--CA 1.492 2.42 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 -178.987 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 51.9 m-85 -92.64 56.83 2.77 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 120.895 -1.356 . . . . 0.0 110.061 179.747 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -69.44 -39.42 77.82 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 120.939 -1.101 . . . . 0.0 109.707 179.649 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.56 81.54 1.74 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.234 -0.916 . . . . 0.0 110.094 179.923 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.994 HD12 HD13 ' A' ' 109' ' ' ILE . 2.2 tt -113.99 137.14 52.09 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.107 -0.996 . . . . 0.0 110.212 -179.983 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.44 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.0 p -105.56 -30.07 9.75 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.394 -0.816 . . . . 0.0 111.871 179.259 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.671 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 13.1 m -145.28 -168.03 2.84 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 120.323 -1.486 . . . . 0.0 109.444 178.813 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.623 HD21 ' HA ' ' A' ' 91' ' ' LEU . 15.1 mt -99.13 -37.03 9.49 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.119 -0.988 . . . . 0.0 110.492 178.898 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 1.8 ttt-85 -103.95 34.98 2.81 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.851 -1.156 . . . . 0.0 109.417 178.456 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.671 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.309 1.7 t -129.46 21.17 5.62 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -179.39 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.994 HD13 HD12 ' A' ' 103' ' ' LEU . 1.6 pt -156.73 37.08 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.282 0 O-C-N 120.953 -1.092 . . . . 0.0 110.634 -178.626 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.51 ' C ' HG23 ' A' ' 119' ' ' THR . 1.7 mt-30 . . . . . 0 N--CA 1.514 2.745 0 O-C-N 120.858 -1.151 . . . . 0.0 110.833 -178.864 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.51 HG23 ' C ' ' A' ' 110' ' ' GLN . 4.0 m . . . . . 0 N--CA 1.494 1.765 0 CA-C-O 120.659 0.266 . . . . 0.0 110.372 . . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 49.5 t -89.32 153.75 20.63 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.242 -0.911 . . . . 0.0 109.183 178.99 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.82 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -74.12 -35.63 41.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 121.048 -1.032 . . . . 0.0 111.184 -178.898 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.458 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.7 p -56.05 -35.84 67.37 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.886 -1.134 . . . . 0.0 111.058 -178.613 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.519 ' HG3' HG22 ' A' ' 109' ' ' ILE . 0.5 OUTLIER -58.82 -33.96 70.97 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.004 -1.06 . . . . 0.0 109.959 178.662 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 47.2 t -76.51 125.36 87.55 Favored Pre-proline 0 N--CA 1.505 2.28 0 O-C-N 121.065 -1.022 . . . . 0.0 110.077 179.957 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.4 ' HB3' ' CB ' ' A' ' 154' ' ' ALA . 37.9 Cg_endo -65.04 175.64 3.69 Favored 'Trans proline' 0 N--CA 1.488 1.204 0 O-C-N 123.236 1.124 . . . . 0.0 110.801 179.428 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -75.02 -36.66 61.91 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.274 -0.891 . . . . 0.0 110.542 -179.977 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.29 -40.36 77.63 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.035 -1.04 . . . . 0.0 109.989 -179.935 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.21 -42.43 75.77 Favored 'General case' 0 N--CA 1.506 2.356 0 C-N-CA 119.358 -0.937 . . . . 0.0 109.169 179.313 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.579 HD11 HD11 ' A' ' 121' ' ' ILE . 3.5 mt -66.94 -39.68 87.38 Favored 'General case' 0 N--CA 1.505 2.279 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.342 178.989 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -60.51 -38.02 82.99 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.237 -0.915 . . . . 0.0 109.82 179.404 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -57.74 -37.0 72.83 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.17 -0.956 . . . . 0.0 110.372 179.787 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -63.57 -50.38 69.69 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.131 -0.981 . . . . 0.0 109.673 179.862 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.53 -38.35 87.1 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.186 -0.946 . . . . 0.0 109.991 179.745 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 5.1 ttt85 -68.96 -36.53 78.0 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 121.057 -1.027 . . . . 0.0 110.265 179.61 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -79.03 -33.83 44.43 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.01 -1.056 . . . . 0.0 110.587 179.861 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 23.1 mttt -83.97 -19.28 34.88 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.054 -1.029 . . . . 0.0 111.765 179.758 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.37 32.73 10.07 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 -179.502 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 7.8 t -135.88 -160.88 1.1 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.031 -1.276 . . . . 0.0 109.738 179.883 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -132.72 142.21 48.93 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.063 -1.023 . . . . 0.0 110.232 179.905 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.7 p -125.6 160.54 31.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 O-C-N 121.246 -0.909 . . . . 0.0 110.027 179.738 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 32.4 t -167.71 83.14 0.2 Allowed 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.223 -0.923 . . . . 0.0 111.277 -179.828 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.752 ' CG ' HD12 ' A' ' 121' ' ' ILE . 46.6 t80 -92.72 159.61 15.35 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.175 -0.953 . . . . 0.0 109.981 179.601 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 20.7 m170 -136.97 -61.31 0.67 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.434 -0.791 . . . . 0.0 109.136 179.245 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -135.63 151.65 50.46 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.48 -0.762 . . . . 0.0 109.227 178.988 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 29.8 p -92.85 154.05 18.47 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.107 -0.996 . . . . 0.0 110.877 -179.761 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 26.8 m -72.05 -25.63 24.02 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.533 0 O-C-N 121.422 -0.799 . . . . 0.0 111.481 -179.487 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -51.32 -55.14 19.98 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 120.811 -1.18 . . . . 0.0 109.94 -179.958 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.5 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 28.4 p -131.39 -170.15 2.32 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.235 -0.915 . . . . 0.0 110.583 179.571 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . 0.4 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -97.7 58.44 1.09 Allowed Glycine 0 N--CA 1.492 2.425 0 N-CA-C 107.937 -2.065 . . . . 0.0 107.937 178.421 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 13.0 t -97.71 146.21 25.58 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.369 -1.077 . . . . 0.0 109.797 -179.157 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 14.9 mmt85 -98.16 50.29 1.01 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.287 -0.883 . . . . 0.0 109.503 179.123 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.95 98.0 0.03 OUTLIER Glycine 0 N--CA 1.486 2.008 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 -179.877 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.0 p -110.48 129.35 55.8 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.298 -1.119 . . . . 0.0 110.336 179.699 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . 0.4 ' CB ' ' HB3' ' A' ' 125' ' ' PRO . . . -143.08 145.75 33.16 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.05 -1.031 . . . . 0.0 110.046 -179.789 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.499 1.99 0 O-C-N 121.159 -0.963 . . . . 0.0 110.62 -179.752 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.865 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.511 2.579 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 . . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -83.12 83.08 1.99 Allowed 'Trans proline' 0 C--N 1.318 -1.057 0 O-C-N 123.186 1.098 . . . . 0.0 112.434 -178.131 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 48.81 92.07 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.322 -0.862 . . . . 0.0 111.676 178.473 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.06 -39.58 0.46 Allowed Glycine 0 N--CA 1.5 2.95 0 C-N-CA 119.658 -1.258 . . . . 0.0 110.579 179.554 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.582 ' N ' HD21 ' A' ' 77' ' ' LEU . 18.1 t80 -58.03 -31.47 67.02 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.073 -1.251 . . . . 0.0 110.509 179.812 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -52.69 -33.81 49.21 Favored 'General case' 0 N--CA 1.512 2.671 0 O-C-N 120.968 -1.083 . . . . 0.0 110.218 179.247 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 42.8 mmtt -58.4 -38.2 76.87 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.147 -0.971 . . . . 0.0 110.111 179.525 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.525 HD11 HD21 ' A' ' 81' ' ' LEU . 3.8 pt -116.65 36.94 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.213 -0.929 . . . . 0.0 110.499 179.727 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.427 ' N ' ' HD2' ' A' ' 21' ' ' PRO . 1.4 tmtt? -84.1 -42.64 0.76 Allowed Pre-proline 0 N--CA 1.508 2.447 0 O-C-N 121.173 -0.954 . . . . 0.0 113.523 -178.941 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.427 ' HD2' ' N ' ' A' ' 20' ' ' LYS . 44.6 Cg_endo -74.58 -36.88 2.63 Favored 'Trans proline' 0 N--CA 1.486 1.054 0 O-C-N 122.518 0.746 . . . . 0.0 111.967 -177.971 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.959 HG21 ' CE2' ' A' ' 62' ' ' TYR . 70.4 m -62.22 -48.0 81.91 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 120.96 -1.088 . . . . 0.0 109.786 -179.97 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.428 ' CD1' HD12 ' A' ' 19' ' ' ILE . 5.2 mt -60.09 -35.42 75.16 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.252 -0.905 . . . . 0.0 109.825 179.196 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 25.2 m -55.76 -36.91 67.84 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.026 -1.046 . . . . 0.0 110.11 179.324 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -57.47 -38.42 74.48 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.184 -0.948 . . . . 0.0 109.946 179.554 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.75 ' CD2' HD22 ' A' ' 55' ' ' LEU . 20.5 m-85 -59.34 -40.66 87.08 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.15 -0.969 . . . . 0.0 109.887 179.616 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -58.63 -25.27 62.52 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.299 -0.875 . . . . 0.0 111.321 -179.874 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.537 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.6 mp -79.0 -34.61 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.442 0 O-C-N 120.889 -1.132 . . . . 0.0 109.833 179.705 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -81.85 -36.72 27.95 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.007 -1.058 . . . . 0.0 109.109 178.554 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.737 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -73.9 -31.98 63.37 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.163 -0.96 . . . . 0.0 110.109 178.81 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.1 ptm180 -69.57 -36.49 76.34 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 120.799 -1.188 . . . . 0.0 109.753 179.354 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.49 -42.19 99.33 Favored 'General case' 0 N--CA 1.508 2.435 0 C-N-CA 119.043 -1.063 . . . . 0.0 109.123 179.316 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.602 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -69.7 -42.4 74.14 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.373 -0.931 . . . . 0.0 108.839 178.775 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 34.3 mm-40 -58.98 -35.02 72.51 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.308 -0.87 . . . . 0.0 110.138 179.436 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -90.04 -39.45 12.93 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 120.976 -1.077 . . . . 0.0 110.133 179.653 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.6 t70 . . . . . 0 N--CA 1.51 2.544 0 O-C-N 121.2 -0.937 . . . . 0.0 110.308 179.639 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 28.3 t . . . . . 0 N--CA 1.502 2.168 0 CA-C-O 120.396 0.141 . . . . 0.0 110.733 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.403 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 15.1 m-80 -57.51 -40.62 79.09 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.073 -1.017 . . . . 0.0 109.954 179.918 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -61.23 -40.0 92.37 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.229 -0.92 . . . . 0.0 109.878 179.667 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 25.4 tp60 -68.13 -38.96 82.78 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.123 -0.986 . . . . 0.0 109.858 179.574 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.539 HD23 HD12 ' A' ' 52' ' ' ILE . 63.4 mt -70.19 -33.51 71.81 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.193 -0.942 . . . . 0.0 110.599 179.91 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.487 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.1 m0 -57.43 -40.89 79.37 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 120.865 -1.147 . . . . 0.0 109.85 179.824 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -63.18 -33.83 76.33 Favored 'General case' 0 N--CA 1.504 2.24 0 C-N-CA 119.177 -1.009 . . . . 0.0 109.481 178.413 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.737 HG23 ' CG ' ' A' ' 30' ' ' LEU . 76.1 mt -71.28 -56.04 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.217 0 O-C-N 121.059 -1.025 . . . . 0.0 109.218 179.323 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.3 ptm -63.21 -30.19 71.39 Favored 'General case' 0 N--CA 1.506 2.374 0 C-N-CA 118.547 -1.261 . . . . 0.0 109.883 178.816 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -66.6 -38.97 88.12 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 120.817 -1.177 . . . . 0.0 108.907 178.227 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.75 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.5 mt -53.63 -33.13 54.01 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 121.105 -0.997 . . . . 0.0 110.117 178.93 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.474 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 69.6 t60 -54.73 -37.9 66.46 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.048 -1.032 . . . . 0.0 109.973 179.668 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.434 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.0 m170 -60.89 -49.38 77.68 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.2 -0.938 . . . . 0.0 109.257 179.437 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.57 -36.21 77.93 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.386 -0.925 . . . . 0.0 109.374 178.74 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.42 ' HG3' ' CE2' ' A' ' 26' ' ' PHE . 0.5 OUTLIER -62.6 -49.76 73.96 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.139 -0.976 . . . . 0.0 109.299 179.229 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 92.3 p -64.65 -39.97 94.63 Favored 'General case' 0 N--CA 1.503 2.199 0 C-N-CA 119.222 -0.991 . . . . 0.0 108.982 179.175 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.1 ttp85 -63.18 -40.25 96.97 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.135 -0.978 . . . . 0.0 109.091 178.927 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.959 ' CE2' HG21 ' A' ' 22' ' ' THR . 43.6 t80 -64.15 -53.76 44.35 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.202 -0.937 . . . . 0.0 109.187 179.293 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.722 HD12 ' HB2' ' A' ' 87' ' ' ALA . 78.6 mt -66.28 -34.71 72.0 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 C-N-CA 119.163 -1.015 . . . . 0.0 109.36 179.292 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.461 ' HD2' HD13 ' A' ' 92' ' ' ILE . 12.4 t80 -68.87 -42.57 76.82 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.993 -1.067 . . . . 0.0 108.797 178.789 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.403 ' HA ' ' HD3' ' A' ' 69' ' ' LYS . 85.4 m -59.45 -39.28 83.08 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.219 -0.926 . . . . 0.0 110.615 -179.608 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.609 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.6 pp -83.02 -34.42 26.29 Favored 'General case' 0 N--CA 1.503 2.224 0 C-N-CA 118.596 -1.241 . . . . 0.0 112.114 -179.08 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.548 ' N ' HD12 ' A' ' 66' ' ' LEU . 36.5 t80 -86.52 -32.09 20.92 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 120.705 -1.247 . . . . 0.0 111.948 -179.395 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.436 ' CD2' ' CE2' ' A' ' 64' ' ' TYR . 9.4 m-85 -98.39 -17.9 18.58 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.764 -1.21 . . . . 0.0 112.943 -178.495 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.403 ' HD3' ' HA ' ' A' ' 65' ' ' THR . 21.0 mtpt -118.29 -57.16 2.1 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.433 -1.417 . . . . 0.0 110.846 -179.962 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.406 ' HB2' ' HA ' ' A' ' 66' ' ' LEU . 46.4 mtp180 -68.8 -29.25 67.57 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.177 -0.952 . . . . 0.0 110.964 -179.581 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.21 42.02 22.66 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 120.881 -1.137 . . . . 0.0 109.896 -179.425 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.86 35.25 3.97 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.453 -0.779 . . . . 0.0 109.927 179.286 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.609 HG21 ' CD1' ' A' ' 66' ' ' LEU . 13.4 tt -152.91 162.05 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.2 -0.937 . . . . 0.0 109.775 179.933 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -108.33 149.57 28.5 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.155 -0.966 . . . . 0.0 110.204 -179.916 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.2 ttpt -46.84 -32.23 3.59 Favored 'General case' 0 N--CA 1.514 2.763 0 O-C-N 121.314 -0.866 . . . . 0.0 111.426 179.992 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -64.24 -47.82 78.18 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 120.846 -1.159 . . . . 0.0 109.319 179.349 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.582 HD21 ' N ' ' A' ' 16' ' ' PHE . 0.4 OUTLIER -67.39 -41.01 85.67 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.186 -0.946 . . . . 0.0 108.749 178.869 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.472 ' CE1' HG22 ' A' ' 63' ' ' ILE . 13.2 t80 -66.33 -41.34 89.77 Favored 'General case' 0 N--CA 1.505 2.298 0 C-N-CA 119.565 -0.854 . . . . 0.0 109.263 179.027 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -72.9 -41.78 64.24 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.136 -0.978 . . . . 0.0 108.788 178.78 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.865 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 87.8 t90 -55.8 -37.37 68.53 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.158 -0.964 . . . . 0.0 109.31 178.803 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.525 HD21 HD11 ' A' ' 19' ' ' ILE . 17.2 mt -67.81 -59.76 3.05 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.136 -0.978 . . . . 0.0 108.627 178.869 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.537 HG21 ' HG3' ' A' ' 89' ' ' LYS . 3.8 mt -57.18 -26.91 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 O-C-N 120.924 -1.11 . . . . 0.0 110.026 179.306 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.2 tptm -80.19 -18.74 48.77 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 120.873 -1.142 . . . . 0.0 110.946 178.549 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.44 ' HB2' ' CE1' ' A' ' 86' ' ' TYR . 11.0 mm-40 -109.24 23.89 13.87 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.66 -1.275 . . . . 0.0 112.0 179.982 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.418 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 15.0 tttm 77.17 68.35 0.05 Allowed 'General case' 0 N--CA 1.515 2.775 0 O-C-N 121.212 -0.93 . . . . 0.0 112.133 179.243 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.472 ' CE2' HD23 ' A' ' 81' ' ' LEU . 21.6 m-85 -130.53 -62.4 0.92 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.404 -0.81 . . . . 0.0 109.186 179.196 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.722 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -128.6 173.32 10.38 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.447 -0.783 . . . . 0.0 109.602 179.596 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.474 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 13.7 t0 -120.29 108.54 14.3 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.035 -1.041 . . . . 0.0 110.453 179.965 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.537 ' HG3' HG21 ' A' ' 82' ' ' ILE . 20.8 mtmt -58.84 -39.17 80.46 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.195 -0.941 . . . . 0.0 110.1 179.863 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.574 HD23 HD22 ' A' ' 106' ' ' LEU . 16.5 tp -59.61 -38.58 81.66 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.108 -0.995 . . . . 0.0 110.258 -179.831 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.461 ' N ' HD11 ' A' ' 106' ' ' LEU . 53.6 tp -68.18 -48.76 64.41 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.191 -1.004 . . . . 0.0 109.184 179.482 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.461 HD13 ' HD2' ' A' ' 64' ' ' TYR . 70.8 mt -59.59 -37.91 72.89 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.495 0 O-C-N 121.126 -0.984 . . . . 0.0 108.838 178.658 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.76 -38.98 87.67 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.12 -0.988 . . . . 0.0 109.059 178.442 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.616 ' HB3' HD22 ' A' ' 103' ' ' LEU . 9.6 mmtm -57.17 -42.97 82.12 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.116 -0.99 . . . . 0.0 109.493 179.34 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 2.4 m0 -63.52 -33.43 75.57 Favored 'General case' 0 N--CA 1.507 2.418 0 C-N-CA 119.583 -0.847 . . . . 0.0 110.316 179.576 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.8 -33.25 25.0 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.024 -1.048 . . . . 0.0 110.655 179.611 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.8 mmmt -51.31 176.93 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.761 0 O-C-N 120.857 -1.152 . . . . 0.0 110.831 179.907 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -103.5 140.81 37.01 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.196 -0.94 . . . . 0.0 109.321 179.163 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 102.48 -26.91 22.53 Favored Glycine 0 N--CA 1.493 2.451 0 C-N-CA 119.755 -1.212 . . . . 0.0 110.106 -179.099 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.568 ' HB3' HD23 ' A' ' 103' ' ' LEU . 67.6 m-85 -92.29 57.85 3.12 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 120.83 -1.394 . . . . 0.0 110.132 179.815 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -68.66 -36.87 79.13 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 120.936 -1.102 . . . . 0.0 110.009 179.637 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.31 81.75 2.0 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.064 -1.022 . . . . 0.0 110.481 -179.88 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.649 ' HB2' HD13 ' A' ' 109' ' ' ILE . 2.0 pp -116.4 140.23 49.57 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.084 -1.01 . . . . 0.0 110.1 179.703 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.434 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.1 p -107.4 -30.21 8.81 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.241 -0.912 . . . . 0.0 112.575 -179.722 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.712 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 10.9 m -146.41 -170.3 3.47 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 120.329 -1.482 . . . . 0.0 109.994 179.23 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.574 HD22 HD23 ' A' ' 90' ' ' LEU . 18.0 mt -99.61 -34.98 10.0 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.337 -0.852 . . . . 0.0 110.445 178.688 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 3.9 ttm180 -104.57 36.05 2.54 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.8 -1.188 . . . . 0.0 109.205 178.275 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.712 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.281 1.6 t -127.68 -59.55 1.2 Allowed 'General case' 0 N--CA 1.497 1.905 0 N-CA-C 105.901 -1.889 . . . . 0.0 105.901 -179.426 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.673 ' O ' HG21 ' A' ' 119' ' ' THR . 9.4 pt -67.81 -23.71 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.699 0 O-C-N 120.925 -1.109 . . . . 0.0 111.052 177.084 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.57 ' C ' HG23 ' A' ' 119' ' ' THR . 27.3 tt0 . . . . . 0 N--CA 1.492 1.661 0 O-C-N 120.836 -1.165 . . . . 0.0 110.024 -179.321 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.673 HG21 ' O ' ' A' ' 109' ' ' ILE . 1.6 m . . . . . 0 N--CA 1.496 1.868 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 . . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 27.4 t -57.97 154.59 12.2 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.134 -0.979 . . . . 0.0 109.952 179.821 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.827 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -75.15 -34.92 32.79 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.471 0 O-C-N 121.14 -0.975 . . . . 0.0 111.239 -179.269 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.469 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 12.1 p -54.42 -33.6 59.74 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.763 -1.21 . . . . 0.0 111.251 -178.485 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.5 -34.99 73.29 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 120.916 -1.115 . . . . 0.0 109.615 178.471 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 47.7 t -79.91 124.87 82.97 Favored Pre-proline 0 N--CA 1.504 2.254 0 O-C-N 121.134 -0.979 . . . . 0.0 109.884 179.786 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.609 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.0 Cg_endo -65.03 176.33 3.17 Favored 'Trans proline' 0 N--CA 1.489 1.233 0 O-C-N 123.113 1.059 . . . . 0.0 110.921 179.499 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -75.04 -37.21 61.77 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.296 -0.877 . . . . 0.0 110.481 -179.837 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.27 -40.75 78.36 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 120.954 -1.091 . . . . 0.0 109.926 179.946 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 9.9 tp60 -70.27 -41.61 73.19 Favored 'General case' 0 N--CA 1.505 2.305 0 C-N-CA 119.378 -0.929 . . . . 0.0 108.998 178.956 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.611 HD11 HD11 ' A' ' 121' ' ' ILE . 2.2 mt -65.09 -39.3 92.97 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.301 -0.875 . . . . 0.0 109.394 179.081 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -60.1 -39.51 86.44 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.134 -0.979 . . . . 0.0 109.905 179.639 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -58.72 -37.2 75.61 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.173 -0.955 . . . . 0.0 110.289 179.755 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -59.97 -43.46 95.05 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.159 -0.963 . . . . 0.0 109.957 179.925 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . 0.662 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -60.12 -38.96 84.6 Favored 'General case' 0 N--CA 1.51 2.544 0 C-N-CA 119.374 -0.93 . . . . 0.0 109.993 179.879 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 20.9 mtt-85 -67.11 -40.27 86.84 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.142 -0.974 . . . . 0.0 109.822 179.803 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 26.6 mmtp -68.95 -35.99 77.42 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.206 -0.934 . . . . 0.0 110.34 179.714 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . 0.431 ' HB3' HG22 ' A' ' 138' ' ' THR . 2.4 tppt? -85.48 -21.7 28.55 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.045 -1.034 . . . . 0.0 111.446 179.781 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 91.61 31.47 9.44 Favored Glycine 0 N--CA 1.493 2.473 0 N-CA-C 110.069 -1.213 . . . . 0.0 110.069 -179.727 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.662 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.9 t -140.64 -161.66 1.24 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.961 -1.317 . . . . 0.0 109.835 179.682 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -123.2 171.54 9.27 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.124 -0.985 . . . . 0.0 110.266 179.997 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 10.1 p -155.18 160.45 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.203 -0.936 . . . . 0.0 110.702 179.801 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 44.2 t -168.51 89.28 0.24 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.288 -0.882 . . . . 0.0 111.086 -179.937 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.73 ' CG ' HD12 ' A' ' 121' ' ' ILE . 50.3 t80 -95.69 159.02 15.19 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.235 -0.915 . . . . 0.0 110.13 179.867 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 8.3 m80 -136.46 -61.4 0.69 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.47 -0.769 . . . . 0.0 109.08 179.179 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . 0.405 ' OE1' ' CZ3' ' A' ' 50' ' ' TRP . 11.5 pt20 -135.74 151.28 49.98 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 178.918 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . 0.425 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.3 p -90.13 153.09 20.79 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.155 -1.018 . . . . 0.0 111.008 -179.67 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.8 m -71.14 -26.73 27.71 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 C-N-CA 119.715 -0.794 . . . . 0.0 111.496 -179.436 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -51.69 -60.66 2.91 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 120.835 -1.166 . . . . 0.0 110.288 -179.856 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.487 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 24.3 p -125.29 -170.9 2.25 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.214 -0.929 . . . . 0.0 110.849 179.862 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -95.78 59.41 1.5 Allowed Glycine 0 N--CA 1.493 2.451 0 N-CA-C 108.297 -1.921 . . . . 0.0 108.297 178.752 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 19.3 t -100.91 140.38 35.29 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.372 -1.075 . . . . 0.0 109.849 -179.367 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.6 53.18 1.43 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.282 -0.886 . . . . 0.0 109.563 179.287 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.95 98.52 0.03 OUTLIER Glycine 0 N--CA 1.486 2.001 0 N-CA-C 109.81 -1.316 . . . . 0.0 109.81 -179.952 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.8 p -108.75 127.59 54.13 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.303 -1.116 . . . . 0.0 110.451 179.683 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -143.23 147.8 35.42 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.129 -0.982 . . . . 0.0 109.927 -179.68 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.498 1.954 0 O-C-N 121.218 -0.926 . . . . 0.0 110.624 -179.709 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.666 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . . . . . . 0 N--CA 1.505 2.282 0 N-CA-C 109.765 -0.458 . . . . 0.0 109.765 . . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -71.21 163.74 38.11 Favored 'Trans proline' 0 C--N 1.316 -1.158 0 O-C-N 123.433 1.228 . . . . 0.0 110.89 -179.669 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -48.72 -31.67 7.25 Favored 'General case' 0 N--CA 1.513 2.715 0 O-C-N 121.416 -0.802 . . . . 0.0 111.463 -179.892 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.62 -34.88 36.5 Favored Glycine 0 N--CA 1.499 2.863 0 O-C-N 120.961 -1.087 . . . . 0.0 110.552 179.828 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.405 ' HB2' HD11 ' A' ' 77' ' ' LEU . 28.2 t80 -55.4 -32.79 62.95 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 121.008 -1.289 . . . . 0.0 110.614 179.692 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -54.3 -37.66 65.04 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 121.039 -1.038 . . . . 0.0 110.234 179.695 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 27.9 mttt -57.59 -36.74 72.14 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.303 -0.873 . . . . 0.0 110.177 179.452 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.89 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.1 pt -116.64 35.06 1.13 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.176 -0.952 . . . . 0.0 110.449 179.509 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.431 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 1.2 tmtt? -84.79 -43.04 0.69 Allowed Pre-proline 0 N--CA 1.509 2.511 0 O-C-N 121.122 -0.986 . . . . 0.0 113.172 -179.024 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.9 Cg_endo -76.22 -37.7 1.37 Allowed 'Trans proline' 0 N--CA 1.487 1.121 0 O-C-N 122.618 0.799 . . . . 0.0 111.571 -178.337 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.759 HG21 ' CE2' ' A' ' 62' ' ' TYR . 88.5 m -59.6 -41.62 90.74 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.031 -1.043 . . . . 0.0 109.959 -179.726 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.89 HD12 ' O ' ' A' ' 19' ' ' ILE . 6.0 mt -65.19 -39.57 93.04 Favored 'General case' 0 N--CA 1.506 2.338 0 C-N-CA 119.484 -0.887 . . . . 0.0 109.461 179.238 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.15 -35.02 69.02 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.073 -1.017 . . . . 0.0 110.235 179.335 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -56.45 -35.82 68.33 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 121.118 -0.988 . . . . 0.0 110.407 179.82 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.571 ' CE2' HD12 ' A' ' 55' ' ' LEU . 15.8 m-85 -57.25 -36.84 71.45 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.074 -1.016 . . . . 0.0 110.673 -179.952 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -60.31 -37.96 82.2 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.149 -0.969 . . . . 0.0 110.893 -178.93 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.409 HD12 ' H ' ' A' ' 28' ' ' ILE . 2.9 mp -63.28 -40.31 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.475 0 C-N-CA 118.992 -1.083 . . . . 0.0 108.961 179.783 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -70.08 -55.98 8.08 Favored 'General case' 0 N--CA 1.505 2.316 0 C-N-CA 119.115 -1.034 . . . . 0.0 108.468 178.63 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.939 HD12 HD23 ' A' ' 55' ' ' LEU . 0.8 OUTLIER -56.67 -31.28 64.27 Favored 'General case' 0 N--CA 1.509 2.508 0 C-N-CA 119.242 -0.983 . . . . 0.0 109.738 178.382 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -57.75 -38.78 75.98 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 120.942 -1.099 . . . . 0.0 110.19 179.891 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -64.32 -50.29 68.4 Favored 'General case' 0 N--CA 1.506 2.351 0 C-N-CA 119.097 -1.041 . . . . 0.0 109.728 -179.902 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.449 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -70.61 -37.59 73.88 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.371 -0.932 . . . . 0.0 109.517 179.183 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 7.2 mm100 -71.55 -30.82 66.31 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 121.164 -0.96 . . . . 0.0 110.206 179.339 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.7 mtpp -91.79 -35.21 14.24 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.905 -1.122 . . . . 0.0 110.552 179.771 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 . . . . . 0 N--CA 1.506 2.361 0 O-C-N 121.109 -0.994 . . . . 0.0 109.356 179.377 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 38.6 t . . . . . 0 N--CA 1.496 1.838 0 CA-C-O 120.599 0.238 . . . . 0.0 110.496 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 -55.87 -39.23 71.23 Favored 'General case' 0 N--CA 1.512 2.642 0 O-C-N 121.208 -0.932 . . . . 0.0 109.91 179.846 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -59.55 -36.79 76.86 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.269 -0.894 . . . . 0.0 110.028 179.524 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -62.08 -47.47 84.49 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.076 -1.015 . . . . 0.0 109.718 179.89 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 49' ' ' LEU . 12.5 mt -58.52 -38.04 76.89 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.187 -0.945 . . . . 0.0 110.127 179.908 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 48.1 m0 -59.23 -34.04 71.73 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.122 -0.986 . . . . 0.0 110.049 179.464 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.666 ' O ' HD22 ' A' ' 55' ' ' LEU . 0.7 OUTLIER -62.76 -31.09 71.98 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.077 -1.015 . . . . 0.0 109.947 178.646 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.745 HG23 HD11 ' A' ' 30' ' ' LEU . 5.7 mt -71.41 -58.89 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.263 0 O-C-N 120.921 -1.112 . . . . 0.0 109.324 179.547 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.52 -25.95 60.62 Favored 'General case' 0 N--CA 1.513 2.717 0 C-N-CA 118.312 -1.355 . . . . 0.0 110.076 178.829 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.6 mm100 -64.07 -40.07 95.46 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 120.742 -1.224 . . . . 0.0 109.405 178.522 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.939 HD23 HD12 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -55.0 -33.93 62.99 Favored 'General case' 0 N--CA 1.513 2.702 0 O-C-N 120.942 -1.099 . . . . 0.0 109.873 179.074 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.47 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 16.3 t60 -55.54 -39.78 71.02 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 120.972 -1.08 . . . . 0.0 110.291 -179.672 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 57' ' ' HIS . . . . . 0.446 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.2 m170 -64.85 -50.96 64.59 Favored 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 119.208 -0.997 . . . . 0.0 109.61 179.45 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 54.1 tp60 -57.11 -34.87 68.78 Favored 'General case' 0 N--CA 1.507 2.423 0 C-N-CA 119.436 -0.905 . . . . 0.0 109.962 179.286 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.456 ' HD3' ' CD1' ' A' ' 26' ' ' PHE . 19.2 mmm-85 -65.16 -50.32 66.43 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.027 -1.046 . . . . 0.0 109.567 179.333 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 53.8 p -60.76 -39.91 90.52 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.375 -0.93 . . . . 0.0 109.695 179.769 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.2 tpt180 -63.97 -41.19 97.63 Favored 'General case' 0 N--CA 1.505 2.314 0 C-N-CA 119.174 -1.01 . . . . 0.0 109.186 179.204 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.759 ' CE2' HG21 ' A' ' 22' ' ' THR . 36.7 t80 -63.23 -49.95 72.16 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.177 -0.952 . . . . 0.0 109.682 179.499 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.881 HD12 ' HB2' ' A' ' 87' ' ' ALA . 74.0 mt -71.61 -36.03 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 O-C-N 121.209 -0.932 . . . . 0.0 109.654 179.585 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.437 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 10.5 t80 -69.28 -41.64 76.57 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 120.974 -1.079 . . . . 0.0 108.871 178.848 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 87.8 m -61.19 -40.85 95.47 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.046 -1.034 . . . . 0.0 109.876 179.683 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.659 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.8 pp -83.23 -35.89 25.03 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 120.962 -1.086 . . . . 0.0 112.374 -179.241 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.596 ' N ' HD12 ' A' ' 66' ' ' LEU . 63.9 t80 -86.58 -35.14 19.64 Favored 'General case' 0 N--CA 1.513 2.71 0 O-C-N 120.585 -1.322 . . . . 0.0 111.839 -179.499 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.437 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 7.6 m-85 -98.26 -3.58 37.03 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 120.837 -1.164 . . . . 0.0 113.17 -178.574 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.76 -58.86 0.61 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.354 -1.466 . . . . 0.0 110.819 179.555 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.408 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 10.1 tpt180 -63.11 -29.12 70.55 Favored 'General case' 0 N--CA 1.51 2.561 0 O-C-N 121.063 -1.023 . . . . 0.0 110.609 179.956 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt 57.83 43.34 21.85 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 120.855 -1.153 . . . . 0.0 110.163 -179.512 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -115.02 36.86 3.69 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.499 -0.751 . . . . 0.0 109.737 179.213 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.744 HG13 HD23 ' A' ' 77' ' ' LEU . 13.8 tt -156.43 162.39 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.21 -0.931 . . . . 0.0 110.174 -179.83 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 31.8 m -109.93 147.54 33.24 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.163 -0.961 . . . . 0.0 109.971 179.595 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.2 tttm -45.29 -32.61 2.05 Favored 'General case' 0 N--CA 1.516 2.829 0 O-C-N 121.406 -0.809 . . . . 0.0 111.675 -179.866 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -61.72 -50.35 72.79 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 120.95 -1.093 . . . . 0.0 109.324 179.496 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.744 HD23 HG13 ' A' ' 73' ' ' ILE . 25.4 tp -67.27 -43.7 81.16 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 119.15 -1.02 . . . . 0.0 108.582 178.831 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.491 ' HA ' HD12 ' A' ' 81' ' ' LEU . 16.1 t80 -60.66 -37.97 83.3 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.312 -0.868 . . . . 0.0 109.435 178.913 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.475 ' O ' HG22 ' A' ' 82' ' ' ILE . 10.0 t70 -74.88 -41.38 59.9 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.099 -1.0 . . . . 0.0 108.968 178.786 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.666 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 82.6 t90 -59.21 -38.45 79.94 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.111 -0.993 . . . . 0.0 109.212 178.816 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.491 HD12 ' HA ' ' A' ' 78' ' ' TYR . 15.1 mt -65.95 -55.8 14.99 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.249 -0.907 . . . . 0.0 109.278 179.116 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.524 HD12 ' HB3' ' A' ' 87' ' ' ALA . 0.8 OUTLIER -56.22 -27.11 23.24 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.429 0 O-C-N 121.16 -0.962 . . . . 0.0 110.852 -179.633 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.18 -18.71 26.57 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.95 -1.094 . . . . 0.0 111.674 179.598 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.446 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 10.4 mm-40 -103.75 25.19 10.11 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 120.601 -1.312 . . . . 0.0 111.809 179.97 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 7.8 mmpt? 75.25 69.97 0.08 Allowed 'General case' 0 N--CA 1.513 2.72 0 O-C-N 121.319 -0.863 . . . . 0.0 111.989 179.362 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.524 ' HE2' HD13 ' A' ' 23' ' ' LEU . 27.7 m-85 -131.9 -64.0 0.8 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.41 -0.806 . . . . 0.0 109.192 178.997 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.881 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -129.71 -178.68 4.8 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.339 -0.85 . . . . 0.0 109.734 179.44 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.47 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 6.4 t70 -131.12 124.24 30.31 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.093 -1.004 . . . . 0.0 110.615 -179.835 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -74.35 -36.75 63.62 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.264 -0.897 . . . . 0.0 109.899 179.349 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.903 HD23 HD13 ' A' ' 106' ' ' LEU . 16.0 tp -60.1 -43.35 95.62 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.022 -1.049 . . . . 0.0 109.763 179.867 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.691 ' HA ' HD21 ' A' ' 106' ' ' LEU . 67.8 tp -67.56 -48.54 66.63 Favored 'General case' 0 N--CA 1.506 2.364 0 C-N-CA 119.16 -1.016 . . . . 0.0 108.511 179.014 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 63.9 mt -58.52 -40.0 77.26 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.473 0 O-C-N 121.112 -0.993 . . . . 0.0 108.628 178.464 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.91 -39.23 91.3 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.18 -0.95 . . . . 0.0 109.459 178.803 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.411 ' HB3' ' CD2' ' A' ' 103' ' ' LEU . 5.8 mmtt -59.0 -45.4 90.77 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.051 -1.031 . . . . 0.0 109.423 179.523 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.498 ' CD1' HD23 ' A' ' 103' ' ' LEU . 8.2 m0 -64.53 -41.93 96.07 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.45 -0.9 . . . . 0.0 109.718 179.639 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 3.0 mtp85 -65.27 -31.73 73.03 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.319 -0.863 . . . . 0.0 110.595 179.58 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 3.1 mmtp -54.26 -177.17 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.668 0 O-C-N 121.018 -1.051 . . . . 0.0 110.524 179.934 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.71 133.3 52.32 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.181 -0.949 . . . . 0.0 109.838 179.405 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.23 4.16 55.3 Favored Glycine 0 N--CA 1.493 2.458 0 C-N-CA 120.149 -1.024 . . . . 0.0 111.184 -179.488 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -110.29 46.86 1.0 Allowed 'General case' 0 N--CA 1.497 1.924 0 CA-C-N 119.658 1.729 . . . . 0.0 110.048 179.696 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -60.85 -39.74 90.25 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.171 -0.956 . . . . 0.0 109.829 179.835 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -116.01 101.89 9.16 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.3 -0.875 . . . . 0.0 109.899 179.906 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.699 HD11 ' O ' ' A' ' 105' ' ' CYS . 1.2 tp -137.98 139.82 39.89 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.247 -0.908 . . . . 0.0 109.452 -179.372 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.681 ' N ' HD12 ' A' ' 103' ' ' LEU . 29.4 p -112.36 -37.76 4.89 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.148 -0.97 . . . . 0.0 112.765 -179.521 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 105' ' ' CYS . . . . . 0.699 ' O ' HD11 ' A' ' 103' ' ' LEU . 6.4 m -142.57 -169.43 2.98 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 120.209 -1.557 . . . . 0.0 110.361 179.292 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.903 HD13 HD23 ' A' ' 90' ' ' LEU . 18.0 mt -96.69 -38.76 9.79 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.103 -0.998 . . . . 0.0 110.28 179.124 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 8.1 ttm180 -101.03 29.2 4.76 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 120.944 -1.098 . . . . 0.0 109.883 178.012 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.654 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.299 1.8 t -126.64 14.35 7.55 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.052 -1.03 . . . . 0.0 109.344 -179.429 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.576 ' CD1' HD13 ' A' ' 103' ' ' LEU . 1.0 OUTLIER -160.07 37.88 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.386 0 O-C-N 120.826 -1.171 . . . . 0.0 110.648 -178.963 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.654 ' O ' HG23 ' A' ' 119' ' ' THR . 25.8 mt-30 . . . . . 0 N--CA 1.499 1.993 0 O-C-N 120.678 -1.264 . . . . 0.0 111.552 -178.562 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.654 HG23 ' O ' ' A' ' 110' ' ' GLN . 1.7 m . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 120.779 0.323 . . . . 0.0 110.255 . . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.432 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 48.1 t -97.7 155.52 16.97 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.319 -0.863 . . . . 0.0 109.068 178.996 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.722 HG23 ' CE1' ' A' ' 142' ' ' PHE . 14.6 tt -77.49 -29.43 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.296 0 O-C-N 120.995 -1.066 . . . . 0.0 112.022 -179.257 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.475 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.3 p -54.76 -35.78 64.15 Favored 'General case' 0 N--CA 1.512 2.643 0 O-C-N 120.517 -1.365 . . . . 0.0 110.2 -179.278 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.86 -29.39 64.97 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.984 -1.072 . . . . 0.0 109.514 177.476 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.525 HG12 ' HG ' ' A' ' 129' ' ' LEU . 51.2 t -73.16 118.37 68.0 Favored Pre-proline 0 N--CA 1.507 2.403 0 O-C-N 121.1 -1.0 . . . . 0.0 110.221 179.764 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.404 ' HB3' ' CB ' ' A' ' 154' ' ' ALA . 37.7 Cg_endo -64.91 168.44 13.66 Favored 'Trans proline' 0 N--CA 1.489 1.221 0 O-C-N 123.088 1.046 . . . . 0.0 110.678 178.736 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 -74.98 -38.9 61.53 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.199 -0.938 . . . . 0.0 110.335 179.983 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.66 -40.62 83.99 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.079 -1.013 . . . . 0.0 110.078 -179.779 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -66.08 -41.65 90.43 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.167 -0.958 . . . . 0.0 109.514 179.604 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.611 ' O ' HG11 ' A' ' 140' ' ' VAL . 58.0 mt -64.15 -40.2 95.64 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.191 -0.943 . . . . 0.0 109.633 179.502 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -60.34 -39.15 86.09 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.211 -0.93 . . . . 0.0 110.126 179.955 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.75 -39.01 93.24 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.059 -1.025 . . . . 0.0 110.184 179.924 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -65.46 -40.42 93.16 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.176 -0.952 . . . . 0.0 109.881 179.879 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -66.54 -41.08 89.24 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.149 -0.969 . . . . 0.0 109.647 179.704 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.26 -33.44 73.55 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.134 -0.979 . . . . 0.0 110.185 179.493 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 22.2 mttt -79.26 -29.22 42.52 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.893 -1.129 . . . . 0.0 111.147 179.975 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 36.9 mttt -97.53 21.96 9.55 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 120.825 -1.172 . . . . 0.0 111.855 -179.941 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.18 46.42 56.72 Favored Glycine 0 N--CA 1.499 2.898 0 O-C-N 120.666 -1.271 . . . . 0.0 110.8 179.317 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 7.9 t -149.39 -164.68 2.08 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.203 -1.174 . . . . 0.0 110.404 179.987 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -134.34 162.77 31.29 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.106 -0.996 . . . . 0.0 110.346 -179.902 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.611 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.9 p -151.16 161.43 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.257 -0.902 . . . . 0.0 110.453 -179.85 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 46.5 t -170.38 110.3 0.38 Allowed 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.179 -0.951 . . . . 0.0 111.202 179.789 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 142' ' ' PHE . . . . . 0.722 ' CE1' HG23 ' A' ' 121' ' ' ILE . 86.0 t80 -105.78 158.78 16.49 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.224 -0.922 . . . . 0.0 110.601 179.741 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 21.9 t-160 -138.42 -60.07 0.62 Allowed 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.673 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -148.05 149.01 31.32 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.42 -0.8 . . . . 0.0 109.175 178.646 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . 0.454 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 25.0 p -93.46 156.1 16.96 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.007 -1.058 . . . . 0.0 111.105 -179.247 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.9 p -73.31 -25.85 21.83 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.447 0 O-C-N 121.43 -0.794 . . . . 0.0 111.679 -179.235 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -49.06 -52.5 25.18 Favored 'General case' 0 N--CA 1.516 2.853 0 O-C-N 120.816 -1.177 . . . . 0.0 110.412 -179.724 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 28.2 p -135.39 -165.02 1.62 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.227 -0.921 . . . . 0.0 110.404 179.72 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.34 61.78 0.65 Allowed Glycine 0 N--CA 1.492 2.376 0 N-CA-C 107.867 -2.093 . . . . 0.0 107.867 178.309 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.8 t -103.26 137.38 41.48 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.368 -1.077 . . . . 0.0 109.847 -179.007 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 19.1 mtp85 -96.03 52.8 1.32 Allowed 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.206 -0.934 . . . . 0.0 109.612 179.305 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.52 97.59 0.05 OUTLIER Glycine 0 N--CA 1.488 2.164 0 N-CA-C 109.947 -1.261 . . . . 0.0 109.947 179.924 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.6 p -107.9 126.0 52.15 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.246 -1.149 . . . . 0.0 110.049 179.463 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 154' ' ' ALA . . . . . 0.404 ' CB ' ' HB3' ' A' ' 125' ' ' PRO . . . -139.45 137.52 35.66 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.047 -1.033 . . . . 0.0 109.924 -179.374 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.497 1.916 0 O-C-N 121.124 -0.985 . . . . 0.0 110.485 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.328 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 137.9 -49.24 0.85 Allowed Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 53.1 p -120.09 151.86 53.55 Favored Pre-proline 0 N--CA 1.494 1.746 0 O-C-N 121.152 -1.205 . . . . 0.0 110.208 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.73 168.36 24.73 Favored 'Trans proline' 0 C--N 1.316 -1.132 0 O-C-N 123.384 1.202 . . . . 0.0 110.401 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.81 83.38 1.85 Allowed 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.181 -0.949 . . . . 0.0 110.247 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.515 HG23 ' O ' ' A' ' 4' ' ' ILE . 5.9 tp -152.9 121.88 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.239 -0.913 . . . . 0.0 110.598 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.2 mttm -145.99 91.62 2.1 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.172 -0.955 . . . . 0.0 110.391 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.0 p -129.13 162.8 26.92 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.221 -0.925 . . . . 0.0 110.236 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.4 mtp85 -119.77 121.98 40.36 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.195 -0.94 . . . . 0.0 110.228 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -133.99 152.94 52.05 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.241 -0.912 . . . . 0.0 110.3 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.4 ' OG ' ' N ' ' A' ' 10' ' ' LYS . 54.6 p -116.88 -56.6 2.25 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.19 -0.943 . . . . 0.0 110.318 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.4 ' N ' ' OG ' ' A' ' 9' ' ' SER . 66.7 mttt -116.05 151.0 46.09 Favored Pre-proline 0 N--CA 1.495 1.787 0 O-C-N 121.257 -0.902 . . . . 0.0 110.339 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.34 158.72 48.04 Favored 'Trans proline' 0 C--N 1.317 -1.103 0 O-C-N 123.407 1.214 . . . . 0.0 110.678 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.687 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -100.68 147.52 33.74 Favored Pre-proline 0 N--CA 1.501 2.095 0 O-C-N 121.411 -0.806 . . . . 0.0 109.814 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -70.58 161.73 45.01 Favored 'Trans proline' 0 C--N 1.317 -1.108 0 O-C-N 123.382 1.201 . . . . 0.0 110.81 -179.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -48.95 -31.69 7.82 Favored 'General case' 0 N--CA 1.514 2.758 0 O-C-N 121.42 -0.8 . . . . 0.0 111.384 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.71 -33.81 35.2 Favored Glycine 0 N--CA 1.499 2.855 0 O-C-N 120.925 -1.109 . . . . 0.0 110.671 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.411 ' HB2' HD11 ' A' ' 77' ' ' LEU . 25.1 t80 -55.42 -33.51 63.6 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 120.929 -1.336 . . . . 0.0 110.623 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -54.13 -36.8 63.67 Favored 'General case' 0 N--CA 1.512 2.654 0 O-C-N 121.01 -1.056 . . . . 0.0 110.331 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.4 mtpp -58.13 -36.22 72.63 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.248 -0.908 . . . . 0.0 110.261 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.848 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.9 pt -116.33 35.8 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 O-C-N 121.192 -0.942 . . . . 0.0 110.602 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.425 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 3.9 tmtt? -83.59 -43.16 0.81 Allowed Pre-proline 0 N--CA 1.508 2.451 0 O-C-N 121.04 -1.038 . . . . 0.0 113.12 -179.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.425 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.6 Cg_endo -76.24 -35.69 2.2 Favored 'Trans proline' 0 N--CA 1.486 1.061 0 O-C-N 122.582 0.78 . . . . 0.0 111.725 -178.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.912 HG21 ' CE2' ' A' ' 62' ' ' TYR . 85.3 m -59.6 -43.8 93.59 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 120.921 -1.112 . . . . 0.0 109.973 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.848 HD12 ' O ' ' A' ' 19' ' ' ILE . 7.2 mt -64.78 -39.88 94.33 Favored 'General case' 0 N--CA 1.506 2.349 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.472 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.8 m -58.23 -35.22 71.37 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.119 -0.988 . . . . 0.0 110.168 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -56.57 -35.88 68.69 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.037 -1.039 . . . . 0.0 110.383 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.61 ' CD1' HD22 ' A' ' 55' ' ' LEU . 11.7 m-85 -57.16 -38.27 73.32 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.085 -1.009 . . . . 0.0 110.578 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 55.2 mm-40 -58.64 -39.61 81.06 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.23 -0.919 . . . . 0.0 110.49 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.422 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.2 mp -65.75 -41.26 89.94 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.385 0 C-N-CA 119.187 -1.005 . . . . 0.0 108.77 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -69.18 -50.33 48.57 Favored 'General case' 0 N--CA 1.506 2.336 0 C-N-CA 119.244 -0.982 . . . . 0.0 108.534 178.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.023 HD11 HG23 ' A' ' 52' ' ' ILE . 3.1 tp -59.73 -35.29 74.25 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.254 -0.904 . . . . 0.0 109.453 178.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.63 -37.32 73.12 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.035 -1.041 . . . . 0.0 110.352 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -62.92 -51.61 66.28 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.201 -1.0 . . . . 0.0 109.588 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.437 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -69.76 -41.2 75.49 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 119.029 -1.069 . . . . 0.0 108.726 178.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -62.5 -34.85 77.69 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.242 -0.911 . . . . 0.0 109.868 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.8 mmtm -70.44 -38.68 74.56 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 120.984 -1.072 . . . . 0.0 110.183 179.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.04 -38.96 77.23 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.16 -0.962 . . . . 0.0 110.107 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.28 -36.31 68.46 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.122 -0.986 . . . . 0.0 110.643 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 54.7 p -95.18 -38.27 10.66 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.063 -1.023 . . . . 0.0 110.495 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 82.7 p -113.13 143.02 45.07 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.106 -0.996 . . . . 0.0 110.227 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.2 mtpt 52.89 95.17 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.045 -1.035 . . . . 0.0 110.795 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -142.45 64.42 1.38 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.165 -0.959 . . . . 0.0 110.312 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -114.95 -56.0 2.42 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.141 -0.974 . . . . 0.0 110.224 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -115.55 159.54 21.13 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.193 -0.942 . . . . 0.0 110.175 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 29.6 mttt 52.87 74.79 0.27 Allowed 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.036 -1.04 . . . . 0.0 110.703 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -113.05 -54.48 2.62 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.171 -0.956 . . . . 0.0 110.423 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.431 ' HB3' ' CZ2' ' A' ' 50' ' ' TRP . 5.3 m-20 -56.65 -39.66 74.08 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.194 -0.941 . . . . 0.0 109.989 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -60.1 -38.08 81.88 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.26 -0.9 . . . . 0.0 109.922 179.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.42 ' HG2' ' CB ' ' A' ' 33' ' ' ALA . 0.3 OUTLIER -60.02 -45.87 91.36 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.086 -1.008 . . . . 0.0 109.656 179.727 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.44 HD23 ' HA ' ' A' ' 49' ' ' LEU . 30.3 mt -65.39 -36.72 84.84 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.391 -0.924 . . . . 0.0 110.146 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.503 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.0 m0 -59.1 -38.57 79.85 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.058 -1.026 . . . . 0.0 109.635 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -63.01 -31.95 73.2 Favored 'General case' 0 N--CA 1.503 2.221 0 C-N-CA 119.097 -1.041 . . . . 0.0 109.464 178.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 1.023 HG23 HD11 ' A' ' 30' ' ' LEU . 11.3 mt -71.61 -58.55 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.184 0 O-C-N 121.0 -1.062 . . . . 0.0 109.111 179.205 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.7 ptm -59.87 -28.33 67.44 Favored 'General case' 0 N--CA 1.509 2.484 0 C-N-CA 118.601 -1.239 . . . . 0.0 109.988 178.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -69.24 -37.93 78.21 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.826 -1.171 . . . . 0.0 109.153 178.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.61 HD22 ' CD1' ' A' ' 26' ' ' PHE . 11.0 mt -53.66 -33.28 54.71 Favored 'General case' 0 N--CA 1.512 2.654 0 O-C-N 120.956 -1.09 . . . . 0.0 110.098 179.059 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.44 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 13.7 t60 -54.87 -36.27 64.93 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.082 -1.011 . . . . 0.0 110.137 179.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.435 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 8.0 m170 -59.64 -49.33 78.17 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.029 -1.045 . . . . 0.0 109.381 179.303 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -58.48 -34.46 70.91 Favored 'General case' 0 N--CA 1.507 2.421 0 C-N-CA 119.526 -0.87 . . . . 0.0 109.729 179.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.435 ' HG2' ' CE1' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -64.18 -50.58 67.58 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.068 -1.02 . . . . 0.0 109.545 179.363 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 87.9 p -63.49 -39.67 95.06 Favored 'General case' 0 N--CA 1.504 2.237 0 C-N-CA 119.25 -0.98 . . . . 0.0 109.296 179.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 18.9 ttt85 -63.99 -39.24 93.67 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 119.255 -0.978 . . . . 0.0 109.264 178.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.912 ' CE2' HG21 ' A' ' 22' ' ' THR . 40.4 t80 -63.49 -52.28 61.96 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.175 -0.953 . . . . 0.0 109.416 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.96 HD12 ' HB2' ' A' ' 87' ' ' ALA . 77.5 mt -70.2 -36.71 68.88 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 C-N-CA 119.163 -1.015 . . . . 0.0 109.34 179.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.41 ' HD2' HD13 ' A' ' 92' ' ' ILE . 13.0 t80 -66.83 -43.08 84.66 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.057 -1.027 . . . . 0.0 108.907 179.001 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.406 ' HA ' ' CD ' ' A' ' 69' ' ' LYS . 90.0 m -61.35 -40.46 94.36 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.132 -0.98 . . . . 0.0 110.475 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.576 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.05 -33.32 26.47 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 120.921 -1.112 . . . . 0.0 112.353 -178.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.502 ' N ' HD12 ' A' ' 66' ' ' LEU . 46.9 t80 -86.35 -32.16 21.13 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 120.64 -1.288 . . . . 0.0 111.807 -179.413 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -98.26 -19.32 17.9 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.817 -1.177 . . . . 0.0 112.645 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.406 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 9.1 mtpt -120.35 -59.28 1.79 Allowed 'General case' 0 N--CA 1.502 2.135 0 O-C-N 120.488 -1.382 . . . . 0.0 110.704 179.666 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.406 ' HB3' ' HA ' ' A' ' 66' ' ' LEU . 3.0 ttt85 -62.67 -30.83 71.68 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.164 -0.96 . . . . 0.0 110.837 -179.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 56.86 42.16 26.89 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 120.77 -1.207 . . . . 0.0 109.994 -179.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.66 35.4 3.87 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.38 -0.825 . . . . 0.0 109.991 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.676 HG13 HD23 ' A' ' 77' ' ' LEU . 14.3 tt -153.73 162.6 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.199 -0.938 . . . . 0.0 109.909 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -108.73 146.76 33.02 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.102 -0.999 . . . . 0.0 110.298 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -46.04 -32.11 2.66 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.341 -0.849 . . . . 0.0 111.586 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 38.4 m-20 -61.65 -49.95 74.47 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 120.895 -1.128 . . . . 0.0 109.352 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.676 HD23 HG13 ' A' ' 73' ' ' ILE . 28.9 tp -67.9 -44.28 77.31 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.16 -1.016 . . . . 0.0 108.408 178.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.55 ' HA ' HD12 ' A' ' 81' ' ' LEU . 18.3 t80 -60.03 -37.88 81.05 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.326 -0.859 . . . . 0.0 109.393 179.037 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -74.14 -42.66 59.61 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.154 -0.966 . . . . 0.0 108.695 178.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.687 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 77.7 t90 -57.43 -36.37 71.27 Favored 'General case' 0 N--CA 1.51 2.557 0 O-C-N 121.278 -0.889 . . . . 0.0 109.716 178.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.55 HD12 ' HA ' ' A' ' 78' ' ' TYR . 12.1 mt -69.92 -48.7 57.51 Favored 'General case' 0 N--CA 1.505 2.308 0 O-C-N 121.163 -0.961 . . . . 0.0 108.858 179.079 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.403 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 33.8 mm -56.9 -32.27 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.629 0 O-C-N 121.259 -0.901 . . . . 0.0 110.11 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.8 tmtt? -89.23 -17.9 28.13 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 120.958 -1.089 . . . . 0.0 112.074 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.443 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 21.3 mm-40 -103.68 21.71 15.69 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 120.645 -1.284 . . . . 0.0 112.087 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.7 tttp 74.6 75.07 0.11 Allowed 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.108 -0.995 . . . . 0.0 111.729 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.509 ' HB3' HD11 ' A' ' 63' ' ' ILE . 33.6 m-85 -135.94 -63.42 0.65 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.458 -0.776 . . . . 0.0 109.334 179.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.96 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -123.05 -171.23 2.25 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.401 -0.812 . . . . 0.0 109.276 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.462 ' OD1' HD11 ' A' ' 106' ' ' LEU . 5.5 t0 -131.09 120.25 23.13 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.086 -1.009 . . . . 0.0 110.522 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 10.8 mmtp -77.34 -39.84 46.23 Favored 'General case' 0 N--CA 1.505 2.306 0 C-N-CA 119.528 -0.869 . . . . 0.0 109.649 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 33.0 tp -60.64 -39.96 90.23 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.196 -0.94 . . . . 0.0 109.74 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.792 ' HA ' HD21 ' A' ' 106' ' ' LEU . 60.5 tp -69.85 -49.92 47.73 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.101 -0.999 . . . . 0.0 108.788 179.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.411 HG22 ' HD2' ' A' ' 96' ' ' ARG . 58.1 mt -58.87 -32.35 47.0 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.392 0 C-N-CA 119.361 -0.936 . . . . 0.0 108.993 178.25 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.04 -44.03 70.06 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 120.962 -1.087 . . . . 0.0 109.358 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.49 ' HD3' HD23 ' A' ' 106' ' ' LEU . 5.1 mttp -58.21 -39.14 78.24 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.099 -1.001 . . . . 0.0 110.106 179.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.0 m0 -69.09 -39.77 78.81 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.109 -0.995 . . . . 0.0 109.767 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.411 ' HD2' HG22 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -67.84 -33.95 75.75 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.245 -0.91 . . . . 0.0 110.349 179.494 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 10.3 mmtm -54.17 -177.18 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.679 0 O-C-N 121.081 -1.012 . . . . 0.0 110.526 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.96 131.75 53.69 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.217 -0.927 . . . . 0.0 109.614 179.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 101.44 1.91 53.58 Favored Glycine 0 N--CA 1.492 2.398 0 C-N-CA 120.066 -1.064 . . . . 0.0 111.192 -179.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 41.2 m-85 -105.64 64.03 0.69 Allowed 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 119.595 1.698 . . . . 0.0 109.903 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -88.82 -36.57 15.97 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.102 -0.998 . . . . 0.0 110.121 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -108.23 71.24 0.79 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.153 -0.967 . . . . 0.0 109.786 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.855 HD13 HD13 ' A' ' 109' ' ' ILE . 7.2 tp -117.84 133.08 56.28 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.223 -0.923 . . . . 0.0 109.627 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.435 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.3 p -109.72 -37.44 5.66 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.242 -0.911 . . . . 0.0 112.361 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.757 ' O ' HD11 ' A' ' 103' ' ' LEU . 6.6 m -141.04 -169.06 2.75 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.217 -1.552 . . . . 0.0 110.1 178.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.792 HD21 ' HA ' ' A' ' 91' ' ' LEU . 27.9 mt -97.34 -38.07 9.79 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.186 -0.946 . . . . 0.0 110.282 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 8.7 ttt-85 -101.15 30.06 4.34 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 120.966 -1.084 . . . . 0.0 109.734 177.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.667 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.3 1.7 t -126.56 15.07 7.63 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.07 -1.019 . . . . 0.0 108.995 -179.375 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.855 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -159.07 37.26 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.404 0 O-C-N 120.788 -1.195 . . . . 0.0 110.759 -179.015 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.619 ' C ' HG23 ' A' ' 119' ' ' THR . 10.6 mm100 -125.44 137.28 53.98 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 120.643 -1.286 . . . . 0.0 111.767 -178.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.532 ' HA ' ' HG1' ' A' ' 119' ' ' THR . 17.6 ptpt -131.54 155.87 46.72 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.284 -0.885 . . . . 0.0 110.124 179.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 63.8 m-20 -127.88 166.34 18.46 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.182 -0.949 . . . . 0.0 110.234 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 72.5 mt-10 -138.77 39.89 2.18 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.213 -0.93 . . . . 0.0 110.272 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 1.3 m -118.93 -57.07 2.06 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.198 -0.938 . . . . 0.0 110.297 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 12.7 m-20 -121.19 -58.04 1.82 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.147 -0.97 . . . . 0.0 110.255 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 47.5 p30 -132.27 179.12 6.31 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.211 -0.93 . . . . 0.0 110.268 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -120.43 119.82 4.32 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 2.8 m -116.81 76.56 1.04 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.249 -1.147 . . . . 0.0 110.07 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.619 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.1 m -126.23 173.62 9.14 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.208 -0.932 . . . . 0.0 110.321 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.425 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 47.9 t -105.37 155.37 19.18 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.395 -0.816 . . . . 0.0 109.385 179.123 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.812 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -71.41 -35.94 59.05 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.344 0 O-C-N 121.113 -0.992 . . . . 0.0 110.801 -179.471 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.436 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.3 p -55.59 -34.27 64.67 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 120.8 -1.187 . . . . 0.0 110.929 -179.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -35.83 78.17 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 120.957 -1.09 . . . . 0.0 109.607 178.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.2 t -77.63 124.98 86.54 Favored Pre-proline 0 N--CA 1.505 2.291 0 O-C-N 121.167 -0.958 . . . . 0.0 109.952 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.618 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.0 Cg_endo -64.94 178.92 1.61 Allowed 'Trans proline' 0 N--CA 1.489 1.237 0 O-C-N 123.176 1.093 . . . . 0.0 110.718 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -75.01 -36.96 61.93 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.287 -0.883 . . . . 0.0 110.627 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.61 -41.57 81.52 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 120.985 -1.072 . . . . 0.0 109.886 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -70.1 -41.19 74.35 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.338 -0.945 . . . . 0.0 108.966 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.618 HD12 ' O ' ' A' ' 125' ' ' PRO . 4.2 mt -64.94 -39.3 93.3 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.27 -0.894 . . . . 0.0 109.465 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -60.41 -40.0 89.41 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.134 -0.979 . . . . 0.0 109.806 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -59.29 -37.67 78.28 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.152 -0.968 . . . . 0.0 110.251 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -59.37 -41.69 89.91 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.178 -0.951 . . . . 0.0 110.042 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.647 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -62.75 -48.23 80.09 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.192 -0.943 . . . . 0.0 109.614 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 1.1 ttt-85 -60.82 -37.1 80.85 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.211 -0.931 . . . . 0.0 110.067 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 33.4 mmtm -67.96 -34.12 75.96 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.103 -0.998 . . . . 0.0 110.781 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 18.4 mtmt -102.82 23.28 12.37 Favored 'General case' 0 N--CA 1.502 2.165 0 O-C-N 120.925 -1.109 . . . . 0.0 111.718 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.53 46.5 53.11 Favored Glycine 0 N--CA 1.499 2.866 0 O-C-N 120.715 -1.24 . . . . 0.0 110.851 179.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.647 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 9.2 t -147.18 -167.7 2.85 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.132 -1.216 . . . . 0.0 110.433 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -123.81 174.61 7.41 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.239 -0.913 . . . . 0.0 110.317 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.6 p -157.35 159.81 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.253 -0.904 . . . . 0.0 110.855 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 29.6 t -170.24 85.95 0.12 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.243 -0.911 . . . . 0.0 110.924 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.787 ' CG ' HD12 ' A' ' 121' ' ' ILE . 47.1 t80 -97.85 161.5 13.71 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.197 -0.939 . . . . 0.0 110.612 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 13.3 m80 -140.63 -61.08 0.5 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.521 -0.737 . . . . 0.0 109.104 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.7 151.48 51.1 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.413 -0.805 . . . . 0.0 109.037 178.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 29.2 p -95.79 153.26 17.83 Favored 'General case' 0 N--CA 1.503 2.203 0 C-N-CA 119.163 -1.015 . . . . 0.0 111.102 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.4 m -72.08 -25.7 24.07 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 O-C-N 121.44 -0.787 . . . . 0.0 111.563 -179.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -50.08 -60.41 2.97 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 120.868 -1.145 . . . . 0.0 110.219 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.503 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 25.0 p -125.83 -165.93 1.49 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.295 -0.878 . . . . 0.0 110.574 179.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -98.59 59.09 0.93 Allowed Glycine 0 N--CA 1.492 2.373 0 N-CA-C 108.16 -1.976 . . . . 0.0 108.16 178.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.7 t -103.84 143.97 32.13 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.316 -1.108 . . . . 0.0 109.931 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 14.0 ttt-85 -98.67 49.78 0.98 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.289 -0.882 . . . . 0.0 109.545 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.25 97.57 0.05 OUTLIER Glycine 0 N--CA 1.488 2.105 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.7 p -109.51 123.79 49.99 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.293 -1.122 . . . . 0.0 110.221 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -140.02 121.56 15.18 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.108 -0.995 . . . . 0.0 109.605 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -88.75 -38.41 14.72 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.121 -0.987 . . . . 0.0 110.419 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.53 -40.62 79.21 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 121.046 -1.034 . . . . 0.0 110.317 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 . . . . . 0 N--CA 1.497 1.882 0 CA-C-O 118.005 -0.997 . . . . 0.0 110.497 179.982 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.308 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 119.76 -148.87 17.97 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -123.92 87.23 53.13 Favored Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.139 -1.212 . . . . 0.0 110.205 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.56 -40.2 2.26 Favored 'Trans proline' 0 C--N 1.318 -1.059 0 O-C-N 123.419 1.22 . . . . 0.0 110.487 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 12.7 ttt180 -127.27 -59.83 1.22 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.273 -0.892 . . . . 0.0 110.225 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.2 tp -145.26 148.69 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.334 -0.853 . . . . 0.0 110.267 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.2 ttpt -129.49 130.18 45.5 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.237 -0.915 . . . . 0.0 110.145 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.9 p -127.51 127.81 44.62 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.192 -0.942 . . . . 0.0 110.2 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -137.49 99.43 3.95 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.211 -0.931 . . . . 0.0 110.224 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 18.9 ttm-85 -144.32 -58.82 0.38 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.25 -0.906 . . . . 0.0 110.392 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.3 p -115.31 -165.17 1.0 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.269 -0.894 . . . . 0.0 110.062 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.9 mtmt -114.13 162.14 24.58 Favored Pre-proline 0 N--CA 1.496 1.851 0 O-C-N 121.168 -0.957 . . . . 0.0 110.269 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.97 158.89 49.08 Favored 'Trans proline' 0 C--N 1.316 -1.163 0 O-C-N 123.411 1.216 . . . . 0.0 110.661 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.718 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -90.37 146.87 35.43 Favored Pre-proline 0 N--CA 1.503 2.197 0 O-C-N 121.429 -0.794 . . . . 0.0 109.736 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.407 ' HG2' HD13 ' A' ' 77' ' ' LEU . 45.6 Cg_endo -70.7 162.77 41.37 Favored 'Trans proline' 0 C--N 1.317 -1.109 0 O-C-N 123.405 1.213 . . . . 0.0 110.879 -179.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -48.64 -31.88 7.39 Favored 'General case' 0 N--CA 1.514 2.764 0 O-C-N 121.443 -0.785 . . . . 0.0 111.375 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.03 -35.14 40.22 Favored Glycine 0 N--CA 1.5 2.931 0 O-C-N 121.046 -1.034 . . . . 0.0 110.542 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -56.03 -32.93 64.47 Favored 'General case' 0 N--CA 1.511 2.621 0 O-C-N 120.973 -1.31 . . . . 0.0 110.554 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -54.61 -38.5 66.87 Favored 'General case' 0 N--CA 1.511 2.62 0 O-C-N 120.98 -1.075 . . . . 0.0 110.123 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.0 mtmt -58.64 -37.44 75.93 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.315 -0.866 . . . . 0.0 110.087 179.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.712 HD12 ' CD1' ' A' ' 23' ' ' LEU . 2.1 pt -114.86 34.79 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.152 -0.967 . . . . 0.0 110.452 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.5 OUTLIER -83.57 -43.79 0.81 Allowed Pre-proline 0 N--CA 1.509 2.48 0 O-C-N 121.052 -1.03 . . . . 0.0 113.12 -179.177 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.2 Cg_endo -76.13 -36.96 1.67 Allowed 'Trans proline' 0 N--CA 1.486 1.079 0 O-C-N 122.712 0.849 . . . . 0.0 111.455 -178.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.782 HG21 ' CE2' ' A' ' 62' ' ' TYR . 62.7 m -60.39 -44.24 95.84 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.004 -1.06 . . . . 0.0 109.972 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.712 ' CD1' HD12 ' A' ' 19' ' ' ILE . 3.3 mt -65.25 -40.06 93.51 Favored 'General case' 0 N--CA 1.506 2.327 0 C-N-CA 119.411 -0.916 . . . . 0.0 109.453 179.318 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 47.9 m -57.93 -35.51 71.19 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.25 -0.906 . . . . 0.0 110.1 179.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.59 -36.92 69.94 Favored 'General case' 0 N--CA 1.511 2.606 0 O-C-N 121.05 -1.031 . . . . 0.0 110.252 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.73 ' CD2' HD22 ' A' ' 55' ' ' LEU . 14.9 m-85 -58.57 -39.47 80.41 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.094 -1.004 . . . . 0.0 110.457 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -59.89 -38.74 83.09 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.073 -1.017 . . . . 0.0 110.662 -179.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.418 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.2 mp -66.7 -40.27 85.7 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.412 0 C-N-CA 119.196 -1.001 . . . . 0.0 109.241 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.6 tp60 -69.58 -46.5 66.21 Favored 'General case' 0 N--CA 1.506 2.342 0 C-N-CA 119.211 -0.996 . . . . 0.0 108.821 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.739 HD21 HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -64.21 -35.28 80.28 Favored 'General case' 0 N--CA 1.508 2.469 0 C-N-CA 119.283 -0.967 . . . . 0.0 108.923 178.359 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.31 -40.04 77.05 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 120.959 -1.088 . . . . 0.0 110.075 179.338 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -62.58 -50.24 72.08 Favored 'General case' 0 N--CA 1.507 2.392 0 C-N-CA 119.262 -0.975 . . . . 0.0 109.37 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.606 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -65.9 -41.5 91.4 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.38 -0.928 . . . . 0.0 109.088 179.002 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.441 ' CG ' HD23 ' A' ' 30' ' ' LEU . 10.1 mm-40 -63.18 -34.99 78.84 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.22 -0.925 . . . . 0.0 110.03 179.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.6 mtpt -84.1 -37.09 22.46 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.998 -1.064 . . . . 0.0 110.318 179.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -57.86 -38.62 76.02 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.044 -1.035 . . . . 0.0 110.032 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 13.9 tptt -55.46 -36.85 67.02 Favored 'General case' 0 N--CA 1.512 2.634 0 O-C-N 121.1 -1.0 . . . . 0.0 110.348 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.6 p -103.64 39.96 1.51 Allowed 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.171 -0.955 . . . . 0.0 110.03 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.3 t -143.36 -60.15 0.42 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.259 -0.901 . . . . 0.0 109.926 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -113.93 105.1 12.84 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.285 -0.884 . . . . 0.0 109.686 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.1 tp -113.12 50.87 0.86 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.139 -0.976 . . . . 0.0 110.405 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -115.93 -56.42 2.32 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.184 -0.948 . . . . 0.0 110.135 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -144.37 163.23 34.35 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.182 -0.949 . . . . 0.0 110.408 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm 52.8 53.35 12.27 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.132 -0.98 . . . . 0.0 111.011 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.6 p -110.31 -52.29 2.79 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.052 -1.03 . . . . 0.0 110.491 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -55.31 -37.19 67.04 Favored 'General case' 0 N--CA 1.511 2.6 0 O-C-N 121.153 -0.967 . . . . 0.0 110.172 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -59.05 -39.48 82.17 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.142 -0.974 . . . . 0.0 110.042 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 50.1 tp60 -61.6 -41.23 97.15 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.119 -0.988 . . . . 0.0 109.888 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 49' ' ' LEU . 12.6 mt -59.46 -38.36 80.55 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.273 -0.892 . . . . 0.0 110.319 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.507 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.5 m0 -59.91 -36.79 77.74 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.165 -0.96 . . . . 0.0 110.174 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -60.36 -30.33 69.49 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.065 -1.022 . . . . 0.0 110.126 178.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.739 HG23 HD21 ' A' ' 30' ' ' LEU . 75.0 mt -72.33 -58.68 4.53 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.276 0 O-C-N 120.879 -1.138 . . . . 0.0 109.209 179.253 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 ptm -61.55 -29.55 70.08 Favored 'General case' 0 N--CA 1.508 2.465 0 C-N-CA 118.504 -1.278 . . . . 0.0 109.683 178.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 -68.85 -37.25 79.0 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.79 -1.194 . . . . 0.0 109.063 178.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.73 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.1 mt -53.02 -32.19 45.33 Favored 'General case' 0 N--CA 1.512 2.659 0 O-C-N 121.045 -1.035 . . . . 0.0 110.155 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.464 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 66.0 t60 -54.63 -38.06 66.4 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.062 -1.024 . . . . 0.0 110.072 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.45 ' CD2' HD21 ' A' ' 91' ' ' LEU . 5.5 m170 -61.35 -51.19 69.86 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.17 -0.956 . . . . 0.0 109.362 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -59.38 -33.98 71.87 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 119.474 -0.89 . . . . 0.0 109.668 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.461 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -68.18 -50.2 55.91 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.067 -1.021 . . . . 0.0 109.191 179.15 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 77.3 p -63.38 -38.44 91.16 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.093 -1.004 . . . . 0.0 109.154 178.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 10.4 ttm-85 -64.28 -39.86 94.79 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.165 -0.96 . . . . 0.0 109.184 178.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.782 ' CE2' HG21 ' A' ' 22' ' ' THR . 37.8 t80 -62.85 -51.26 67.73 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.113 -0.992 . . . . 0.0 109.292 179.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.803 HD12 ' HB2' ' A' ' 87' ' ' ALA . 77.5 mt -69.65 -38.99 77.65 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 O-C-N 121.257 -0.902 . . . . 0.0 109.179 179.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.41 ' HD2' HD13 ' A' ' 92' ' ' ILE . 11.8 t80 -65.48 -43.25 90.83 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.195 -0.941 . . . . 0.0 109.05 179.154 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.409 ' HA ' ' CD ' ' A' ' 69' ' ' LYS . 88.2 m -61.04 -41.26 96.25 Favored 'General case' 0 N--CA 1.503 2.186 0 C-N-CA 119.331 -0.948 . . . . 0.0 110.546 -179.501 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.582 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.22 -33.35 26.13 Favored 'General case' 0 N--CA 1.504 2.245 0 C-N-CA 118.926 -1.11 . . . . 0.0 112.52 -178.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.496 ' N ' HD12 ' A' ' 66' ' ' LEU . 52.0 t80 -86.33 -32.7 20.87 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 120.738 -1.226 . . . . 0.0 111.779 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -98.26 -15.74 19.69 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.752 -1.217 . . . . 0.0 112.759 -178.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.409 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 8.2 mtpt -124.88 -59.38 1.43 Allowed 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.394 -1.441 . . . . 0.0 110.778 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.404 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 4.5 ttp85 -62.43 -30.59 71.33 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.153 -0.967 . . . . 0.0 110.829 -179.558 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.4 tttp 57.68 42.49 23.72 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 120.816 -1.178 . . . . 0.0 110.073 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.82 36.3 3.71 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.404 -0.81 . . . . 0.0 109.82 179.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.761 HG13 HD23 ' A' ' 77' ' ' LEU . 14.2 tt -154.53 162.7 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.126 -0.984 . . . . 0.0 110.011 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 73.3 m -109.8 146.81 34.38 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.174 -0.954 . . . . 0.0 110.065 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -45.25 -32.45 1.94 Allowed 'General case' 0 N--CA 1.515 2.819 0 O-C-N 121.323 -0.861 . . . . 0.0 111.7 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -61.88 -50.63 71.45 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.956 -1.09 . . . . 0.0 109.374 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.761 HD23 HG13 ' A' ' 73' ' ' ILE . 30.6 tp -66.98 -43.75 82.21 Favored 'General case' 0 N--CA 1.505 2.296 0 C-N-CA 119.155 -1.018 . . . . 0.0 108.584 178.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.473 ' HA ' HD12 ' A' ' 81' ' ' LEU . 15.7 t80 -60.78 -38.38 85.07 Favored 'General case' 0 N--CA 1.506 2.344 0 C-N-CA 119.645 -0.822 . . . . 0.0 109.317 178.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.493 ' O ' HG22 ' A' ' 82' ' ' ILE . 20.1 t0 -74.63 -41.19 60.82 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.136 -0.977 . . . . 0.0 108.892 178.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.718 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 86.6 t90 -59.13 -39.14 81.41 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.184 -0.947 . . . . 0.0 109.259 178.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.473 HD12 ' HA ' ' A' ' 78' ' ' TYR . 14.8 mt -65.61 -54.75 23.4 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.211 -0.93 . . . . 0.0 109.223 179.072 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.578 HD12 ' HB3' ' A' ' 87' ' ' ALA . 0.7 OUTLIER -55.9 -27.63 22.94 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.423 0 O-C-N 121.123 -0.986 . . . . 0.0 110.701 -179.745 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.2 tttm -88.2 -19.46 26.86 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 120.899 -1.126 . . . . 0.0 111.628 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.446 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 77.0 mm-40 -102.77 23.74 11.65 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 120.623 -1.298 . . . . 0.0 111.843 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.41 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 15.6 tttt 76.34 69.57 0.07 Allowed 'General case' 0 N--CA 1.513 2.696 0 O-C-N 121.175 -0.953 . . . . 0.0 111.916 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.57 ' HE2' HD13 ' A' ' 23' ' ' LEU . 28.3 m-85 -132.04 -63.1 0.82 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.467 -0.771 . . . . 0.0 109.134 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.803 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -131.2 167.43 19.17 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.477 -0.764 . . . . 0.0 109.464 179.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.464 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 24.2 t70 -120.35 121.1 37.86 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.091 -1.006 . . . . 0.0 110.599 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 29.5 mtpt -67.75 -35.39 78.64 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 121.304 -0.873 . . . . 0.0 110.227 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.726 HD23 HD13 ' A' ' 106' ' ' LEU . 25.7 tp -58.56 -40.87 84.3 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.017 -1.052 . . . . 0.0 109.965 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.462 ' HA ' HD21 ' A' ' 106' ' ' LEU . 58.5 tp -70.58 -50.62 35.41 Favored 'General case' 0 N--CA 1.506 2.343 0 C-N-CA 119.185 -1.006 . . . . 0.0 108.652 179.145 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.41 HD13 ' HD2' ' A' ' 64' ' ' TYR . 63.2 mt -58.45 -34.83 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.457 0 C-N-CA 119.209 -0.996 . . . . 0.0 108.823 178.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.95 -39.51 87.29 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.049 -1.032 . . . . 0.0 109.135 178.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.424 ' HD2' ' CE1' ' A' ' 100' ' ' TYR . 4.9 mmtt -57.27 -44.66 84.17 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.098 -1.001 . . . . 0.0 109.174 179.176 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.3 m0 -63.41 -35.41 80.33 Favored 'General case' 0 N--CA 1.509 2.477 0 C-N-CA 119.562 -0.855 . . . . 0.0 110.1 179.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.01 -32.53 45.15 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.087 -1.008 . . . . 0.0 110.723 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.5 mmtt -53.69 -176.91 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.714 0 O-C-N 120.989 -1.069 . . . . 0.0 110.715 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.2 m -102.91 135.07 45.27 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.099 -1.001 . . . . 0.0 109.711 179.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.03 11.71 54.07 Favored Glycine 0 N--CA 1.494 2.524 0 C-N-CA 120.183 -1.008 . . . . 0.0 111.056 -179.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.585 ' HB3' HD23 ' A' ' 103' ' ' LEU . 50.4 m-85 -119.97 71.94 0.91 Allowed 'General case' 0 N--CA 1.492 1.641 0 CA-C-N 119.41 1.605 . . . . 0.0 109.823 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -97.37 -34.24 11.12 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.192 -0.942 . . . . 0.0 111.18 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.1 63.4 1.15 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.974 -1.079 . . . . 0.0 111.044 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.585 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.1 pp -111.57 152.98 26.95 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.0 -1.062 . . . . 0.0 109.67 179.182 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.429 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.8 p -113.17 -30.28 7.01 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.156 -0.965 . . . . 0.0 113.463 -179.138 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.634 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.9 m -143.47 -169.03 2.97 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 120.161 -1.587 . . . . 0.0 110.175 179.372 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.726 HD13 HD23 ' A' ' 90' ' ' LEU . 16.4 mt -95.39 -38.74 10.35 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.173 -0.954 . . . . 0.0 109.95 178.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 5.6 ttt85 -102.02 29.81 4.83 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.928 -1.108 . . . . 0.0 110.092 178.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.634 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.301 1.8 t -127.65 17.57 6.89 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.035 -1.041 . . . . 0.0 108.847 -179.564 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.461 HG23 ' C ' ' A' ' 108' ' ' CYS . 1.3 pt -158.36 38.66 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.277 0 O-C-N 120.982 -1.074 . . . . 0.0 110.216 -178.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.765 ' C ' HG23 ' A' ' 119' ' ' THR . 25.6 mt-30 -98.67 103.53 15.49 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.91 -1.119 . . . . 0.0 111.02 -178.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.428 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 7.6 ttmt -106.31 -50.04 3.23 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.263 -0.898 . . . . 0.0 110.568 179.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -111.62 -170.6 1.68 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.085 -1.01 . . . . 0.0 110.243 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 53.46 51.07 16.01 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.018 -1.051 . . . . 0.0 110.748 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -142.49 169.45 17.56 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.159 -0.963 . . . . 0.0 110.19 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -116.92 -61.69 1.68 Allowed 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.277 -0.889 . . . . 0.0 110.204 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -133.53 49.94 2.25 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.217 -0.927 . . . . 0.0 110.108 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -126.98 -161.39 10.86 Favored Glycine 0 N--CA 1.493 2.469 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.3 m -146.34 -175.72 4.89 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.24 -1.153 . . . . 0.0 110.427 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.765 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.4 m -116.11 171.19 7.96 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.192 -0.943 . . . . 0.0 110.136 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 48.7 t -94.37 154.21 17.59 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 119.401 -0.92 . . . . 0.0 108.804 178.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.953 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -74.66 -30.6 25.22 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.381 0 O-C-N 121.021 -1.05 . . . . 0.0 111.654 -178.706 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.493 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.7 p -59.46 -35.75 74.67 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 120.594 -1.316 . . . . 0.0 110.639 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.82 -31.1 64.38 Favored 'General case' 0 N--CA 1.512 2.655 0 O-C-N 120.95 -1.093 . . . . 0.0 109.998 178.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 60.7 t -82.61 124.54 77.45 Favored Pre-proline 0 N--CA 1.504 2.256 0 O-C-N 121.061 -1.024 . . . . 0.0 109.974 179.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -66.21 176.03 4.31 Favored 'Trans proline' 0 N--CA 1.489 1.242 0 O-C-N 123.172 1.09 . . . . 0.0 110.871 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.0 mmm-85 -75.15 -38.37 60.98 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.292 -0.88 . . . . 0.0 110.162 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.47 -40.01 77.63 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 121.042 -1.036 . . . . 0.0 109.994 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -68.38 -42.59 78.87 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.228 -0.92 . . . . 0.0 109.192 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.889 HD11 HD11 ' A' ' 121' ' ' ILE . 11.7 mt -65.1 -39.36 93.03 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.413 -0.915 . . . . 0.0 109.362 179.145 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -59.04 -37.96 78.19 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.116 -0.99 . . . . 0.0 110.061 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -58.34 -39.03 78.38 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 121.123 -0.986 . . . . 0.0 110.195 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -62.41 -46.93 86.35 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.268 -0.895 . . . . 0.0 109.724 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.532 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -59.21 -38.39 79.8 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.167 -0.958 . . . . 0.0 110.2 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 25.6 ttt85 -67.59 -38.97 84.79 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.19 -0.944 . . . . 0.0 110.107 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 16.9 mttp -72.01 -34.67 69.04 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.067 -1.02 . . . . 0.0 110.511 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -88.61 -19.67 25.96 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.044 -1.035 . . . . 0.0 111.626 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.38 33.36 9.45 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.532 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.6 t -133.07 -160.67 1.07 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.066 -1.256 . . . . 0.0 109.737 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -134.19 144.45 48.47 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.076 -1.015 . . . . 0.0 110.098 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.495 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.7 p -131.45 160.58 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.169 -0.957 . . . . 0.0 110.349 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 39.2 t -169.26 95.16 0.32 Allowed 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.219 -0.925 . . . . 0.0 110.928 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.953 ' CD1' HD12 ' A' ' 121' ' ' ILE . 72.9 t80 -99.25 159.88 14.68 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.273 -0.892 . . . . 0.0 110.767 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 10.1 m170 -138.43 -61.12 0.6 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -138.57 150.82 46.72 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.429 -0.794 . . . . 0.0 109.227 178.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . 0.429 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 30.6 p -93.6 154.12 18.02 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.015 -1.053 . . . . 0.0 110.941 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 19.7 m -73.55 -23.14 19.27 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.46 0 O-C-N 121.363 -0.835 . . . . 0.0 111.669 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -51.39 -62.06 1.85 Allowed 'General case' 0 N--CA 1.515 2.793 0 O-C-N 120.742 -1.224 . . . . 0.0 110.066 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.507 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 21.6 p -124.17 -163.8 1.19 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.265 -0.897 . . . . 0.0 110.385 179.543 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . 0.412 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.33 63.86 0.61 Allowed Glycine 0 N--CA 1.491 2.333 0 N-CA-C 107.997 -2.041 . . . . 0.0 107.997 178.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 34.4 t -101.09 142.41 32.59 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.289 -1.124 . . . . 0.0 109.687 -179.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -101.09 43.44 1.06 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.233 -0.917 . . . . 0.0 109.78 179.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 80.62 94.81 0.41 Allowed Glycine 0 N--CA 1.486 2.009 0 N-CA-C 109.87 -1.292 . . . . 0.0 109.87 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.8 p -107.85 123.95 49.36 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.272 -1.134 . . . . 0.0 110.205 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -143.1 141.66 31.3 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.081 -1.012 . . . . 0.0 110.089 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 1.4 m -104.51 42.39 1.21 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.167 -0.958 . . . . 0.0 109.617 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 28.0 m -159.64 -55.64 0.06 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.336 -0.853 . . . . 0.0 110.744 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 118.05 -0.976 . . . . 0.0 110.247 179.934 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.375 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 133.53 -129.11 5.25 Favored Glycine 0 N--CA 1.493 2.482 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.6 m -132.57 164.04 46.36 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.295 -1.12 . . . . 0.0 110.152 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.65 164.88 34.31 Favored 'Trans proline' 0 C--N 1.317 -1.091 0 O-C-N 123.441 1.232 . . . . 0.0 110.339 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 10.9 ttt-85 -140.97 174.23 10.72 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.198 -0.939 . . . . 0.0 110.302 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 86.4 mt -116.1 89.89 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.192 -0.942 . . . . 0.0 109.988 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -134.35 -164.2 1.47 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.157 -0.964 . . . . 0.0 110.072 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -112.4 89.33 3.04 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.184 -0.948 . . . . 0.0 110.156 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.72 94.85 2.77 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.199 -0.938 . . . . 0.0 110.073 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 4.2 tpt85 -133.36 145.5 50.42 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.152 -0.967 . . . . 0.0 110.332 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 71.3 m -125.16 154.18 41.91 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.249 -0.907 . . . . 0.0 110.028 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.5 mttt -145.25 155.46 54.33 Favored Pre-proline 0 N--CA 1.494 1.772 0 O-C-N 121.154 -0.966 . . . . 0.0 110.494 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -72.76 160.79 45.45 Favored 'Trans proline' 0 C--N 1.318 -1.078 0 O-C-N 123.499 1.263 . . . . 0.0 110.617 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.698 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -78.71 146.28 68.64 Favored Pre-proline 0 N--CA 1.506 2.365 0 O-C-N 121.365 -0.834 . . . . 0.0 109.789 179.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.26 162.12 42.51 Favored 'Trans proline' 0 C--N 1.317 -1.092 0 O-C-N 123.311 1.164 . . . . 0.0 110.794 -179.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -48.99 -31.77 8.02 Favored 'General case' 0 N--CA 1.514 2.758 0 O-C-N 121.474 -0.767 . . . . 0.0 111.339 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.53 -34.45 42.69 Favored Glycine 0 N--CA 1.5 2.909 0 O-C-N 120.987 -1.071 . . . . 0.0 110.431 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -54.65 -32.35 59.0 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 120.968 -1.313 . . . . 0.0 110.649 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -55.21 -38.95 69.09 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.012 -1.055 . . . . 0.0 110.194 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 29.5 mttt -58.2 -37.28 74.49 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.236 -0.915 . . . . 0.0 110.078 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.714 HG22 ' OH ' ' A' ' 62' ' ' TYR . 1.6 pt -114.62 34.61 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.2 -0.938 . . . . 0.0 110.323 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -84.73 -43.04 0.7 Allowed Pre-proline 0 N--CA 1.51 2.534 0 O-C-N 120.974 -1.079 . . . . 0.0 113.331 -179.024 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.1 Cg_endo -75.6 -36.66 2.1 Favored 'Trans proline' 0 N--CA 1.487 1.092 0 O-C-N 122.566 0.772 . . . . 0.0 111.583 -178.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.577 HG21 ' CE2' ' A' ' 62' ' ' TYR . 75.2 m -60.4 -43.5 96.63 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.046 -1.034 . . . . 0.0 109.936 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.666 HD12 ' O ' ' A' ' 19' ' ' ILE . 3.3 mt -64.05 -39.38 93.96 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.233 -0.917 . . . . 0.0 109.571 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.95 -37.0 75.74 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.062 -1.024 . . . . 0.0 110.15 179.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -57.38 -36.41 71.22 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.167 -0.958 . . . . 0.0 110.29 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.726 ' CD2' HD22 ' A' ' 55' ' ' LEU . 16.9 m-85 -57.43 -38.54 74.55 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.085 -1.009 . . . . 0.0 110.47 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -62.96 -22.48 66.84 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.168 -0.958 . . . . 0.0 111.854 -179.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.568 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.8 mp -81.26 -33.94 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.738 -1.226 . . . . 0.0 109.954 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -81.66 -34.59 30.68 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 120.949 -1.094 . . . . 0.0 109.438 178.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.755 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -75.83 -32.08 59.64 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.1 -1.0 . . . . 0.0 109.942 178.8 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.2 ptt85 -68.55 -34.84 76.54 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 120.874 -1.141 . . . . 0.0 109.998 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -68.15 -41.1 82.08 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.01 -1.056 . . . . 0.0 109.54 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.479 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -67.21 -43.35 82.29 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.269 -0.895 . . . . 0.0 109.325 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.6 mm100 -61.99 -38.79 89.92 Favored 'General case' 0 N--CA 1.506 2.373 0 C-N-CA 119.454 -0.898 . . . . 0.0 109.815 179.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 37.2 mmtm -62.41 -36.7 83.18 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.101 -1.0 . . . . 0.0 110.422 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -58.3 -41.25 84.03 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.059 -1.026 . . . . 0.0 110.04 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.2 mmtp -58.08 -34.02 69.71 Favored 'General case' 0 N--CA 1.511 2.582 0 O-C-N 121.235 -0.916 . . . . 0.0 110.763 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 36.6 m -96.96 -30.74 12.92 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.022 -1.049 . . . . 0.0 111.472 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.97 -46.9 6.02 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 120.92 -1.112 . . . . 0.0 110.497 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 15.8 mtpt -114.21 90.17 3.27 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.097 -1.002 . . . . 0.0 110.346 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.2 tp -116.51 58.43 0.76 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.13 -0.981 . . . . 0.0 110.182 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -135.13 -62.82 0.71 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.137 -0.977 . . . . 0.0 110.149 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -116.78 149.85 39.27 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.162 -0.961 . . . . 0.0 110.101 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.4 mtmm 52.83 55.25 9.26 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 120.956 -1.09 . . . . 0.0 110.69 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 18.7 m -105.86 -52.07 2.88 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.205 -0.935 . . . . 0.0 110.147 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -57.74 -39.62 77.75 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.2 -0.937 . . . . 0.0 109.813 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -60.05 -38.55 83.11 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.15 -0.969 . . . . 0.0 109.917 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 34.2 tp60 -59.09 -42.54 90.7 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 121.068 -1.02 . . . . 0.0 109.895 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.46 HD13 ' HA ' ' A' ' 49' ' ' LEU . 4.2 mm? -58.96 -37.93 77.9 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.224 -0.923 . . . . 0.0 109.993 179.466 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.495 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 37.5 m0 -59.95 -36.16 76.48 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.198 -0.939 . . . . 0.0 109.435 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -64.74 -33.11 75.19 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 120.696 -1.252 . . . . 0.0 109.502 178.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.755 HG23 ' CG ' ' A' ' 30' ' ' LEU . 73.4 mt -71.24 -55.17 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.315 0 O-C-N 120.981 -1.074 . . . . 0.0 109.377 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.487 ' CE ' ' HB2' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -60.56 -32.22 71.3 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 118.687 -1.205 . . . . 0.0 109.5 179.015 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.18 -41.35 96.65 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 120.856 -1.153 . . . . 0.0 108.975 178.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.726 HD22 ' CD2' ' A' ' 26' ' ' PHE . 18.2 mt -54.27 -33.76 59.34 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.242 -0.911 . . . . 0.0 109.779 178.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.447 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 13.8 t60 -56.58 -40.62 75.53 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.105 -0.997 . . . . 0.0 109.545 179.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.489 ' CD2' HD21 ' A' ' 91' ' ' LEU . 7.5 m170 -61.13 -49.84 75.61 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.212 -0.93 . . . . 0.0 108.981 178.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -60.57 -38.46 84.66 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.289 -0.882 . . . . 0.0 109.302 179.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.456 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.71 -48.98 74.91 Favored 'General case' 0 N--CA 1.507 2.381 0 C-N-CA 119.33 -0.948 . . . . 0.0 109.015 179.187 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 76.8 p -66.71 -40.43 88.45 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.159 -0.963 . . . . 0.0 108.881 178.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 39.4 ttt85 -64.17 -37.16 86.46 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.115 -0.99 . . . . 0.0 109.502 178.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.714 ' OH ' HG22 ' A' ' 19' ' ' ILE . 40.7 t80 -60.98 -49.73 76.25 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.078 -1.014 . . . . 0.0 109.332 179.473 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.951 HD12 ' HB2' ' A' ' 87' ' ' ALA . 83.9 mt -75.87 -42.75 39.82 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.32 0 O-C-N 121.207 -0.933 . . . . 0.0 109.011 179.108 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.523 ' CE1' HG23 ' A' ' 92' ' ' ILE . 34.8 t80 -59.05 -26.73 64.85 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.384 -0.822 . . . . 0.0 110.352 178.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 67.1 m -87.28 -34.69 18.82 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.787 -1.195 . . . . 0.0 110.533 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.614 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -82.9 -34.17 26.71 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 120.77 -1.207 . . . . 0.0 112.151 -179.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.548 ' N ' HD12 ' A' ' 66' ' ' LEU . 54.2 t80 -86.54 -36.65 18.82 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 120.672 -1.267 . . . . 0.0 111.873 -179.395 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -95.83 -20.58 18.71 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.901 -1.124 . . . . 0.0 112.84 -178.255 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -119.34 -58.05 1.95 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 120.574 -1.329 . . . . 0.0 111.164 -179.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.423 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -64.77 -30.48 71.49 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.004 -1.06 . . . . 0.0 110.655 -179.841 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 58.74 44.26 17.42 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 120.852 -1.155 . . . . 0.0 110.047 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -115.91 37.61 3.59 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.416 -0.802 . . . . 0.0 109.836 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.785 HG13 HD23 ' A' ' 77' ' ' LEU . 14.2 tt -156.09 162.8 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.182 -0.949 . . . . 0.0 110.118 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.3 p -108.47 147.63 31.39 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.101 -0.999 . . . . 0.0 110.102 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.4 tttp -45.9 -32.67 2.79 Favored 'General case' 0 N--CA 1.516 2.861 0 O-C-N 121.381 -0.825 . . . . 0.0 111.574 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -61.75 -49.33 76.81 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.886 -1.134 . . . . 0.0 109.467 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.785 HD23 HG13 ' A' ' 73' ' ' ILE . 50.4 tp -67.42 -44.08 79.64 Favored 'General case' 0 N--CA 1.505 2.317 0 C-N-CA 119.212 -0.995 . . . . 0.0 108.606 178.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.474 ' HA ' HD12 ' A' ' 81' ' ' LEU . 21.8 t80 -60.98 -38.48 86.1 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.304 -0.872 . . . . 0.0 109.43 178.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -73.89 -42.3 60.9 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.083 -1.011 . . . . 0.0 108.942 178.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.698 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 81.6 t90 -58.3 -37.04 74.25 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.24 -0.913 . . . . 0.0 109.667 178.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.508 HD22 ' CD2' ' A' ' 86' ' ' TYR . 13.6 mt -68.96 -48.68 62.6 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.175 -0.953 . . . . 0.0 108.981 179.209 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.459 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 32.4 mm -57.1 -30.89 35.64 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.553 0 O-C-N 121.145 -0.972 . . . . 0.0 110.1 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -87.86 -22.24 24.55 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.896 -1.128 . . . . 0.0 111.804 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.444 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 72.9 mm-40 -100.42 21.17 13.57 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 120.696 -1.253 . . . . 0.0 111.998 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt 73.56 79.42 0.13 Allowed 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.021 -1.049 . . . . 0.0 111.472 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.641 ' HE2' HD13 ' A' ' 23' ' ' LEU . 31.5 m-85 -137.35 -64.92 0.55 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.554 -0.716 . . . . 0.0 109.669 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.951 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -115.47 173.08 6.71 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.425 -0.797 . . . . 0.0 109.212 179.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.447 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 3.5 t0 -116.95 104.13 10.97 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.072 -1.017 . . . . 0.0 110.403 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.77 -39.23 84.17 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.225 -0.922 . . . . 0.0 109.857 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 18.1 tp -60.92 -40.54 93.58 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.219 -0.925 . . . . 0.0 109.947 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.587 ' HA ' HD21 ' A' ' 106' ' ' LEU . 45.5 tp -70.65 -49.06 51.43 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.266 -0.973 . . . . 0.0 108.875 179.346 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.523 HG23 ' CE1' ' A' ' 64' ' ' TYR . 49.6 mt -62.29 -32.08 53.71 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.32 0 C-N-CA 119.287 -0.965 . . . . 0.0 108.917 178.34 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -71.76 -42.08 67.64 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.02 -1.05 . . . . 0.0 109.157 178.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.496 ' HD3' HD23 ' A' ' 106' ' ' LEU . 13.0 mttp -60.73 -40.1 91.13 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.073 -1.017 . . . . 0.0 110.07 179.346 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 3.4 m0 -66.03 -38.01 87.33 Favored 'General case' 0 N--CA 1.509 2.514 0 C-N-CA 119.188 -1.005 . . . . 0.0 109.967 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.19 -35.27 63.96 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.113 -0.992 . . . . 0.0 110.179 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 17.0 mmtt -53.31 -178.82 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.671 0 O-C-N 121.124 -0.985 . . . . 0.0 110.639 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 18.4 m -107.09 142.05 37.37 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.261 -0.899 . . . . 0.0 109.438 179.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 101.98 -25.39 28.02 Favored Glycine 0 N--CA 1.494 2.508 0 C-N-CA 119.793 -1.194 . . . . 0.0 110.32 -179.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -91.71 57.88 3.34 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 120.691 -1.476 . . . . 0.0 110.111 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -70.65 -38.3 73.82 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.07 -1.019 . . . . 0.0 109.934 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.26 87.88 2.81 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.177 -0.952 . . . . 0.0 110.153 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.962 HD13 HD13 ' A' ' 109' ' ' ILE . 15.8 tp -120.35 133.01 55.52 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.187 -0.946 . . . . 0.0 109.733 -179.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.446 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.1 p -106.21 -36.03 7.01 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.175 -0.953 . . . . 0.0 112.165 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.866 ' O ' HD11 ' A' ' 103' ' ' LEU . 7.1 m -140.17 -169.11 2.68 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.26 -1.525 . . . . 0.0 109.461 178.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.587 HD21 ' HA ' ' A' ' 91' ' ' LEU . 15.3 mt -98.45 -36.1 10.05 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.064 -1.022 . . . . 0.0 110.662 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 18.3 ttm-85 -103.57 35.25 2.66 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 120.903 -1.123 . . . . 0.0 109.06 177.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.68 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.306 1.7 t -129.12 18.91 5.97 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.273 -0.892 . . . . 0.0 109.011 -178.907 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.962 HD13 HD13 ' A' ' 103' ' ' LEU . 1.3 pt -158.14 38.31 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 O-C-N 120.929 -1.107 . . . . 0.0 110.288 -178.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.576 ' C ' HG23 ' A' ' 119' ' ' THR . 11.7 tm0? -69.58 72.45 0.35 Allowed 'General case' 0 N--CA 1.509 2.525 0 O-C-N 120.878 -1.139 . . . . 0.0 110.79 -178.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.708 ' HD2' HG21 ' A' ' 119' ' ' THR . 0.2 OUTLIER -141.05 170.14 16.29 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.056 -1.027 . . . . 0.0 110.32 179.348 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -173.46 -58.8 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.307 -0.871 . . . . 0.0 110.587 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -136.12 -60.13 0.73 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.303 -0.873 . . . . 0.0 110.084 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 78.5 p -108.01 -169.74 1.57 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.27 -0.894 . . . . 0.0 109.731 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 41.9 t-20 -105.49 102.02 11.51 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.066 -1.021 . . . . 0.0 110.253 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -139.79 155.33 47.34 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.232 -0.918 . . . . 0.0 110.081 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 70.28 -142.43 35.74 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 17.9 m -128.68 119.33 24.47 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.2 -1.176 . . . . 0.0 110.281 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.708 HG21 ' HD2' ' A' ' 111' ' ' LYS . 2.8 m -114.61 169.15 9.27 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.235 -0.916 . . . . 0.0 110.139 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.447 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 48.9 t -102.4 154.98 18.56 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.241 -0.912 . . . . 0.0 109.74 179.273 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.802 HD12 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -73.39 -36.83 49.73 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.348 0 O-C-N 121.202 -0.936 . . . . 0.0 111.016 -179.422 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.44 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 6.5 p -53.35 -31.39 44.26 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 120.775 -1.203 . . . . 0.0 111.262 -178.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.73 -32.89 72.15 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 120.98 -1.075 . . . . 0.0 109.765 178.334 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 53.0 t -81.57 125.5 78.3 Favored Pre-proline 0 N--CA 1.505 2.319 0 O-C-N 121.032 -1.042 . . . . 0.0 110.075 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.522 ' O ' HD12 ' A' ' 129' ' ' LEU . 40.0 Cg_endo -67.18 175.9 5.24 Favored 'Trans proline' 0 N--CA 1.488 1.199 0 O-C-N 123.191 1.1 . . . . 0.0 110.639 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.11 -36.74 61.65 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.241 -0.912 . . . . 0.0 110.739 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.98 -41.65 83.41 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 120.946 -1.096 . . . . 0.0 110.024 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -68.16 -41.63 81.28 Favored 'General case' 0 N--CA 1.506 2.356 0 C-N-CA 119.317 -0.953 . . . . 0.0 109.221 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.523 HD11 HD11 ' A' ' 121' ' ' ILE . 2.5 mt -62.79 -39.52 94.51 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.236 -0.915 . . . . 0.0 109.669 179.235 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -59.24 -39.56 83.14 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.191 -0.943 . . . . 0.0 110.027 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -60.19 -39.26 85.89 Favored 'General case' 0 N--CA 1.508 2.46 0 C-N-CA 119.385 -0.926 . . . . 0.0 110.05 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -61.86 -46.09 90.92 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.231 -0.918 . . . . 0.0 109.812 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.487 ' HB1' ' HA ' ' A' ' 139' ' ' GLN . . . -61.53 -41.21 97.0 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.177 -0.952 . . . . 0.0 109.916 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 10.0 mmt-85 -65.57 -33.89 76.98 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.228 -0.92 . . . . 0.0 110.343 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 26.2 ttmt -76.82 -31.67 57.07 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.042 -1.036 . . . . 0.0 111.016 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 4.0 tppt? -99.93 23.38 9.87 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 120.945 -1.097 . . . . 0.0 111.762 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.89 46.74 49.11 Favored Glycine 0 N--CA 1.5 2.913 0 O-C-N 120.732 -1.23 . . . . 0.0 110.951 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.438 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 10.1 t -146.61 -163.54 1.77 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.065 -1.256 . . . . 0.0 110.295 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . 0.487 ' HA ' ' HB1' ' A' ' 133' ' ' ALA . 30.5 mt-30 -137.12 151.02 48.38 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.105 -0.997 . . . . 0.0 110.396 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.473 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.3 p -132.9 161.1 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.23 -0.919 . . . . 0.0 110.004 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 47.3 t -169.3 75.73 0.09 Allowed 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.172 -0.955 . . . . 0.0 111.211 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.802 ' CG ' HD12 ' A' ' 121' ' ' ILE . 36.8 t80 -91.86 161.62 14.77 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.263 -0.898 . . . . 0.0 109.975 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 3.3 m80 -139.54 -60.91 0.55 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.517 -0.739 . . . . 0.0 109.157 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.26 152.27 50.69 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 179.259 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 25.4 p -98.66 155.24 17.42 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.313 -0.867 . . . . 0.0 110.532 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.3 p -75.33 -23.31 16.92 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.572 0 O-C-N 121.271 -0.893 . . . . 0.0 112.045 -179.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -52.27 -44.54 65.02 Favored 'General case' 0 N--CA 1.516 2.867 0 O-C-N 120.667 -1.27 . . . . 0.0 109.592 179.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.495 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 29.3 p -140.15 -169.41 2.74 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.34 -0.85 . . . . 0.0 110.599 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . 0.446 ' CA ' ' CE3' ' A' ' 50' ' ' TRP . . . -98.98 56.93 0.93 Allowed Glycine 0 N--CA 1.489 2.169 0 N-CA-C 107.426 -2.27 . . . . 0.0 107.426 178.268 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 24.1 t -101.19 142.51 32.52 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.466 -1.02 . . . . 0.0 109.672 -178.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 2.4 ttp85 -97.4 53.02 1.13 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.258 -0.901 . . . . 0.0 109.379 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.42 97.55 0.03 OUTLIER Glycine 0 N--CA 1.488 2.139 0 N-CA-C 109.559 -1.417 . . . . 0.0 109.559 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 p -107.57 128.69 54.75 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.319 -1.106 . . . . 0.0 110.338 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -136.79 141.58 42.92 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.157 -0.964 . . . . 0.0 110.108 -179.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . 0.66 ' O ' HG23 ' A' ' 156' ' ' THR . 0.7 OUTLIER -104.37 41.78 1.27 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.211 -0.931 . . . . 0.0 109.672 179.521 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . 0.66 HG23 ' O ' ' A' ' 155' ' ' SER . 0.7 OUTLIER -160.34 -55.65 0.06 Allowed 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.287 -0.883 . . . . 0.0 110.742 -179.869 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 . . . . . 0 N--CA 1.493 1.723 0 CA-C-O 118.005 -0.997 . . . . 0.0 110.271 179.905 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.305 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -79.62 -177.53 50.41 Favored Glycine 0 N--CA 1.492 2.425 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.6 p -131.76 131.77 22.92 Favored Pre-proline 0 N--CA 1.494 1.726 0 O-C-N 121.192 -1.181 . . . . 0.0 110.097 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -74.16 78.93 2.49 Favored 'Trans proline' 0 N--CA 1.486 1.035 0 O-C-N 123.206 1.109 . . . . 0.0 110.345 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 27.2 ttm-85 -126.27 110.31 13.27 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.252 -0.905 . . . . 0.0 110.354 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.508 HG23 ' O ' ' A' ' 4' ' ' ILE . 1.2 tp -157.02 60.86 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 O-C-N 121.196 -0.94 . . . . 0.0 110.731 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.9 tttt -148.08 162.03 40.22 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.144 -0.972 . . . . 0.0 110.428 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.9 m -145.36 47.08 1.3 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.231 -0.918 . . . . 0.0 110.42 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.27 130.61 26.88 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.156 -0.965 . . . . 0.0 110.077 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -120.38 -61.52 1.57 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.19 -0.944 . . . . 0.0 110.194 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.4 t -155.25 81.65 1.06 Allowed 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.183 -0.948 . . . . 0.0 110.737 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 12.6 mmmt -143.35 63.77 13.07 Favored Pre-proline 0 N--CA 1.495 1.805 0 O-C-N 121.224 -0.923 . . . . 0.0 110.155 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.48 ' O ' ' HB3' ' A' ' 12' ' ' ALA . 47.8 Cg_endo -73.09 157.54 50.62 Favored 'Trans proline' 0 C--N 1.317 -1.082 0 O-C-N 123.356 1.187 . . . . 0.0 110.656 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.733 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . 61.89 146.46 0.08 OUTLIER Pre-proline 0 N--CA 1.503 2.198 0 O-C-N 121.395 -0.816 . . . . 0.0 110.69 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -73.75 162.71 38.93 Favored 'Trans proline' 0 C--N 1.318 -1.037 0 O-C-N 123.272 1.143 . . . . 0.0 110.52 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -48.94 -31.95 8.23 Favored 'General case' 0 N--CA 1.516 2.845 0 O-C-N 121.317 -0.864 . . . . 0.0 111.327 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.93 -34.46 51.77 Favored Glycine 0 N--CA 1.498 2.775 0 O-C-N 121.01 -1.056 . . . . 0.0 110.517 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -54.62 -31.8 57.83 Favored 'General case' 0 N--CA 1.511 2.621 0 O-C-N 120.924 -1.339 . . . . 0.0 110.821 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -54.24 -37.83 65.07 Favored 'General case' 0 N--CA 1.512 2.652 0 O-C-N 120.886 -1.134 . . . . 0.0 110.286 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 15.8 mttm -59.27 -37.62 78.07 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.254 -0.904 . . . . 0.0 110.139 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.868 HD12 HD11 ' A' ' 23' ' ' LEU . 1.7 pt -116.3 34.78 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 O-C-N 121.166 -0.959 . . . . 0.0 110.498 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.42 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.4 OUTLIER -85.1 -43.72 0.67 Allowed Pre-proline 0 N--CA 1.509 2.52 0 O-C-N 121.038 -1.039 . . . . 0.0 113.529 -178.911 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.42 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.1 Cg_endo -74.8 -34.14 4.32 Favored 'Trans proline' 0 N--CA 1.487 1.095 0 O-C-N 122.529 0.752 . . . . 0.0 111.96 -177.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.546 HG21 ' CE2' ' A' ' 62' ' ' TYR . 91.6 m -62.06 -47.78 83.16 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 120.909 -1.119 . . . . 0.0 109.792 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.868 HD11 HD12 ' A' ' 19' ' ' ILE . 7.7 mt -62.45 -39.53 93.68 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.27 -0.894 . . . . 0.0 109.519 179.357 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.7 m -57.1 -34.82 68.73 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.17 -0.956 . . . . 0.0 110.206 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -56.62 -37.13 70.27 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.094 -1.004 . . . . 0.0 110.266 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.606 ' CD2' HD22 ' A' ' 55' ' ' LEU . 20.2 m-85 -56.97 -37.4 71.54 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.141 -0.974 . . . . 0.0 110.254 179.576 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -56.45 -27.81 57.86 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.23 -0.919 . . . . 0.0 110.975 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.486 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.7 mp -77.75 -35.82 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.45 0 O-C-N 121.044 -1.035 . . . . 0.0 109.411 179.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -79.83 -40.03 29.41 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.006 -1.059 . . . . 0.0 108.603 178.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.057 HD11 HG23 ' A' ' 52' ' ' ILE . 7.0 tp -69.46 -34.04 73.81 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.238 -0.914 . . . . 0.0 110.364 179.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -71.41 -35.72 71.09 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 118.833 -1.147 . . . . 0.0 109.854 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -65.33 -39.95 93.05 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.106 -0.996 . . . . 0.0 109.645 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.438 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -72.76 -42.02 64.45 Favored 'General case' 0 N--CA 1.504 2.265 0 C-N-CA 119.167 -1.013 . . . . 0.0 109.031 179.01 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -62.92 -34.11 76.76 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.282 -0.887 . . . . 0.0 109.936 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 40.7 mmtt -84.4 -32.68 24.01 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.036 -1.04 . . . . 0.0 110.78 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -55.07 -36.66 65.84 Favored 'General case' 0 N--CA 1.511 2.616 0 O-C-N 120.985 -1.072 . . . . 0.0 110.392 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt -54.56 -38.18 66.34 Favored 'General case' 0 N--CA 1.513 2.691 0 O-C-N 121.107 -0.996 . . . . 0.0 110.399 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.5 m 53.19 -166.82 0.07 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 120.973 -1.079 . . . . 0.0 110.823 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.1 t -110.87 -53.94 2.65 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.218 -0.927 . . . . 0.0 110.171 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.2 mmmt -108.13 72.32 0.84 Allowed 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.245 -0.909 . . . . 0.0 109.746 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.3 tp -165.64 92.92 0.55 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.172 -0.955 . . . . 0.0 110.688 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -102.37 105.44 16.05 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.184 -0.948 . . . . 0.0 110.392 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -169.05 109.83 0.48 Allowed 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.183 -0.948 . . . . 0.0 110.683 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 18.8 mtpt 53.22 41.57 32.14 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.026 -1.046 . . . . 0.0 110.42 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.8 t -95.7 -35.53 11.54 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.307 -0.871 . . . . 0.0 110.865 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 50.0 m-20 -55.85 -38.99 70.83 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 120.982 -1.074 . . . . 0.0 110.122 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -62.36 -41.57 98.72 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.236 -0.915 . . . . 0.0 109.67 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 55.7 tp60 -61.98 -40.62 96.24 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.19 -0.944 . . . . 0.0 109.681 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.408 HD23 HD12 ' A' ' 52' ' ' ILE . 12.5 mt -58.68 -39.02 79.51 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.172 -0.955 . . . . 0.0 109.979 179.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.502 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 52.8 m0 -58.56 -36.84 74.55 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.153 -0.967 . . . . 0.0 109.826 179.398 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -60.71 -30.19 69.81 Favored 'General case' 0 N--CA 1.506 2.325 0 O-C-N 121.08 -1.013 . . . . 0.0 109.733 178.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 1.057 HG23 HD11 ' A' ' 30' ' ' LEU . 22.6 mt -71.36 -60.64 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.226 0 O-C-N 120.952 -1.092 . . . . 0.0 108.845 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.47 ' HE1' ' O ' ' A' ' 147' ' ' HIS . 0.9 OUTLIER -60.51 -28.69 68.58 Favored 'General case' 0 N--CA 1.51 2.537 0 C-N-CA 118.547 -1.261 . . . . 0.0 109.774 178.61 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -72.24 -39.22 68.62 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 120.875 -1.14 . . . . 0.0 108.89 178.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.606 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.0 mt -54.04 -33.71 58.06 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 121.105 -0.997 . . . . 0.0 110.269 178.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.44 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 12.9 t60 -57.03 -35.39 69.22 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.089 -1.007 . . . . 0.0 110.438 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.528 ' NE2' HD21 ' A' ' 91' ' ' LEU . 6.3 m170 -60.56 -50.65 72.69 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 120.981 -1.074 . . . . 0.0 109.603 179.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -58.72 -35.83 73.29 Favored 'General case' 0 N--CA 1.508 2.449 0 C-N-CA 119.501 -0.88 . . . . 0.0 109.596 179.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.449 ' CD ' ' CD1' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -68.27 -49.61 59.37 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.079 -1.013 . . . . 0.0 109.176 179.003 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.1 p -62.12 -38.46 89.02 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.201 -0.937 . . . . 0.0 109.356 179.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 37.5 ttt-85 -65.12 -38.22 89.97 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.092 -1.005 . . . . 0.0 109.384 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.582 ' OH ' HG22 ' A' ' 19' ' ' ILE . 34.1 t80 -59.78 -48.87 79.95 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.211 -0.93 . . . . 0.0 109.368 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.78 HD12 ' HB2' ' A' ' 87' ' ' ALA . 92.0 mt -76.27 -44.25 36.42 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.266 0 C-N-CA 119.505 -0.878 . . . . 0.0 108.869 179.121 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.516 ' CE1' HG23 ' A' ' 92' ' ' ILE . 40.9 t80 -58.92 -25.7 63.67 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.323 -0.86 . . . . 0.0 110.365 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.465 HG23 ' HD3' ' A' ' 69' ' ' LYS . 88.4 m -87.25 -36.09 18.13 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.756 -1.215 . . . . 0.0 110.373 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.564 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -82.92 -33.08 26.93 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 120.813 -1.179 . . . . 0.0 112.34 -179.267 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.518 ' N ' HD12 ' A' ' 66' ' ' LEU . 33.3 t80 -86.42 -34.61 20.1 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 120.707 -1.246 . . . . 0.0 111.922 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.402 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 14.4 m-85 -96.21 -22.02 17.52 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 120.903 -1.123 . . . . 0.0 112.986 -178.181 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.465 ' HD3' HG23 ' A' ' 65' ' ' THR . 8.5 mtpt -112.59 -58.13 2.19 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 120.527 -1.358 . . . . 0.0 110.979 -179.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.401 ' HB2' ' HA ' ' A' ' 66' ' ' LEU . 10.2 mmm-85 -71.7 -29.39 64.51 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.139 -0.975 . . . . 0.0 110.919 -179.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 58.83 43.91 17.61 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.815 -1.178 . . . . 0.0 109.953 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.01 35.08 3.52 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.302 -0.874 . . . . 0.0 109.807 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.778 HG13 HD23 ' A' ' 77' ' ' LEU . 13.4 tt -153.1 162.7 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.23 -0.919 . . . . 0.0 109.784 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.4 p -107.44 146.76 31.31 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.089 -1.007 . . . . 0.0 110.415 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -46.34 -32.31 3.09 Favored 'General case' 0 N--CA 1.516 2.869 0 O-C-N 121.307 -0.87 . . . . 0.0 111.469 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -62.14 -49.68 74.88 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 120.894 -1.129 . . . . 0.0 109.302 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.778 HD23 HG13 ' A' ' 73' ' ' ILE . 49.5 tp -67.28 -43.46 81.74 Favored 'General case' 0 N--CA 1.505 2.295 0 C-N-CA 119.185 -1.006 . . . . 0.0 108.552 178.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.416 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 17.5 t80 -61.64 -38.87 89.27 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.291 -0.88 . . . . 0.0 109.432 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -72.22 -42.41 65.77 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 120.998 -1.064 . . . . 0.0 108.991 178.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.733 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 84.2 t90 -57.94 -36.89 73.16 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.214 -0.929 . . . . 0.0 109.691 179.159 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.659 HD22 ' CD2' ' A' ' 86' ' ' TYR . 30.7 mt -68.75 -46.06 69.82 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.129 -0.982 . . . . 0.0 109.116 179.296 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.2 mm -58.46 -32.84 46.47 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.532 0 O-C-N 121.26 -0.9 . . . . 0.0 110.001 179.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.5 mmtp -89.16 -8.79 52.98 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 120.895 -1.128 . . . . 0.0 112.278 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.452 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 75.7 mm-40 -112.17 21.55 15.71 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 120.556 -1.34 . . . . 0.0 112.04 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt 74.05 77.9 0.12 Allowed 'General case' 0 N--CA 1.51 2.543 0 O-C-N 120.97 -1.081 . . . . 0.0 111.456 179.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.681 ' HE2' HD13 ' A' ' 23' ' ' LEU . 33.6 m-85 -137.06 -63.0 0.62 Allowed 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.558 -0.714 . . . . 0.0 109.49 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.78 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -126.38 175.97 7.47 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.403 -0.811 . . . . 0.0 109.44 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.44 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 19.1 t0 -116.24 105.5 12.64 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.114 -0.991 . . . . 0.0 110.505 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 13.1 mmmt -61.34 -39.74 91.69 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.228 -0.92 . . . . 0.0 109.655 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.773 HD23 HD13 ' A' ' 106' ' ' LEU . 26.9 tp -60.49 -42.41 96.28 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.104 -0.997 . . . . 0.0 109.658 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.776 ' HA ' HD21 ' A' ' 106' ' ' LEU . 43.4 tp -67.78 -49.36 62.82 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.291 -0.964 . . . . 0.0 109.119 179.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.516 HG23 ' CE1' ' A' ' 64' ' ' TYR . 34.3 mt -58.54 -29.88 39.97 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.48 0 C-N-CA 119.27 -0.972 . . . . 0.0 109.212 178.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.68 -46.2 66.62 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 120.911 -1.118 . . . . 0.0 109.328 178.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.514 ' HD3' HD23 ' A' ' 106' ' ' LEU . 6.4 mttp -58.16 -38.94 77.61 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.094 -1.004 . . . . 0.0 110.084 179.194 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.6 m0 -66.27 -39.98 89.81 Favored 'General case' 0 N--CA 1.508 2.467 0 C-N-CA 119.318 -0.953 . . . . 0.0 109.515 179.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.05 -33.65 70.49 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.282 -0.886 . . . . 0.0 110.358 179.468 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.6 mmtp -53.78 -177.17 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.699 0 O-C-N 121.037 -1.039 . . . . 0.0 110.651 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -106.34 133.22 51.37 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.183 -0.948 . . . . 0.0 109.797 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.95 3.1 56.0 Favored Glycine 0 N--CA 1.493 2.487 0 C-N-CA 120.06 -1.067 . . . . 0.0 111.31 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -108.62 48.48 0.86 Allowed 'General case' 0 N--CA 1.498 1.968 0 CA-C-N 119.645 1.723 . . . . 0.0 110.115 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -64.58 -39.51 93.87 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.213 -0.93 . . . . 0.0 109.911 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.78 104.26 11.78 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.153 -0.967 . . . . 0.0 109.979 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.906 HD13 HD13 ' A' ' 109' ' ' ILE . 8.9 tp -141.59 132.48 25.93 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.17 -0.956 . . . . 0.0 109.713 -179.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.444 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.4 p -108.4 -37.3 6.01 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.176 -0.953 . . . . 0.0 112.305 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.816 ' O ' HD11 ' A' ' 103' ' ' LEU . 7.6 m -140.76 -168.93 2.69 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 120.265 -1.522 . . . . 0.0 109.924 178.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.776 HD21 ' HA ' ' A' ' 91' ' ' LEU . 32.7 mt -97.69 -36.74 10.15 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.035 -1.04 . . . . 0.0 110.462 179.272 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 12.1 ttm-85 -103.11 32.72 3.6 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 120.92 -1.112 . . . . 0.0 109.473 178.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.657 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.309 1.7 t -128.98 16.47 6.24 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.207 -0.933 . . . . 0.0 109.219 -179.066 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.906 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -158.89 37.99 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 O-C-N 120.843 -1.161 . . . . 0.0 110.604 -178.732 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.575 ' O ' HG23 ' A' ' 119' ' ' THR . 0.0 OUTLIER -115.75 131.16 57.02 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 120.708 -1.245 . . . . 0.0 111.79 -178.433 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.467 ' HA ' ' HG1' ' A' ' 119' ' ' THR . 5.8 ptpt -133.34 -175.19 3.72 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.349 -0.844 . . . . 0.0 110.119 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -147.0 167.88 22.91 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.127 -0.983 . . . . 0.0 110.442 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -117.38 125.16 50.52 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.194 -0.941 . . . . 0.0 110.155 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 1.6 m 52.81 38.91 27.86 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.997 -1.064 . . . . 0.0 110.647 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -143.49 -171.88 3.6 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.221 -0.924 . . . . 0.0 110.145 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -113.31 73.02 0.8 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.19 -0.944 . . . . 0.0 110.165 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -107.64 -169.61 21.82 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 74.0 m -144.77 132.83 21.48 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.172 -1.193 . . . . 0.0 110.362 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.575 HG23 ' O ' ' A' ' 110' ' ' GLN . 2.5 m -125.04 168.55 13.2 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.251 -0.906 . . . . 0.0 110.216 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 45.6 t -92.14 154.44 18.7 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.296 -0.878 . . . . 0.0 109.038 178.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.813 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -71.31 -36.33 61.17 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.42 0 O-C-N 121.101 -1.0 . . . . 0.0 110.882 -179.159 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.446 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.4 p -55.37 -34.35 64.23 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 120.828 -1.17 . . . . 0.0 110.869 -179.004 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.496 ' HG3' HG22 ' A' ' 109' ' ' ILE . 3.0 ttp85 -59.36 -35.55 74.1 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.006 -1.059 . . . . 0.0 109.65 178.399 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 55.6 t -78.91 125.03 84.67 Favored Pre-proline 0 N--CA 1.503 2.202 0 O-C-N 121.171 -0.956 . . . . 0.0 109.823 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.462 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.2 Cg_endo -65.03 174.92 4.26 Favored 'Trans proline' 0 N--CA 1.487 1.133 0 O-C-N 123.143 1.075 . . . . 0.0 110.734 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -75.05 -36.18 61.83 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.203 -0.936 . . . . 0.0 110.719 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.53 -40.9 79.79 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.005 -1.06 . . . . 0.0 109.985 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 7.7 tp60 -69.68 -41.32 75.63 Favored 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 119.341 -0.944 . . . . 0.0 109.274 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.573 HD11 HD11 ' A' ' 121' ' ' ILE . 3.1 mt -65.5 -38.77 90.67 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.204 -0.935 . . . . 0.0 109.554 179.122 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -61.25 -39.91 92.09 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.181 -0.949 . . . . 0.0 109.757 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -59.03 -37.13 76.25 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.179 -0.951 . . . . 0.0 110.326 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -61.4 -44.97 96.22 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.115 -0.991 . . . . 0.0 110.057 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.428 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -60.8 -41.68 96.13 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.172 -0.955 . . . . 0.0 109.914 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 11.0 mtt180 -59.46 -36.9 76.85 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.143 -0.973 . . . . 0.0 110.178 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 44.6 mttm -65.93 -33.77 76.59 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.075 -1.016 . . . . 0.0 110.81 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 35.6 mtmt -105.51 22.39 15.56 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 120.931 -1.106 . . . . 0.0 111.923 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.72 46.47 54.16 Favored Glycine 0 N--CA 1.499 2.89 0 O-C-N 120.608 -1.307 . . . . 0.0 110.799 179.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.428 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 9.4 t -138.84 -163.5 1.48 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.197 -1.178 . . . . 0.0 110.088 179.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -138.6 146.62 41.99 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.098 -1.001 . . . . 0.0 110.549 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.429 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.9 p -131.0 161.46 40.98 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.185 -0.947 . . . . 0.0 109.723 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 42.1 t -166.75 83.56 0.26 Allowed 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.128 -0.982 . . . . 0.0 111.305 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.792 ' CG ' HD12 ' A' ' 121' ' ' ILE . 38.9 t80 -95.0 161.75 14.01 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.295 -0.878 . . . . 0.0 110.049 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -140.67 -60.61 0.51 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.571 -0.705 . . . . 0.0 109.19 179.011 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.22 151.25 50.94 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.437 -0.789 . . . . 0.0 109.293 178.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 28.0 p -97.06 154.43 17.33 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.122 -0.986 . . . . 0.0 111.065 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 19.7 m -74.06 -23.35 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.433 0 O-C-N 121.395 -0.816 . . . . 0.0 111.676 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . 0.47 ' O ' ' HE1' ' A' ' 53' ' ' MET . 3.7 m-70 -51.68 -52.01 51.44 Favored 'General case' 0 N--CA 1.515 2.779 0 O-C-N 120.717 -1.239 . . . . 0.0 109.967 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.502 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 26.4 p -133.58 -164.88 1.55 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.329 -0.857 . . . . 0.0 110.518 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.59 56.51 0.78 Allowed Glycine 0 N--CA 1.492 2.386 0 N-CA-C 107.925 -2.07 . . . . 0.0 107.925 178.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 18.3 t -101.39 144.07 30.65 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.33 -1.1 . . . . 0.0 109.912 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 7.6 ttm-85 -98.49 50.27 0.99 Allowed 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.3 -0.875 . . . . 0.0 109.531 179.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 69.73 98.82 0.04 OUTLIER Glycine 0 N--CA 1.488 2.106 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.0 p -111.13 128.32 55.85 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.237 -1.155 . . . . 0.0 110.229 179.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -144.95 137.31 26.07 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.075 -1.016 . . . . 0.0 110.2 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -96.2 -38.58 10.07 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.208 -0.933 . . . . 0.0 110.559 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 2.7 m -55.41 -38.65 69.21 Favored 'General case' 0 N--CA 1.512 2.642 0 O-C-N 121.007 -1.058 . . . . 0.0 110.525 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 . . . . . 0 N--CA 1.494 1.768 0 CA-C-O 117.969 -1.015 . . . . 0.0 110.174 179.947 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.313 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -117.84 61.79 0.43 Allowed Glycine 0 N--CA 1.494 2.502 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.1 p -120.79 166.37 15.83 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.278 -1.131 . . . . 0.0 110.275 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.79 155.13 53.97 Favored 'Trans proline' 0 C--N 1.316 -1.133 0 O-C-N 123.434 1.229 . . . . 0.0 110.389 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.7 tpt180 -136.77 141.03 42.95 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.228 -0.92 . . . . 0.0 110.216 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 45.1 pt -136.85 144.46 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.222 -0.924 . . . . 0.0 110.3 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.7 ptpt -145.14 -176.71 5.21 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.17 -0.956 . . . . 0.0 110.35 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 66.1 p -128.96 -65.95 0.85 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.238 -0.914 . . . . 0.0 110.255 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 77.1 mtt-85 -145.99 126.82 14.42 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.284 -0.885 . . . . 0.0 110.377 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 25.6 ttp85 -144.04 95.53 2.74 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.172 -0.955 . . . . 0.0 110.261 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.1 t -140.47 93.82 2.66 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.187 -0.945 . . . . 0.0 110.195 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.6 mmtt 52.81 75.17 0.67 Allowed Pre-proline 0 N--CA 1.501 2.099 0 O-C-N 121.02 -1.05 . . . . 0.0 110.648 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -73.06 158.57 49.25 Favored 'Trans proline' 0 C--N 1.316 -1.151 0 O-C-N 123.361 1.19 . . . . 0.0 110.764 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.693 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -100.23 147.3 33.34 Favored Pre-proline 0 N--CA 1.499 1.987 0 O-C-N 121.391 -0.818 . . . . 0.0 109.748 179.54 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.435 ' HG2' HD13 ' A' ' 77' ' ' LEU . 44.2 Cg_endo -69.94 162.7 41.19 Favored 'Trans proline' 0 C--N 1.317 -1.125 0 O-C-N 123.315 1.166 . . . . 0.0 110.812 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -48.7 -31.83 7.46 Favored 'General case' 0 N--CA 1.514 2.758 0 O-C-N 121.451 -0.78 . . . . 0.0 111.339 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.67 -34.29 43.47 Favored Glycine 0 N--CA 1.499 2.861 0 O-C-N 120.941 -1.1 . . . . 0.0 110.609 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -55.6 -33.19 63.73 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 120.965 -1.315 . . . . 0.0 110.688 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -54.03 -37.65 64.33 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 121.04 -1.037 . . . . 0.0 110.187 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -58.9 -37.45 76.64 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.288 -0.882 . . . . 0.0 110.072 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.727 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.5 pt -116.43 34.5 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 O-C-N 121.118 -0.989 . . . . 0.0 110.554 179.689 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -82.89 -44.29 0.89 Allowed Pre-proline 0 N--CA 1.51 2.544 0 O-C-N 121.011 -1.055 . . . . 0.0 112.871 -179.252 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.4 Cg_endo -76.68 -36.12 1.74 Allowed 'Trans proline' 0 N--CA 1.486 1.087 0 O-C-N 122.642 0.811 . . . . 0.0 111.407 -178.464 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.87 HG21 ' CE2' ' A' ' 62' ' ' TYR . 87.3 m -58.71 -41.77 87.1 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 120.986 -1.071 . . . . 0.0 109.964 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.727 HD12 ' O ' ' A' ' 19' ' ' ILE . 2.3 mt -66.84 -40.97 88.14 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.263 -0.898 . . . . 0.0 109.397 179.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.6 m -59.42 -35.26 73.68 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.199 -0.938 . . . . 0.0 110.084 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -57.04 -36.94 71.07 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 121.036 -1.04 . . . . 0.0 110.266 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.597 ' CD2' HD22 ' A' ' 55' ' ' LEU . 12.5 m-85 -58.18 -37.95 75.74 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.136 -0.977 . . . . 0.0 110.497 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -60.74 -39.78 89.98 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.147 -0.971 . . . . 0.0 110.602 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.414 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.1 mp -65.83 -41.57 90.4 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 C-N-CA 119.23 -0.988 . . . . 0.0 109.039 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -67.78 -48.16 67.13 Favored 'General case' 0 N--CA 1.505 2.319 0 C-N-CA 119.224 -0.99 . . . . 0.0 108.643 178.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.702 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -62.93 -36.39 83.24 Favored 'General case' 0 N--CA 1.509 2.507 0 C-N-CA 119.35 -0.94 . . . . 0.0 108.936 178.356 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -57.31 -41.8 80.59 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.061 -1.025 . . . . 0.0 109.879 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -61.99 -45.28 94.33 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 119.393 -0.923 . . . . 0.0 109.862 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.548 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -68.72 -39.68 80.29 Favored 'General case' 0 N--CA 1.507 2.385 0 C-N-CA 119.343 -0.943 . . . . 0.0 109.652 179.479 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.519 ' HG3' HD23 ' A' ' 30' ' ' LEU . 56.6 mt-30 -68.93 -31.13 69.81 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.218 -0.926 . . . . 0.0 110.647 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.9 mtpt -98.02 -29.17 13.43 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.94 -1.1 . . . . 0.0 111.886 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.416 ' O ' HD22 ' A' ' 41' ' ' LEU . 23.2 m-20 -58.44 -36.72 74.07 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 120.757 -1.214 . . . . 0.0 110.344 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.1 ttmm -54.64 -38.98 67.52 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.007 -1.058 . . . . 0.0 110.387 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.3 t 52.62 -166.35 0.06 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.061 -1.024 . . . . 0.0 110.884 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.4 t -96.55 -38.99 9.75 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 121.173 -0.955 . . . . 0.0 110.468 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.34 82.23 1.71 Allowed 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.052 -1.03 . . . . 0.0 109.906 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.416 HD22 ' O ' ' A' ' 36' ' ' ASP . 18.4 tp -155.03 88.64 1.18 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.176 -0.952 . . . . 0.0 110.484 -179.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -103.23 35.57 2.52 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.253 -0.905 . . . . 0.0 110.651 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -127.29 120.74 29.32 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.263 -0.898 . . . . 0.0 109.901 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.5 mptt 53.15 58.04 5.68 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.008 -1.058 . . . . 0.0 110.547 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -101.98 -44.02 5.61 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.088 -1.008 . . . . 0.0 110.871 -179.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -57.85 -40.31 79.84 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.098 -1.001 . . . . 0.0 110.151 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -59.94 -39.29 85.02 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.26 -0.9 . . . . 0.0 110.052 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -62.36 -45.94 90.93 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.174 -0.954 . . . . 0.0 109.736 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.449 HD23 ' HA ' ' A' ' 49' ' ' LEU . 23.9 mt -59.21 -36.74 75.94 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.177 -0.952 . . . . 0.0 110.32 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 47.7 m0 -58.63 -37.74 76.56 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 121.035 -1.04 . . . . 0.0 110.038 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -61.22 -32.86 72.64 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 119.148 -1.021 . . . . 0.0 109.701 178.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.702 HG23 ' CG ' ' A' ' 30' ' ' LEU . 74.1 mt -71.06 -59.65 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.283 0 O-C-N 121.092 -1.005 . . . . 0.0 108.883 179.101 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -61.1 -29.4 69.73 Favored 'General case' 0 N--CA 1.511 2.591 0 C-N-CA 118.544 -1.263 . . . . 0.0 109.754 178.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -69.48 -37.15 77.14 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.79 -1.194 . . . . 0.0 109.062 178.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.597 HD22 ' CD2' ' A' ' 26' ' ' PHE . 10.9 mt -53.31 -33.55 53.81 Favored 'General case' 0 N--CA 1.511 2.616 0 O-C-N 120.982 -1.074 . . . . 0.0 110.179 179.048 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.468 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 71.1 t60 -54.47 -38.28 66.22 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 120.965 -1.085 . . . . 0.0 110.059 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.448 ' CD2' HD21 ' A' ' 91' ' ' LEU . 6.6 m170 -61.09 -48.08 83.35 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.193 -0.942 . . . . 0.0 109.359 179.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -59.39 -36.57 76.06 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.279 -0.888 . . . . 0.0 109.676 179.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.417 ' HD2' ' CD2' ' A' ' 26' ' ' PHE . 8.0 mtp85 -63.59 -49.58 72.79 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.125 -0.984 . . . . 0.0 109.477 179.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 93.8 p -63.83 -40.74 97.34 Favored 'General case' 0 N--CA 1.504 2.269 0 C-N-CA 119.301 -0.96 . . . . 0.0 109.118 179.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.9 ttt85 -62.14 -38.85 90.55 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.192 -0.943 . . . . 0.0 109.405 179.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.87 ' CE2' HG21 ' A' ' 22' ' ' THR . 39.1 t80 -62.94 -51.7 65.88 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.081 -1.012 . . . . 0.0 109.345 179.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.588 HD12 ' HB2' ' A' ' 87' ' ' ALA . 92.7 mt -69.81 -37.97 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.365 0 C-N-CA 119.321 -0.952 . . . . 0.0 109.332 179.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.44 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 7.1 t80 -66.1 -42.65 89.0 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.127 -0.983 . . . . 0.0 109.018 178.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 92.9 m -60.78 -40.88 94.21 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.19 -0.944 . . . . 0.0 110.384 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.594 HD12 ' N ' ' A' ' 67' ' ' TYR . 3.7 pp -83.14 -35.34 25.64 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.818 -1.176 . . . . 0.0 112.422 -178.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.594 ' N ' HD12 ' A' ' 66' ' ' LEU . 30.6 t80 -86.48 -33.02 20.49 Favored 'General case' 0 N--CA 1.513 2.712 0 O-C-N 120.589 -1.319 . . . . 0.0 112.054 -179.308 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.44 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 7.0 m-85 -98.41 -6.29 30.88 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 120.802 -1.186 . . . . 0.0 113.138 -178.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 15.0 mtpt -129.8 -58.09 1.1 Allowed 'General case' 0 N--CA 1.502 2.17 0 O-C-N 120.366 -1.459 . . . . 0.0 110.534 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.3 mtt85 -72.01 -28.95 63.72 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.145 -0.972 . . . . 0.0 110.83 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.7 tttp 58.58 43.62 18.89 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.771 -1.205 . . . . 0.0 110.034 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -109.85 34.23 3.96 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.363 -0.836 . . . . 0.0 109.915 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.67 HG13 HD23 ' A' ' 77' ' ' LEU . 13.4 tt -151.07 162.65 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 O-C-N 121.202 -0.936 . . . . 0.0 109.657 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.8 t -107.92 144.3 35.36 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.128 -0.983 . . . . 0.0 110.34 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 50.6 tttt -45.08 -32.48 1.76 Allowed 'General case' 0 N--CA 1.515 2.785 0 O-C-N 121.328 -0.857 . . . . 0.0 111.732 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.42 -49.65 76.02 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 120.915 -1.115 . . . . 0.0 109.321 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.67 HD23 HG13 ' A' ' 73' ' ' ILE . 33.6 tp -67.09 -46.93 72.75 Favored 'General case' 0 N--CA 1.505 2.276 0 C-N-CA 119.077 -1.049 . . . . 0.0 108.45 178.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.806 ' HA ' HD12 ' A' ' 81' ' ' LEU . 19.2 t80 -58.15 -38.64 76.98 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.294 -0.879 . . . . 0.0 109.395 178.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -71.7 -42.97 66.73 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.035 -1.041 . . . . 0.0 108.433 178.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.693 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 73.4 t90 -56.33 -37.76 70.4 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.265 -0.897 . . . . 0.0 109.561 178.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.806 HD12 ' HA ' ' A' ' 78' ' ' TYR . 8.0 mt -66.56 -50.39 63.28 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.206 -0.934 . . . . 0.0 109.153 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 36.9 mm -57.91 -33.18 45.24 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.545 0 O-C-N 121.178 -0.951 . . . . 0.0 110.181 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -89.18 -6.07 57.21 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.894 -1.129 . . . . 0.0 112.416 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.455 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 17.3 mm-40 -115.01 22.61 13.24 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.395 -1.441 . . . . 0.0 112.016 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt 75.08 72.82 0.1 Allowed 'General case' 0 N--CA 1.511 2.623 0 O-C-N 121.104 -0.997 . . . . 0.0 111.679 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.656 ' HE2' HD13 ' A' ' 23' ' ' LEU . 31.5 m-85 -133.37 -62.35 0.79 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.432 -0.793 . . . . 0.0 109.333 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.588 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -132.24 167.26 20.13 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.467 -0.771 . . . . 0.0 109.593 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.468 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.5 t0 -109.77 107.24 17.16 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.155 -0.965 . . . . 0.0 110.237 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 12.4 mmtt -58.17 -38.15 76.08 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.263 -0.898 . . . . 0.0 110.035 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.465 HD23 HD13 ' A' ' 106' ' ' LEU . 13.6 tp -58.82 -38.43 78.62 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.213 -0.929 . . . . 0.0 110.161 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.448 HD21 ' CD2' ' A' ' 57' ' ' HIS . 57.6 tp -71.23 -45.35 63.49 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.133 -0.979 . . . . 0.0 108.835 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.439 HG23 ' CE2' ' A' ' 64' ' ' TYR . 24.9 mt -59.63 -37.78 72.38 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 C-N-CA 119.396 -0.921 . . . . 0.0 108.531 178.208 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.73 -38.99 87.78 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.176 -0.953 . . . . 0.0 109.112 178.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.444 ' HB3' HD22 ' A' ' 103' ' ' LEU . 9.8 mmtm -57.75 -41.25 81.5 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.001 -1.062 . . . . 0.0 109.755 179.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.3 m0 -68.1 -35.36 78.03 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.259 -0.901 . . . . 0.0 110.337 179.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 10.1 mtp85 -83.36 -31.41 26.77 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.072 -1.018 . . . . 0.0 110.888 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.3 mmtt -51.63 177.15 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.739 0 O-C-N 120.865 -1.147 . . . . 0.0 110.759 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.58 140.67 37.23 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.202 -0.936 . . . . 0.0 109.48 179.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 101.07 -23.52 35.23 Favored Glycine 0 N--CA 1.493 2.474 0 C-N-CA 119.814 -1.184 . . . . 0.0 110.407 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.632 ' HB3' HD23 ' A' ' 103' ' ' LEU . 63.5 m-85 -92.04 58.11 3.27 Favored 'General case' 0 N--CA 1.504 2.246 0 CA-C-N 119.098 1.449 . . . . 0.0 110.056 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -66.92 -32.83 74.35 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.138 -0.976 . . . . 0.0 110.522 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt -132.9 102.07 5.49 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.002 -1.061 . . . . 0.0 110.506 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.632 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.9 pp -140.62 155.0 46.67 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.083 -1.011 . . . . 0.0 110.551 179.609 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.429 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.5 p -118.95 -35.61 3.61 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.29 -0.881 . . . . 0.0 113.222 -179.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.697 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.4 m -142.91 -170.72 3.3 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.253 -1.529 . . . . 0.0 110.384 179.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.465 HD13 HD23 ' A' ' 90' ' ' LEU . 24.3 mt -98.35 -35.91 10.15 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.28 -0.887 . . . . 0.0 110.333 178.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 1.1 ttt-85 -103.47 35.18 2.67 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.816 -1.177 . . . . 0.0 109.538 178.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.697 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.279 1.7 t -126.85 -59.75 1.25 Allowed 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 105.65 -1.982 . . . . 0.0 105.65 -179.631 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.752 ' O ' HG21 ' A' ' 119' ' ' THR . 15.1 pt -68.95 -26.01 31.45 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.546 0 O-C-N 120.902 -1.124 . . . . 0.0 110.854 176.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.415 ' N ' HG13 ' A' ' 109' ' ' ILE . 44.3 tt0 -126.16 155.09 42.26 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.972 -1.08 . . . . 0.0 110.138 -179.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 2.0 tpmt? -117.88 -56.96 2.15 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.186 -0.946 . . . . 0.0 110.163 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -149.34 -172.69 4.19 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.156 -0.965 . . . . 0.0 110.373 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -117.11 73.57 0.87 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.163 -0.961 . . . . 0.0 110.046 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.47 -164.33 1.7 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.219 -0.926 . . . . 0.0 110.026 -179.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 37.2 t-20 -95.08 -38.75 10.48 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.107 -0.996 . . . . 0.0 110.318 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -112.29 163.21 14.65 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.146 -0.971 . . . . 0.0 110.231 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 140.05 -168.5 25.05 Favored Glycine 0 N--CA 1.494 2.519 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.4 m -142.38 174.89 10.21 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.171 -1.193 . . . . 0.0 110.257 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.752 HG21 ' O ' ' A' ' 109' ' ' ILE . 1.7 m -140.84 174.34 10.61 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.225 -0.922 . . . . 0.0 109.802 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 34.0 t -53.41 153.94 3.73 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 120.928 -1.108 . . . . 0.0 109.801 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.79 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -73.77 -35.26 43.01 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.444 0 O-C-N 121.08 -1.012 . . . . 0.0 111.161 -178.948 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.484 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 12.1 p -54.52 -33.53 60.16 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 120.735 -1.228 . . . . 0.0 111.208 -178.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -34.16 70.1 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.907 -1.121 . . . . 0.0 109.635 178.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.58 HG12 ' HG ' ' A' ' 129' ' ' LEU . 53.0 t -81.65 124.66 79.62 Favored Pre-proline 0 N--CA 1.505 2.282 0 O-C-N 121.123 -0.985 . . . . 0.0 109.779 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.465 ' HD3' ' HB1' ' A' ' 154' ' ' ALA . 39.2 Cg_endo -66.25 178.82 2.28 Favored 'Trans proline' 0 N--CA 1.489 1.234 0 O-C-N 123.194 1.102 . . . . 0.0 110.637 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 6.6 tpt180 -75.04 -38.41 61.44 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.197 -0.939 . . . . 0.0 110.427 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.26 -43.32 92.45 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.074 -1.016 . . . . 0.0 109.809 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.8 tm0? -67.31 -41.17 85.81 Favored 'General case' 0 N--CA 1.505 2.296 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.239 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.639 HD11 HD11 ' A' ' 121' ' ' ILE . 74.6 mt -63.96 -39.94 95.3 Favored 'General case' 0 N--CA 1.506 2.369 0 C-N-CA 119.493 -0.883 . . . . 0.0 109.491 179.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -59.2 -38.3 79.52 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.119 -0.988 . . . . 0.0 109.966 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -57.52 -36.48 71.63 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.107 -0.995 . . . . 0.0 110.397 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -63.07 -48.94 76.47 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.205 -0.934 . . . . 0.0 109.833 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.62 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -59.08 -38.43 79.44 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.09 -1.007 . . . . 0.0 109.834 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -59.74 -38.58 82.12 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.146 -0.971 . . . . 0.0 110.207 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 58.7 mttt -87.13 -42.14 13.25 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.071 -1.018 . . . . 0.0 109.96 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 21.6 mmtt -63.03 -25.82 68.56 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.27 -0.894 . . . . 0.0 111.178 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.75 33.51 9.07 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.62 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 7.8 t -145.99 -160.84 1.2 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.084 -1.245 . . . . 0.0 109.91 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -130.89 143.85 51.03 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.079 -1.013 . . . . 0.0 109.967 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 12.3 p -124.85 160.28 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.206 -0.934 . . . . 0.0 110.722 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 43.8 t -165.5 87.97 0.41 Allowed 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.365 -0.834 . . . . 0.0 110.6 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.767 ' CG ' HD12 ' A' ' 121' ' ' ILE . 60.5 t80 -100.41 161.1 13.82 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.23 -0.919 . . . . 0.0 110.999 -179.19 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -139.29 -60.96 0.56 Allowed 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -134.68 150.52 50.64 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.359 -0.838 . . . . 0.0 108.952 178.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . 0.437 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.5 p -90.79 152.71 20.68 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.056 -1.027 . . . . 0.0 111.237 -179.528 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.8 m -70.9 -26.5 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 C-N-CA 119.736 -0.786 . . . . 0.0 111.298 -179.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -50.38 -58.83 4.8 Favored 'General case' 0 N--CA 1.515 2.818 0 O-C-N 120.9 -1.125 . . . . 0.0 110.221 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 22.9 p -128.3 -166.73 1.67 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.248 -0.908 . . . . 0.0 110.451 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -99.95 60.92 0.71 Allowed Glycine 0 N--CA 1.493 2.44 0 N-CA-C 108.076 -2.01 . . . . 0.0 108.076 178.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 17.4 t -98.72 145.44 26.9 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.315 -1.109 . . . . 0.0 109.902 -179.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 32.4 mtt-85 -98.62 49.93 0.98 Allowed 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.236 -0.915 . . . . 0.0 109.444 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 68.18 97.39 0.04 OUTLIER Glycine 0 N--CA 1.488 2.141 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 22.4 p -109.94 129.08 55.71 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.163 -1.198 . . . . 0.0 110.508 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . 0.465 ' HB1' ' HD3' ' A' ' 125' ' ' PRO . . . -151.0 140.17 21.2 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.187 -0.946 . . . . 0.0 110.179 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -116.52 -57.06 2.23 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.211 -0.931 . . . . 0.0 110.277 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 7.0 m -140.83 51.39 1.63 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.223 -0.923 . . . . 0.0 110.131 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.494 1.754 0 CA-C-O 117.961 -1.019 . . . . 0.0 110.177 -179.963 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 64.5 89.69 0.04 OUTLIER Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.486 -1.446 . . . . 0.0 109.486 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.454 ' OG ' ' HD3' ' A' ' 2' ' ' PRO . 0.0 OUTLIER -63.31 -57.84 18.56 Favored Pre-proline 0 N--CA 1.508 2.431 0 O-C-N 121.176 -1.191 . . . . 0.0 110.12 -179.997 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.454 ' HD3' ' OG ' ' A' ' 1' ' ' SER . 47.1 Cg_endo -73.43 111.07 3.2 Favored 'Trans proline' 0 C--N 1.319 -1.019 0 O-C-N 123.285 1.15 . . . . 0.0 110.414 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.9 ptt-85 -134.79 173.12 12.05 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.248 -0.907 . . . . 0.0 110.323 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.2 tt -141.68 50.9 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 O-C-N 121.186 -0.946 . . . . 0.0 110.108 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 20.5 mtmt -115.66 146.92 41.41 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.189 -0.945 . . . . 0.0 110.198 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 12.3 p -123.77 71.76 1.12 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.272 -0.893 . . . . 0.0 110.272 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -127.54 -179.09 4.74 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.08 -1.013 . . . . 0.0 110.176 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.8 ptt85 -159.69 -172.67 3.77 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.171 -0.955 . . . . 0.0 110.877 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -115.57 -165.31 1.02 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.225 -0.922 . . . . 0.0 110.159 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -115.91 138.81 24.3 Favored Pre-proline 0 N--CA 1.494 1.759 0 O-C-N 121.183 -0.948 . . . . 0.0 110.15 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.474 ' O ' ' HB3' ' A' ' 12' ' ' ALA . 48.4 Cg_endo -74.58 158.11 44.02 Favored 'Trans proline' 0 C--N 1.319 -0.998 0 O-C-N 123.248 1.13 . . . . 0.0 110.557 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.749 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . 61.78 149.1 0.09 OUTLIER Pre-proline 0 N--CA 1.503 2.201 0 O-C-N 121.328 -0.857 . . . . 0.0 110.721 179.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -72.6 165.21 33.38 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 O-C-N 123.287 1.151 . . . . 0.0 110.612 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -48.47 -32.02 7.21 Favored 'General case' 0 N--CA 1.515 2.776 0 O-C-N 121.481 -0.762 . . . . 0.0 111.391 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.83 -34.84 51.82 Favored Glycine 0 N--CA 1.498 2.795 0 N-CA-C 110.449 -1.061 . . . . 0.0 110.449 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.489 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 28.9 t80 -54.77 -32.74 60.42 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 120.919 -1.341 . . . . 0.0 110.673 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -53.94 -37.66 64.12 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 121.015 -1.053 . . . . 0.0 110.276 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.0 mmpt? -58.31 -36.13 72.88 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.203 -0.935 . . . . 0.0 110.275 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.678 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.7 pt -117.06 36.26 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.181 -0.95 . . . . 0.0 110.547 179.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.422 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.5 OUTLIER -83.22 -44.68 0.85 Allowed Pre-proline 0 N--CA 1.509 2.514 0 O-C-N 121.075 -1.016 . . . . 0.0 113.065 -179.178 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.422 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.1 Cg_endo -75.64 -35.87 2.48 Favored 'Trans proline' 0 N--CA 1.485 1.027 0 O-C-N 122.655 0.819 . . . . 0.0 111.757 -178.138 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.784 HG21 ' CE2' ' A' ' 62' ' ' TYR . 60.7 m -60.35 -43.64 96.31 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 120.933 -1.104 . . . . 0.0 110.014 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.728 HD13 ' HE2' ' A' ' 86' ' ' TYR . 4.2 mt -65.49 -41.03 93.73 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 119.45 -0.9 . . . . 0.0 109.419 179.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -57.56 -34.15 68.88 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.164 -0.96 . . . . 0.0 110.192 179.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -57.0 -37.21 71.34 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.106 -0.996 . . . . 0.0 110.316 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.595 ' CD2' HD22 ' A' ' 55' ' ' LEU . 13.3 m-85 -58.76 -38.69 79.03 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.136 -0.977 . . . . 0.0 110.476 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -59.56 -39.7 84.92 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.164 -0.96 . . . . 0.0 110.437 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.412 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.0 mp -64.99 -40.22 88.35 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 C-N-CA 119.227 -0.989 . . . . 0.0 108.958 179.549 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -69.01 -50.41 49.1 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.122 -0.986 . . . . 0.0 108.887 178.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.756 HD11 HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -60.94 -35.54 77.0 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.119 -0.988 . . . . 0.0 109.278 178.535 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.44 -39.36 70.2 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 121.087 -1.008 . . . . 0.0 109.911 179.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.41 -41.75 88.8 Favored 'General case' 0 N--CA 1.507 2.376 0 C-N-CA 119.206 -0.998 . . . . 0.0 109.395 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.48 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -70.84 -41.92 70.85 Favored 'General case' 0 N--CA 1.504 2.229 0 C-N-CA 119.228 -0.989 . . . . 0.0 109.073 179.068 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -60.4 -34.44 73.92 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.285 -0.885 . . . . 0.0 109.963 179.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.8 mmmt -80.08 -29.69 39.16 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.0 -1.062 . . . . 0.0 110.965 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.76 -35.9 57.11 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 120.808 -1.183 . . . . 0.0 110.266 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.7 tmtt? -52.48 -33.7 45.89 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 121.204 -0.935 . . . . 0.0 110.821 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.7 m -53.54 -179.76 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.706 0 O-C-N 121.016 -1.053 . . . . 0.0 110.632 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.9 m -109.05 163.45 13.31 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.174 -0.954 . . . . 0.0 110.297 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.7 ttmt 52.29 38.33 24.57 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.094 -1.004 . . . . 0.0 110.736 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 14.5 tp -124.72 -57.69 1.53 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.188 -0.945 . . . . 0.0 110.372 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.31 -171.12 3.76 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.091 -1.006 . . . . 0.0 110.673 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -113.16 -173.7 2.31 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.2 -0.937 . . . . 0.0 109.99 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.5 mptt 52.28 94.51 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.043 -1.036 . . . . 0.0 110.678 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.31 -51.02 3.59 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.188 -0.945 . . . . 0.0 109.82 179.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.401 ' OD1' ' CZ2' ' A' ' 50' ' ' TRP . 1.5 t-20 -62.69 -39.65 94.65 Favored 'General case' 0 N--CA 1.506 2.345 0 C-N-CA 119.446 -0.902 . . . . 0.0 109.338 179.173 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -65.75 -40.15 91.79 Favored 'General case' 0 N--CA 1.507 2.39 0 C-N-CA 119.473 -0.891 . . . . 0.0 109.566 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.411 ' CG ' ' HA ' ' A' ' 33' ' ' ALA . 49.4 tp60 -63.31 -40.86 98.51 Favored 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 119.413 -0.915 . . . . 0.0 109.664 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.556 HD23 HD12 ' A' ' 52' ' ' ILE . 12.4 mt -59.54 -39.28 83.46 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.13 -0.981 . . . . 0.0 109.72 179.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.509 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.1 m0 -58.01 -36.23 72.39 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.202 -0.936 . . . . 0.0 109.842 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -62.41 -29.89 70.82 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.054 -1.028 . . . . 0.0 109.672 178.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.756 HG23 HD11 ' A' ' 30' ' ' LEU . 46.4 mt -70.55 -59.07 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 120.953 -1.092 . . . . 0.0 109.089 179.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.3 ptm -60.37 -29.82 69.17 Favored 'General case' 0 N--CA 1.51 2.546 0 C-N-CA 118.46 -1.296 . . . . 0.0 109.754 178.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -68.01 -37.41 81.4 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 120.885 -1.134 . . . . 0.0 109.263 178.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.755 HD12 HD12 ' A' ' 30' ' ' LEU . 11.9 mt -53.05 -32.19 45.54 Favored 'General case' 0 N--CA 1.513 2.688 0 O-C-N 120.962 -1.086 . . . . 0.0 110.304 179.055 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.443 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 5.0 t60 -56.1 -36.77 68.55 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.057 -1.027 . . . . 0.0 110.113 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.482 ' NE2' HD21 ' A' ' 91' ' ' LEU . 5.5 m170 -60.48 -49.49 77.34 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.1 -1.0 . . . . 0.0 109.508 179.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -58.24 -37.42 74.87 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.3 -0.875 . . . . 0.0 109.679 179.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.426 HH12 HD13 ' A' ' 30' ' ' LEU . 7.3 mtt180 -63.07 -48.77 77.23 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.172 -0.955 . . . . 0.0 109.482 179.247 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.7 p -60.74 -40.37 92.14 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.172 -0.955 . . . . 0.0 109.564 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.407 ' O ' ' OG1' ' A' ' 65' ' ' THR . 4.1 tpt85 -62.6 -40.99 98.68 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 119.343 -0.943 . . . . 0.0 109.319 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.784 ' CE2' HG21 ' A' ' 22' ' ' THR . 45.3 t80 -62.95 -50.23 71.63 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.276 -0.89 . . . . 0.0 109.512 179.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.833 HD12 ' HB2' ' A' ' 87' ' ' ALA . 79.7 mt -70.28 -36.78 68.78 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 C-N-CA 119.3 -0.96 . . . . 0.0 109.453 179.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.447 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 9.5 t80 -67.8 -42.12 82.09 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.068 -1.02 . . . . 0.0 108.891 178.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.407 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 90.1 m -60.92 -40.83 94.68 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.175 -0.953 . . . . 0.0 110.097 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.626 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.8 pp -83.2 -36.49 24.62 Favored 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 118.99 -1.084 . . . . 0.0 112.465 -179.126 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.612 ' N ' HD12 ' A' ' 66' ' ' LEU . 50.0 t80 -86.65 -35.12 19.54 Favored 'General case' 0 N--CA 1.513 2.693 0 O-C-N 120.63 -1.294 . . . . 0.0 111.858 -179.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.447 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 6.6 m-85 -98.32 -3.42 37.21 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.903 -1.123 . . . . 0.0 113.25 -178.5 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.87 -58.93 0.61 Allowed 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.374 -1.454 . . . . 0.0 110.749 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.413 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -62.57 -29.44 70.59 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.063 -1.023 . . . . 0.0 110.654 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.1 tttt 59.87 44.41 13.75 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.768 -1.207 . . . . 0.0 109.985 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -117.38 37.61 3.83 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.342 -0.849 . . . . 0.0 109.888 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.762 HG13 HD23 ' A' ' 77' ' ' LEU . 14.9 tt -157.35 162.69 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.227 -0.921 . . . . 0.0 110.411 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.8 p -110.31 149.0 30.82 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.119 -0.988 . . . . 0.0 110.104 179.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.3 tttt -46.34 -31.92 2.87 Favored 'General case' 0 N--CA 1.515 2.791 0 O-C-N 121.269 -0.895 . . . . 0.0 111.722 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -62.86 -51.91 65.17 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 120.964 -1.085 . . . . 0.0 109.423 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.762 HD23 HG13 ' A' ' 73' ' ' ILE . 31.4 tp -65.04 -43.02 93.72 Favored 'General case' 0 N--CA 1.507 2.38 0 C-N-CA 119.145 -1.022 . . . . 0.0 108.816 178.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.639 ' HA ' HD12 ' A' ' 81' ' ' LEU . 16.9 t80 -62.53 -40.48 96.94 Favored 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 119.53 -0.868 . . . . 0.0 109.235 179.182 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -70.25 -42.05 72.7 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.168 -0.957 . . . . 0.0 108.849 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.749 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 81.1 t90 -57.06 -35.51 69.43 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.262 -0.899 . . . . 0.0 109.876 179.062 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.639 HD12 ' HA ' ' A' ' 78' ' ' TYR . 12.4 mt -69.9 -48.23 59.44 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.079 -1.013 . . . . 0.0 108.971 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.9 mm -57.47 -31.66 39.45 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.609 0 O-C-N 121.312 -0.868 . . . . 0.0 110.053 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 6.9 tttp -89.28 -15.87 32.52 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.938 -1.101 . . . . 0.0 112.136 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.444 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 18.9 mm-40 -106.33 22.26 16.06 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 120.529 -1.357 . . . . 0.0 112.098 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 19.4 tptt 74.24 75.77 0.12 Allowed 'General case' 0 N--CA 1.512 2.667 0 O-C-N 121.038 -1.039 . . . . 0.0 111.742 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.728 ' HE2' HD13 ' A' ' 23' ' ' LEU . 33.0 m-85 -135.42 -63.04 0.69 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.558 -0.714 . . . . 0.0 109.306 179.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.833 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -125.48 -172.99 2.72 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.485 -0.76 . . . . 0.0 109.198 179.165 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.443 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 8.4 t0 -131.24 102.91 6.19 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.057 -1.027 . . . . 0.0 110.524 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -59.41 -39.18 82.62 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.195 -0.941 . . . . 0.0 109.799 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 19.7 tp -59.5 -40.26 86.49 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.127 -0.983 . . . . 0.0 109.772 179.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.636 HD11 HD11 ' A' ' 103' ' ' LEU . 59.5 tp -71.05 -46.77 61.38 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.173 -0.954 . . . . 0.0 108.552 179.001 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 62.8 mt -60.24 -33.52 53.93 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.344 0 C-N-CA 119.406 -0.918 . . . . 0.0 109.047 178.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.67 -46.36 72.56 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.043 -1.035 . . . . 0.0 109.292 178.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.49 ' HD3' HD23 ' A' ' 106' ' ' LEU . 12.2 mttp -57.48 -40.81 79.39 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.092 -1.005 . . . . 0.0 110.146 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 3.0 m0 -60.77 -26.85 67.55 Favored 'General case' 0 N--CA 1.508 2.468 0 C-N-CA 119.188 -1.005 . . . . 0.0 110.668 179.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.56 -35.8 22.55 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 120.796 -1.19 . . . . 0.0 110.448 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -52.23 178.86 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.76 0 O-C-N 121.022 -1.049 . . . . 0.0 110.764 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -103.4 138.2 40.47 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.259 -0.9 . . . . 0.0 109.22 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 102.85 -27.49 19.98 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 109.948 -1.261 . . . . 0.0 109.948 -178.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.6 ' HB3' HD23 ' A' ' 103' ' ' LEU . 73.3 m-85 -92.32 58.78 3.31 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.885 -1.362 . . . . 0.0 109.808 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -85.56 -35.0 21.34 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.068 -1.02 . . . . 0.0 110.475 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.412 ' HB2' ' OG ' ' A' ' 155' ' ' SER . 0.0 OUTLIER -117.49 62.34 0.74 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.987 -1.071 . . . . 0.0 110.586 -179.827 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.636 HD11 HD11 ' A' ' 91' ' ' LEU . 0.9 OUTLIER -107.29 152.33 24.27 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.003 -1.06 . . . . 0.0 109.847 179.506 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.446 ' N ' HD12 ' A' ' 103' ' ' LEU . 26.8 p -113.75 -29.33 7.13 Favored 'General case' 0 N--CA 1.501 2.121 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -179.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.659 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.8 m -143.87 -168.12 2.77 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 120.109 -1.619 . . . . 0.0 110.019 179.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.512 HD21 ' HA ' ' A' ' 91' ' ' LEU . 16.7 mt -96.35 -38.87 9.89 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.218 -0.926 . . . . 0.0 110.128 179.02 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -102.1 30.3 4.56 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 120.999 -1.063 . . . . 0.0 109.866 178.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.659 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.7 t -127.37 17.18 7.08 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.043 -1.035 . . . . 0.0 108.833 -179.545 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.469 HG23 ' O ' ' A' ' 108' ' ' CYS . 1.1 pt -158.99 38.91 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 O-C-N 120.957 -1.09 . . . . 0.0 110.24 -178.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.752 ' C ' HG23 ' A' ' 119' ' ' THR . 7.3 tt0 -103.75 101.22 11.04 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.868 -1.145 . . . . 0.0 111.201 -178.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.402 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 1.9 tttt -113.01 -179.61 3.69 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.353 -0.842 . . . . 0.0 110.022 179.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -144.77 164.57 30.62 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.173 -0.955 . . . . 0.0 110.324 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -115.61 39.52 2.97 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.102 -0.998 . . . . 0.0 110.246 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 62.7 m -160.13 -56.37 0.06 Allowed 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.176 -0.952 . . . . 0.0 110.735 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -116.94 -171.1 1.96 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.217 -0.927 . . . . 0.0 109.98 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -110.08 85.09 2.04 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.187 -0.946 . . . . 0.0 110.138 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -72.15 -113.75 0.05 OUTLIER Glycine 0 N--CA 1.493 2.438 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 1.8 m -146.39 103.67 3.71 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.24 -1.153 . . . . 0.0 110.454 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.752 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.1 m -119.07 172.84 7.28 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.133 -0.98 . . . . 0.0 110.135 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.438 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 49.6 t -103.87 154.93 19.05 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.26 -0.9 . . . . 0.0 109.207 178.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.967 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -75.34 -30.7 22.89 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 O-C-N 121.158 -0.964 . . . . 0.0 111.62 -179.033 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.484 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.3 p -58.58 -35.72 72.85 Favored 'General case' 0 N--CA 1.511 2.608 0 O-C-N 120.705 -1.247 . . . . 0.0 110.765 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.06 -33.24 64.81 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 120.937 -1.102 . . . . 0.0 109.964 178.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 58.3 t -81.29 124.28 80.78 Favored Pre-proline 0 N--CA 1.504 2.228 0 O-C-N 121.16 -0.963 . . . . 0.0 109.863 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -66.73 173.48 7.95 Favored 'Trans proline' 0 N--CA 1.488 1.163 0 O-C-N 123.187 1.098 . . . . 0.0 110.874 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.9 tpp85 -75.19 -37.66 61.1 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.292 -0.88 . . . . 0.0 110.421 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.89 -40.96 81.57 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.004 -1.06 . . . . 0.0 110.039 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -69.41 -41.8 75.91 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 119.312 -0.955 . . . . 0.0 109.249 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.604 ' O ' HG11 ' A' ' 140' ' ' VAL . 21.1 mt -65.39 -38.6 90.49 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.215 -0.928 . . . . 0.0 109.558 179.083 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -60.99 -39.88 91.34 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.132 -0.98 . . . . 0.0 109.877 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -60.37 -39.62 87.86 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.147 -0.97 . . . . 0.0 110.082 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -60.85 -41.01 95.0 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.244 -0.91 . . . . 0.0 109.941 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.3 -41.88 94.35 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.15 -0.969 . . . . 0.0 110.06 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 20.8 ttt85 -58.97 -38.44 79.09 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.088 -1.007 . . . . 0.0 109.908 179.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -57.87 -35.99 71.73 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.12 -0.987 . . . . 0.0 110.549 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -106.55 18.5 21.84 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.022 -1.049 . . . . 0.0 111.987 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 56.2 44.61 88.94 Favored Glycine 0 N--CA 1.497 2.729 0 O-C-N 120.612 -1.305 . . . . 0.0 110.327 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.7 t -133.75 -163.31 1.34 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.188 -1.184 . . . . 0.0 109.948 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 10.2 mp0 -139.64 144.43 37.66 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.155 -0.965 . . . . 0.0 110.344 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.604 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.6 p -132.1 161.4 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.284 -0.885 . . . . 0.0 110.018 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 38.4 t -166.78 100.07 0.56 Allowed 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.231 -0.918 . . . . 0.0 111.104 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.967 ' CD1' HD12 ' A' ' 121' ' ' ILE . 77.1 t80 -102.58 160.08 14.88 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.336 -0.852 . . . . 0.0 110.639 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 58.7 m-70 -137.83 -61.63 0.62 Allowed 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 178.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.56 150.75 44.07 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.536 -0.727 . . . . 0.0 109.278 178.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . 0.422 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.4 p -93.56 154.82 17.66 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.016 -1.053 . . . . 0.0 110.986 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.7 p -73.62 -25.14 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.569 0 O-C-N 121.334 -0.854 . . . . 0.0 111.598 -179.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -49.44 -59.06 4.07 Favored 'General case' 0 N--CA 1.517 2.879 0 O-C-N 120.873 -1.142 . . . . 0.0 110.167 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.509 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.9 p -127.65 -164.39 1.36 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.192 -0.942 . . . . 0.0 110.369 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . 0.426 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.93 63.38 0.56 Allowed Glycine 0 N--CA 1.492 2.381 0 N-CA-C 107.936 -2.066 . . . . 0.0 107.936 178.422 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 32.8 t -101.83 142.18 33.54 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.332 -1.099 . . . . 0.0 109.797 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 9.3 ttt85 -100.0 46.32 0.96 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.262 -0.899 . . . . 0.0 109.638 179.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 76.38 96.16 0.17 Allowed Glycine 0 N--CA 1.486 2.011 0 N-CA-C 109.883 -1.287 . . . . 0.0 109.883 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.4 p -108.25 126.01 52.33 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.333 -1.098 . . . . 0.0 110.161 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -146.65 148.93 32.57 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.153 -0.967 . . . . 0.0 110.308 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . 0.412 ' OG ' ' HB2' ' A' ' 102' ' ' LYS . 1.5 m -115.2 -54.14 2.57 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.291 -0.88 . . . . 0.0 110.695 -179.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 8.3 p -50.96 -37.63 45.76 Favored 'General case' 0 N--CA 1.513 2.702 0 O-C-N 121.002 -1.061 . . . . 0.0 111.017 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 . . . . . 0 N--CA 1.494 1.766 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.235 179.922 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.348 0 N-CA-C 109.614 -1.394 . . . . 0.0 109.614 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -131.27 62.78 0.64 Allowed Glycine 0 N--CA 1.493 2.46 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 3.2 m -141.34 85.44 11.84 Favored Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.191 -1.182 . . . . 0.0 110.266 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.31 -39.99 2.58 Favored 'Trans proline' 0 C--N 1.317 -1.085 0 O-C-N 123.376 1.198 . . . . 0.0 110.471 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 7.5 ttm-85 -135.75 40.31 2.76 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.2 -0.937 . . . . 0.0 110.219 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 75.8 mt -120.63 133.16 68.22 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 O-C-N 121.154 -0.966 . . . . 0.0 109.985 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -138.31 -59.86 0.62 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.257 -0.902 . . . . 0.0 110.227 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 33.1 m -134.62 161.44 35.11 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.174 -0.954 . . . . 0.0 110.234 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.28 149.03 42.47 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.198 -0.939 . . . . 0.0 110.105 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.26 51.1 1.96 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.11 -0.994 . . . . 0.0 110.269 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 88.6 p -133.84 39.63 3.14 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.185 -0.947 . . . . 0.0 110.407 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -134.04 84.41 42.95 Favored Pre-proline 0 N--CA 1.494 1.728 0 O-C-N 121.19 -0.943 . . . . 0.0 110.121 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.86 158.5 49.96 Favored 'Trans proline' 0 C--N 1.317 -1.094 0 O-C-N 123.373 1.196 . . . . 0.0 110.692 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.724 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -86.59 148.6 46.79 Favored Pre-proline 0 N--CA 1.504 2.233 0 O-C-N 121.391 -0.818 . . . . 0.0 109.63 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.407 ' HG2' HD13 ' A' ' 77' ' ' LEU . 44.1 Cg_endo -70.14 162.83 40.82 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.411 1.216 . . . . 0.0 110.919 -179.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -47.62 -32.34 5.45 Favored 'General case' 0 N--CA 1.515 2.796 0 O-C-N 121.431 -0.793 . . . . 0.0 111.596 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.99 -34.73 39.11 Favored Glycine 0 N--CA 1.5 2.918 0 O-C-N 121.039 -1.038 . . . . 0.0 110.514 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.7 t80 -55.84 -32.29 63.47 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.061 -1.258 . . . . 0.0 110.695 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -54.32 -38.65 66.24 Favored 'General case' 0 N--CA 1.513 2.71 0 O-C-N 120.913 -1.117 . . . . 0.0 110.147 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.22 -36.14 72.73 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.209 -0.932 . . . . 0.0 110.164 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.641 ' O ' HD12 ' A' ' 23' ' ' LEU . 3.0 pt -115.34 36.12 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 O-C-N 121.204 -0.935 . . . . 0.0 110.373 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.434 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.3 OUTLIER -84.06 -43.41 0.77 Allowed Pre-proline 0 N--CA 1.509 2.519 0 O-C-N 121.073 -1.017 . . . . 0.0 113.217 -179.187 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.434 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.2 Cg_endo -75.58 -36.39 2.25 Favored 'Trans proline' 0 N--CA 1.486 1.083 0 O-C-N 122.62 0.8 . . . . 0.0 111.634 -178.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.872 HG21 ' CE2' ' A' ' 62' ' ' TYR . 85.5 m -61.54 -46.65 89.04 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 120.938 -1.101 . . . . 0.0 109.756 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.692 HD13 ' HE2' ' A' ' 86' ' ' TYR . 4.9 mt -61.81 -39.22 90.99 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.48 -0.888 . . . . 0.0 109.632 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.421 ' O ' HD12 ' A' ' 28' ' ' ILE . 6.5 m -57.2 -35.7 69.95 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.137 -0.977 . . . . 0.0 110.295 179.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -57.63 -37.95 74.18 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.068 -1.02 . . . . 0.0 110.248 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.608 ' CD2' HD22 ' A' ' 55' ' ' LEU . 14.2 m-85 -59.0 -38.53 79.43 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.126 -0.984 . . . . 0.0 110.391 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -58.31 -39.36 79.17 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.175 -0.953 . . . . 0.0 110.309 -179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.437 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.4 mp -67.97 -41.19 84.41 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.279 0 C-N-CA 119.225 -0.99 . . . . 0.0 108.734 179.284 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.424 ' HB3' HD11 ' A' ' 55' ' ' LEU . 0.5 OUTLIER -66.74 -49.03 67.3 Favored 'General case' 0 N--CA 1.506 2.329 0 C-N-CA 119.177 -1.009 . . . . 0.0 108.341 178.565 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.085 HD11 HG23 ' A' ' 52' ' ' ILE . 4.3 tp -63.1 -36.21 82.82 Favored 'General case' 0 N--CA 1.508 2.434 0 C-N-CA 119.39 -0.924 . . . . 0.0 108.921 178.289 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.7 -38.03 74.51 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.117 -0.989 . . . . 0.0 110.298 179.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -64.56 -50.55 66.85 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.094 -1.004 . . . . 0.0 109.728 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.482 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -70.78 -36.57 73.12 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 119.202 -0.999 . . . . 0.0 109.48 179.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -72.2 -30.83 65.33 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.127 -0.983 . . . . 0.0 110.281 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.8 mmtt -95.11 -32.72 12.96 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 120.952 -1.093 . . . . 0.0 111.12 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -61.21 -39.34 89.86 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.02 -1.05 . . . . 0.0 109.994 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.3 tttt -56.89 -39.06 73.69 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.116 -0.99 . . . . 0.0 110.263 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.2 p -68.42 178.11 2.12 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.228 -0.92 . . . . 0.0 109.683 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.85 -71.01 0.08 Allowed 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.175 -0.953 . . . . 0.0 110.552 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -116.97 124.29 49.01 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.954 -1.091 . . . . 0.0 110.06 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.4 HD23 ' N ' ' A' ' 41' ' ' LEU . 0.6 OUTLIER -136.0 64.55 1.56 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.197 -0.94 . . . . 0.0 110.357 -179.901 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -115.19 -56.18 2.39 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.134 -0.979 . . . . 0.0 110.256 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -122.26 173.63 7.49 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.227 -0.921 . . . . 0.0 110.266 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 32.8 tptt 52.82 62.93 2.44 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.134 -0.979 . . . . 0.0 110.78 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.39 -57.02 2.32 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.179 -0.951 . . . . 0.0 110.07 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.406 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 15.4 m120 -58.4 -41.79 85.71 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.235 -0.916 . . . . 0.0 109.624 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -62.25 -37.4 85.29 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.297 -0.877 . . . . 0.0 109.988 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -66.04 -43.2 88.21 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.12 -0.988 . . . . 0.0 109.558 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.422 HD23 ' HA ' ' A' ' 49' ' ' LEU . 43.6 mt -64.47 -34.01 77.21 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.258 -0.901 . . . . 0.0 110.321 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.498 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 46.9 m0 -57.76 -40.73 80.45 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 120.929 -1.107 . . . . 0.0 109.724 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -59.73 -35.05 73.77 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.359 -0.937 . . . . 0.0 109.957 179.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 1.085 HG23 HD11 ' A' ' 30' ' ' LEU . 18.3 mt -72.04 -57.24 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.161 0 O-C-N 121.046 -1.034 . . . . 0.0 109.121 179.229 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 ptm -61.58 -26.9 68.26 Favored 'General case' 0 N--CA 1.507 2.421 0 C-N-CA 118.53 -1.268 . . . . 0.0 110.06 178.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -73.49 -39.78 64.6 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 120.723 -1.235 . . . . 0.0 108.708 177.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.608 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.0 mt -53.38 -30.5 40.16 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.087 -1.008 . . . . 0.0 110.303 178.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.48 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 15.9 t60 -57.73 -39.92 78.42 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.943 -1.098 . . . . 0.0 110.111 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.413 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 6.8 m170 -60.51 -46.95 88.25 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.172 -0.955 . . . . 0.0 109.442 179.23 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -61.17 -37.38 82.72 Favored 'General case' 0 N--CA 1.505 2.3 0 C-N-CA 119.463 -0.895 . . . . 0.0 109.57 179.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.447 ' HD3' ' CD1' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -67.16 -48.35 68.25 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.097 -1.002 . . . . 0.0 109.31 179.176 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.2 p -61.68 -38.46 87.87 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.185 -0.947 . . . . 0.0 109.383 179.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -37.71 88.5 Favored 'General case' 0 N--CA 1.507 2.401 0 C-N-CA 119.261 -0.975 . . . . 0.0 109.464 179.176 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.872 ' CE2' HG21 ' A' ' 22' ' ' THR . 42.2 t80 -61.1 -48.69 80.49 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.118 -0.989 . . . . 0.0 109.454 179.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.515 HD12 ' HB2' ' A' ' 87' ' ' ALA . 84.0 mt -76.25 -43.25 37.21 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 O-C-N 121.189 -0.944 . . . . 0.0 108.854 179.09 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.437 ' CE1' HG23 ' A' ' 92' ' ' ILE . 40.7 t80 -59.75 -24.94 64.46 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.408 -0.808 . . . . 0.0 110.39 178.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.417 HG23 ' HD3' ' A' ' 69' ' ' LYS . 85.5 m -88.35 -34.99 17.42 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.692 -1.255 . . . . 0.0 110.441 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.566 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.6 pp -82.88 -32.95 27.11 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 120.806 -1.184 . . . . 0.0 112.025 -179.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.506 ' N ' HD12 ' A' ' 66' ' ' LEU . 33.3 t80 -86.45 -37.16 18.59 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 120.714 -1.241 . . . . 0.0 111.835 -179.317 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.404 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 16.8 m-85 -93.22 -19.58 21.29 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 120.897 -1.127 . . . . 0.0 113.086 -178.116 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.417 ' HD3' HG23 ' A' ' 65' ' ' THR . 15.5 mtpt -116.54 -58.6 2.07 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.518 -1.364 . . . . 0.0 110.97 -179.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.406 ' HB2' ' HA ' ' A' ' 66' ' ' LEU . 0.8 OUTLIER -68.67 -29.21 67.63 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.082 -1.011 . . . . 0.0 110.873 -179.54 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.6 tttt 58.53 42.84 20.22 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.796 -1.19 . . . . 0.0 109.957 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.72 34.32 4.05 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.447 -0.783 . . . . 0.0 109.949 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.781 HG13 HD23 ' A' ' 77' ' ' LEU . 14.1 tt -153.41 162.41 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.156 -0.965 . . . . 0.0 109.728 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 49.7 m -107.93 148.35 29.76 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.056 -1.027 . . . . 0.0 110.406 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 13.0 ttmm -46.81 -32.34 3.63 Favored 'General case' 0 N--CA 1.514 2.763 0 O-C-N 121.262 -0.898 . . . . 0.0 111.417 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -62.27 -51.15 68.86 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 120.976 -1.078 . . . . 0.0 109.29 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.781 HD23 HG13 ' A' ' 73' ' ' ILE . 35.0 tp -65.94 -43.84 86.85 Favored 'General case' 0 N--CA 1.506 2.351 0 C-N-CA 119.202 -0.999 . . . . 0.0 108.528 178.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.418 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 19.3 t80 -60.73 -39.94 90.53 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.279 -0.888 . . . . 0.0 109.335 179.1 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -71.62 -42.22 67.91 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.11 -0.994 . . . . 0.0 108.823 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.724 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 81.7 t90 -56.76 -36.99 70.44 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 121.301 -0.874 . . . . 0.0 109.687 179.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.701 HD22 ' CD2' ' A' ' 86' ' ' TYR . 51.9 mt -68.85 -47.28 66.36 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.22 -0.925 . . . . 0.0 109.122 179.156 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 37.0 mm -57.77 -33.3 45.02 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.535 0 O-C-N 121.258 -0.901 . . . . 0.0 110.032 179.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.6 tmtt? -89.32 -11.77 42.47 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.965 -1.084 . . . . 0.0 112.48 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.449 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 71.5 mm-40 -108.52 22.68 15.6 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 120.475 -1.39 . . . . 0.0 112.206 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 15.8 tttt 74.96 73.99 0.1 Allowed 'General case' 0 N--CA 1.512 2.672 0 O-C-N 121.102 -0.998 . . . . 0.0 111.799 179.113 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.701 ' CD2' HD22 ' A' ' 81' ' ' LEU . 34.1 m-85 -134.54 -62.51 0.74 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.449 -0.782 . . . . 0.0 109.196 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.515 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -132.59 160.85 35.42 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.402 -0.811 . . . . 0.0 109.257 179.038 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.48 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.4 t70 -105.65 119.1 38.27 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.047 -1.033 . . . . 0.0 110.421 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.1 mmtt -60.87 -38.08 84.36 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 119.478 -0.889 . . . . 0.0 109.825 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.467 HD12 ' HA ' ' A' ' 90' ' ' LEU . 8.3 tp -60.29 -37.93 82.02 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.096 -1.003 . . . . 0.0 109.707 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.684 HD12 ' CZ3' ' A' ' 95' ' ' TRP . 0.2 OUTLIER -65.81 -55.82 15.15 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.096 -1.003 . . . . 0.0 108.895 179.21 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.437 HG23 ' CE1' ' A' ' 64' ' ' TYR . 39.6 mt -61.75 -36.02 71.11 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.475 0 C-N-CA 119.342 -0.943 . . . . 0.0 108.888 178.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.92 -39.95 91.02 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.09 -1.006 . . . . 0.0 109.354 178.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.427 ' HD2' ' CE1' ' A' ' 100' ' ' TYR . 10.8 mmtm -58.68 -44.25 90.2 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 121.154 -0.966 . . . . 0.0 109.501 179.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.684 ' CZ3' HD12 ' A' ' 91' ' ' LEU . 2.6 m0 -62.58 -34.97 78.04 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.192 -0.942 . . . . 0.0 110.153 179.378 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.41 ' NH1' ' OH ' ' A' ' 64' ' ' TYR . 0.3 OUTLIER -81.25 -31.9 33.54 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.02 -1.05 . . . . 0.0 110.79 179.757 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 23.6 mmtt -53.91 -176.73 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.711 0 O-C-N 120.899 -1.126 . . . . 0.0 110.582 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -103.38 134.52 46.62 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.241 -0.912 . . . . 0.0 109.808 179.201 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.42 14.2 45.36 Favored Glycine 0 N--CA 1.493 2.494 0 C-N-CA 120.2 -1.0 . . . . 0.0 110.863 -179.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.526 ' HB3' HD23 ' A' ' 103' ' ' LEU . 51.3 m-85 -123.03 72.49 1.1 Allowed 'General case' 0 N--CA 1.493 1.676 0 CA-C-N 119.43 1.615 . . . . 0.0 109.983 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.12 -36.46 12.65 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.159 -0.963 . . . . 0.0 110.468 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.77 77.21 1.74 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.006 -1.059 . . . . 0.0 110.565 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.526 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.0 OUTLIER -120.85 150.54 40.88 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.036 -1.04 . . . . 0.0 110.059 179.632 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.413 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.7 p -111.91 -32.59 6.55 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.173 -0.954 . . . . 0.0 112.98 -179.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.628 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.0 m -142.05 -168.5 2.71 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.204 -1.56 . . . . 0.0 110.156 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 62.1 mt -96.73 -38.46 9.9 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.252 -0.905 . . . . 0.0 110.122 178.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 22.9 ttt-85 -101.27 28.9 5.05 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 120.952 -1.093 . . . . 0.0 109.943 178.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.628 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.308 1.8 t -127.05 17.29 7.24 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.065 -1.022 . . . . 0.0 108.623 -179.801 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.47 HG23 ' C ' ' A' ' 108' ' ' CYS . 2.0 pt -156.35 34.38 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.062 0 O-C-N 120.806 -1.184 . . . . 0.0 111.05 -178.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.587 ' C ' HG23 ' A' ' 119' ' ' THR . 1.6 mt-30 -152.37 150.12 29.36 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.711 -1.243 . . . . 0.0 111.147 -178.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.428 ' HE3' ' OG1' ' A' ' 119' ' ' THR . 0.2 OUTLIER -101.29 -178.83 3.85 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.282 -0.886 . . . . 0.0 110.334 179.836 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -144.3 -59.44 0.38 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.27 -0.894 . . . . 0.0 110.182 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -115.37 -173.06 2.26 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.138 -0.976 . . . . 0.0 110.149 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 3.6 m -124.81 48.14 2.03 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.143 -0.973 . . . . 0.0 110.303 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 47.4 m-20 -145.56 -65.72 0.31 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.207 -0.933 . . . . 0.0 110.306 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -116.73 139.52 50.47 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.249 -0.907 . . . . 0.0 110.183 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 66.81 123.4 0.02 OUTLIER Glycine 0 N--CA 1.492 2.416 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 50.4 m -143.29 95.6 2.78 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.269 -1.136 . . . . 0.0 110.235 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.587 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.2 OUTLIER 56.68 171.94 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.086 -1.008 . . . . 0.0 110.373 -179.925 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 42.7 t -86.9 153.58 21.5 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.12 -0.988 . . . . 0.0 108.661 178.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.948 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -72.5 -30.89 35.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.378 0 O-C-N 121.079 -1.013 . . . . 0.0 111.627 -178.695 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.49 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.8 p -60.0 -35.73 75.67 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 120.593 -1.317 . . . . 0.0 110.396 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 7.0 ttt-85 -57.2 -32.85 66.91 Favored 'General case' 0 N--CA 1.512 2.626 0 O-C-N 121.077 -1.014 . . . . 0.0 109.925 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 61.9 t -79.99 124.4 83.07 Favored Pre-proline 0 N--CA 1.506 2.333 0 O-C-N 121.056 -1.028 . . . . 0.0 109.913 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -67.56 -179.73 2.12 Favored 'Trans proline' 0 N--CA 1.488 1.153 0 O-C-N 123.112 1.059 . . . . 0.0 110.87 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.19 -37.85 61.02 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.22 -0.925 . . . . 0.0 110.419 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.97 -40.83 81.57 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.025 -1.047 . . . . 0.0 110.092 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 22.7 tp60 -69.19 -41.54 77.01 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.339 -0.944 . . . . 0.0 109.238 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.608 HD11 HD11 ' A' ' 121' ' ' ILE . 9.4 mt -66.01 -38.73 89.19 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 121.21 -0.931 . . . . 0.0 109.517 179.023 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -60.61 -38.81 85.93 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.184 -0.947 . . . . 0.0 109.907 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -58.76 -37.9 77.27 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.141 -0.974 . . . . 0.0 110.382 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -64.35 -40.47 95.93 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.094 -1.004 . . . . 0.0 110.098 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.404 ' HA ' HG23 ' A' ' 138' ' ' THR . . . -66.48 -41.33 89.13 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.067 -1.021 . . . . 0.0 109.675 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 11.3 mmp_? -63.89 -34.81 78.8 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.227 -0.921 . . . . 0.0 110.254 179.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 9.9 mmmt -74.41 -31.81 62.46 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 120.958 -1.089 . . . . 0.0 110.956 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 29.2 mttm -99.76 22.28 11.25 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 120.882 -1.136 . . . . 0.0 111.804 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.0 46.42 55.71 Favored Glycine 0 N--CA 1.499 2.884 0 O-C-N 120.607 -1.308 . . . . 0.0 110.743 179.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.404 HG23 ' HA ' ' A' ' 133' ' ' ALA . 9.7 t -145.68 -163.79 1.8 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.145 -1.209 . . . . 0.0 110.32 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 12.6 mt-30 -131.85 171.44 13.54 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.132 -0.98 . . . . 0.0 110.213 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.7 p -159.18 160.96 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.209 -0.932 . . . . 0.0 110.859 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 30.3 t -168.63 96.87 0.39 Allowed 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.319 -0.863 . . . . 0.0 110.924 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.948 ' CD1' HD12 ' A' ' 121' ' ' ILE . 73.4 t80 -97.16 159.6 14.82 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.202 -0.936 . . . . 0.0 110.518 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 17.7 m170 -138.3 -61.24 0.6 Allowed 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 178.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -139.48 151.13 45.94 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.526 -0.734 . . . . 0.0 109.264 178.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . 0.416 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.0 p -92.52 155.71 17.63 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.065 -1.022 . . . . 0.0 111.024 -179.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.4 p -74.78 -23.09 17.51 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.435 -0.79 . . . . 0.0 111.7 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -51.72 -57.24 9.8 Favored 'General case' 0 N--CA 1.514 2.751 0 O-C-N 120.81 -1.181 . . . . 0.0 110.002 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.498 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.2 p -128.91 -164.15 1.36 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.281 -0.887 . . . . 0.0 110.385 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -102.11 62.43 0.51 Allowed Glycine 0 N--CA 1.493 2.459 0 N-CA-C 107.81 -2.116 . . . . 0.0 107.81 178.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 21.6 t -99.54 146.01 26.88 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.32 -1.106 . . . . 0.0 109.792 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 11.1 mtt85 -100.92 44.14 1.03 Allowed 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.219 -0.926 . . . . 0.0 109.689 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 76.67 97.18 0.17 Allowed Glycine 0 N--CA 1.486 2.033 0 N-CA-C 109.846 -1.302 . . . . 0.0 109.846 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.4 p -110.39 125.78 53.58 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.344 -1.092 . . . . 0.0 110.202 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -142.16 137.34 30.8 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.13 -0.981 . . . . 0.0 109.949 -179.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 1.1 m -105.27 42.07 1.28 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.137 -0.977 . . . . 0.0 109.689 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 2.3 m -157.43 -56.14 0.08 Allowed 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.246 -0.909 . . . . 0.0 110.634 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 . . . . . 0 N--CA 1.495 1.821 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.211 179.954 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.374 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -93.07 179.21 39.37 Favored Glycine 0 N--CA 1.494 2.5 0 N-CA-C 109.556 -1.417 . . . . 0.0 109.556 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.9 t -124.24 148.79 58.9 Favored Pre-proline 0 N--CA 1.495 1.779 0 O-C-N 121.246 -1.149 . . . . 0.0 110.177 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -72.89 120.9 6.91 Favored 'Trans proline' 0 C--N 1.318 -1.056 0 O-C-N 123.35 1.184 . . . . 0.0 110.506 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.86 119.27 9.01 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.177 -0.952 . . . . 0.0 110.36 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.441 HG23 ' O ' ' A' ' 4' ' ' ILE . 4.0 tt -155.19 57.4 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.161 -0.962 . . . . 0.0 110.645 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.5 mttm -116.29 -58.27 2.11 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.188 -0.945 . . . . 0.0 110.289 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 11.2 p -118.73 96.23 5.18 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.148 -0.97 . . . . 0.0 110.335 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 18.3 ttm-85 -122.0 -57.09 1.81 Allowed 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.174 -0.954 . . . . 0.0 110.344 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -121.38 154.67 36.18 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.151 -0.968 . . . . 0.0 110.228 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.5 m -130.05 -178.94 4.95 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.273 -0.892 . . . . 0.0 110.236 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.9 79.65 32.6 Favored Pre-proline 0 N--CA 1.494 1.739 0 O-C-N 121.212 -0.93 . . . . 0.0 110.209 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.482 ' O ' ' HB3' ' A' ' 12' ' ' ALA . 46.9 Cg_endo -73.01 158.05 50.17 Favored 'Trans proline' 0 C--N 1.317 -1.112 0 O-C-N 123.369 1.194 . . . . 0.0 110.588 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.758 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . 61.69 148.74 0.09 OUTLIER Pre-proline 0 N--CA 1.503 2.222 0 O-C-N 121.408 -0.808 . . . . 0.0 110.636 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.12 163.95 37.15 Favored 'Trans proline' 0 C--N 1.318 -1.059 0 O-C-N 123.307 1.162 . . . . 0.0 110.652 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -48.46 -32.23 7.48 Favored 'General case' 0 N--CA 1.515 2.801 0 O-C-N 121.483 -0.761 . . . . 0.0 111.375 -179.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.86 -34.12 50.84 Favored Glycine 0 N--CA 1.498 2.779 0 O-C-N 121.018 -1.051 . . . . 0.0 110.502 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.43 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 28.6 t80 -54.63 -32.55 59.16 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 120.999 -1.295 . . . . 0.0 110.76 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 -54.18 -37.9 65.0 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 121.006 -1.059 . . . . 0.0 110.18 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.0 mptt -58.63 -36.52 74.21 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.179 -0.951 . . . . 0.0 110.25 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.718 ' O ' HD12 ' A' ' 23' ' ' LEU . 3.3 pt -117.06 35.69 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.152 -0.968 . . . . 0.0 110.514 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.421 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 6.6 tmtt? -84.64 -43.21 0.71 Allowed Pre-proline 0 N--CA 1.508 2.451 0 O-C-N 121.093 -1.004 . . . . 0.0 113.265 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.421 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.8 Cg_endo -76.44 -38.01 1.17 Allowed 'Trans proline' 0 N--CA 1.487 1.134 0 O-C-N 122.603 0.791 . . . . 0.0 111.582 -178.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.781 HG21 ' CE2' ' A' ' 62' ' ' TYR . 86.0 m -59.73 -43.18 94.3 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 120.86 -1.15 . . . . 0.0 109.992 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.718 HD12 ' O ' ' A' ' 19' ' ' ILE . 1.6 mt -63.12 -37.98 89.35 Favored 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 119.487 -0.885 . . . . 0.0 109.772 179.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.439 ' O ' HD12 ' A' ' 28' ' ' ILE . 0.6 OUTLIER -57.6 -36.63 72.01 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.091 -1.005 . . . . 0.0 110.394 179.652 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -57.26 -37.38 72.25 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.091 -1.005 . . . . 0.0 110.256 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.752 ' CD2' HD22 ' A' ' 55' ' ' LEU . 13.3 m-85 -58.42 -38.98 78.54 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.091 -1.006 . . . . 0.0 110.556 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -60.84 -38.91 87.11 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.233 -0.917 . . . . 0.0 110.864 -179.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.439 HD12 ' O ' ' A' ' 24' ' ' THR . 3.2 mp -65.71 -39.23 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.415 0 C-N-CA 119.119 -1.032 . . . . 0.0 109.591 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.8 tt0 -72.16 -46.0 58.19 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.034 -1.041 . . . . 0.0 108.831 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.698 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -65.29 -33.76 76.75 Favored 'General case' 0 N--CA 1.508 2.44 0 C-N-CA 119.27 -0.972 . . . . 0.0 108.902 178.231 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -57.17 -39.51 75.46 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 120.994 -1.066 . . . . 0.0 110.011 179.349 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.83 -49.86 73.25 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.25 -0.98 . . . . 0.0 109.605 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.601 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -69.33 -39.39 78.23 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.18 -0.95 . . . . 0.0 109.352 179.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.642 ' HG3' HD23 ' A' ' 30' ' ' LEU . 10.8 mm-40 -69.73 -30.8 68.5 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.231 -0.918 . . . . 0.0 110.446 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -94.79 -31.24 13.84 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.85 -1.156 . . . . 0.0 111.261 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -56.68 -36.72 69.93 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 120.873 -1.142 . . . . 0.0 110.282 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.3 ttmt -53.79 -36.74 62.77 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 121.047 -1.033 . . . . 0.0 110.528 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.5 t -106.41 39.49 1.81 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.043 -1.036 . . . . 0.0 110.118 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -150.52 -58.84 0.18 Allowed 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.211 -0.931 . . . . 0.0 110.298 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -122.63 100.1 6.75 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.232 -0.918 . . . . 0.0 109.978 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.5 tt -117.71 69.43 0.77 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.123 -0.985 . . . . 0.0 110.076 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -112.13 -54.33 2.63 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.204 -0.935 . . . . 0.0 110.262 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -135.55 159.3 42.04 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.139 -0.976 . . . . 0.0 110.291 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 52.2 mmtt 52.87 95.26 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.095 -1.003 . . . . 0.0 110.935 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -121.53 -58.45 1.76 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.21 -0.931 . . . . 0.0 110.222 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -55.47 -38.41 69.06 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.202 -0.936 . . . . 0.0 109.821 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -58.0 -34.67 70.25 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.229 -0.919 . . . . 0.0 110.166 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -57.46 -41.02 79.77 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 120.948 -1.095 . . . . 0.0 109.953 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 93.4 mt -64.71 -38.62 91.6 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.254 -0.904 . . . . 0.0 109.885 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.502 ' O ' ' HE3' ' A' ' 53' ' ' MET . 39.9 m0 -58.18 -32.13 67.95 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.151 -0.968 . . . . 0.0 109.865 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -69.37 -33.33 72.9 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.643 -1.286 . . . . 0.0 109.624 178.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.698 HG23 ' CG ' ' A' ' 30' ' ' LEU . 68.4 mt -72.54 -51.1 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.298 0 O-C-N 120.904 -1.122 . . . . 0.0 109.39 179.305 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.502 ' HE3' ' O ' ' A' ' 50' ' ' TRP . 0.0 OUTLIER -61.02 -33.31 73.07 Favored 'General case' 0 N--CA 1.508 2.464 0 C-N-CA 118.799 -1.16 . . . . 0.0 109.648 179.07 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -62.48 -38.16 88.78 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.93 -1.106 . . . . 0.0 109.608 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.752 HD22 ' CD2' ' A' ' 26' ' ' PHE . 19.6 mt -53.79 -35.16 61.06 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.113 -0.992 . . . . 0.0 110.017 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.466 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 38.5 t60 -56.19 -38.81 71.47 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 120.98 -1.075 . . . . 0.0 109.881 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.428 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 10.4 m170 -61.42 -50.39 73.0 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.224 -0.923 . . . . 0.0 109.051 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -60.93 -38.7 86.72 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 119.468 -0.893 . . . . 0.0 109.271 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.415 ' HG3' ' CE2' ' A' ' 26' ' ' PHE . 5.2 mtt180 -62.23 -48.06 81.65 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.164 -0.96 . . . . 0.0 109.33 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 94.6 p -65.44 -39.09 91.65 Favored 'General case' 0 N--CA 1.503 2.204 0 C-N-CA 119.306 -0.958 . . . . 0.0 109.159 179.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 34.9 ttt85 -65.52 -39.82 92.24 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.111 -0.993 . . . . 0.0 109.134 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.781 ' CE2' HG21 ' A' ' 22' ' ' THR . 28.4 t80 -62.46 -50.41 71.59 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.119 -0.988 . . . . 0.0 109.344 179.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.563 HD12 ' HB2' ' A' ' 87' ' ' ALA . 91.6 mt -71.8 -39.49 68.15 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 O-C-N 121.221 -0.924 . . . . 0.0 109.255 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.454 ' HD2' HD13 ' A' ' 92' ' ' ILE . 13.5 t80 -65.15 -42.58 93.63 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.214 -0.929 . . . . 0.0 109.036 179.216 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 95.6 m -61.67 -41.45 97.57 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.134 -0.979 . . . . 0.0 110.389 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.554 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.17 -32.28 26.69 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 120.874 -1.141 . . . . 0.0 112.391 -178.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.451 ' N ' HD12 ' A' ' 66' ' ' LEU . 40.3 t80 -86.27 -32.24 21.22 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 120.755 -1.216 . . . . 0.0 111.714 -179.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -98.01 -19.42 18.02 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 120.806 -1.184 . . . . 0.0 112.487 -178.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.4 mttm -119.4 -58.5 1.91 Allowed 'General case' 0 N--CA 1.503 2.207 0 O-C-N 120.509 -1.369 . . . . 0.0 110.621 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 23.9 ttt-85 -65.14 -31.26 72.37 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.112 -0.992 . . . . 0.0 110.878 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.1 tptt 57.44 42.18 25.01 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.897 -1.127 . . . . 0.0 110.036 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.88 35.02 3.68 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.356 -0.84 . . . . 0.0 109.817 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.785 HG13 HD23 ' A' ' 77' ' ' LEU . 13.8 tt -154.14 162.53 2.0 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.235 -0.915 . . . . 0.0 109.84 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.1 t -108.85 147.44 32.11 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.13 -0.981 . . . . 0.0 110.299 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.7 ttmt -45.79 -31.96 2.31 Favored 'General case' 0 N--CA 1.516 2.837 0 O-C-N 121.289 -0.882 . . . . 0.0 111.604 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -62.35 -51.23 68.46 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 120.956 -1.09 . . . . 0.0 109.234 179.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.785 HD23 HG13 ' A' ' 73' ' ' ILE . 46.5 tp -66.25 -42.96 87.83 Favored 'General case' 0 N--CA 1.506 2.334 0 C-N-CA 119.274 -0.971 . . . . 0.0 108.52 178.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.547 ' HA ' HD12 ' A' ' 81' ' ' LEU . 17.0 t80 -61.41 -39.71 91.75 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 121.341 -0.849 . . . . 0.0 109.3 179.229 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -71.42 -42.45 68.27 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.059 -1.026 . . . . 0.0 108.724 178.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.758 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 80.9 t90 -56.34 -36.42 68.74 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.307 -0.871 . . . . 0.0 109.725 178.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.547 HD12 ' HA ' ' A' ' 78' ' ' TYR . 18.3 mt -69.04 -49.95 53.0 Favored 'General case' 0 N--CA 1.505 2.299 0 C-N-CA 119.393 -0.923 . . . . 0.0 108.916 179.029 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.1 mm -56.59 -32.86 38.28 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.584 0 O-C-N 121.202 -0.937 . . . . 0.0 109.954 179.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.9 mtpp -89.34 -14.89 34.64 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 120.877 -1.139 . . . . 0.0 112.208 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.441 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 5.6 mm-40 -105.73 22.36 15.68 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.593 -1.317 . . . . 0.0 112.069 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt 75.43 71.59 0.09 Allowed 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.041 -1.037 . . . . 0.0 111.916 179.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.636 ' HE2' HD13 ' A' ' 23' ' ' LEU . 32.6 m-85 -133.63 -62.77 0.77 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.488 -0.757 . . . . 0.0 108.977 179.272 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.563 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -134.03 163.02 30.48 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.451 -0.781 . . . . 0.0 109.202 179.215 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.466 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 16.4 t0 -112.19 111.53 22.49 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.088 -1.008 . . . . 0.0 110.482 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 28.0 mttt -57.94 -37.0 73.33 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.245 -0.909 . . . . 0.0 110.114 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.443 HD23 HD13 ' A' ' 106' ' ' LEU . 18.2 tp -57.88 -37.46 73.99 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.091 -1.006 . . . . 0.0 110.192 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.546 ' HA ' HD21 ' A' ' 106' ' ' LEU . 64.2 tp -72.79 -47.62 45.05 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.052 -1.03 . . . . 0.0 108.512 179.065 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.454 HD13 ' HD2' ' A' ' 64' ' ' TYR . 54.5 mt -60.55 -36.55 70.74 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.38 0 O-C-N 121.184 -0.947 . . . . 0.0 108.641 178.291 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.74 -39.27 84.23 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.086 -1.009 . . . . 0.0 109.275 178.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.408 ' HB3' ' CD2' ' A' ' 103' ' ' LEU . 8.7 mmtt -58.24 -42.65 86.82 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.062 -1.024 . . . . 0.0 109.434 179.344 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 6.9 m0 -68.29 -38.64 81.87 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.28 -0.888 . . . . 0.0 109.875 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.78 -31.94 67.13 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.225 -0.922 . . . . 0.0 110.476 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.0 mmtm -54.37 -176.56 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.671 0 O-C-N 120.927 -1.108 . . . . 0.0 110.498 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -104.76 134.24 48.24 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.184 -0.947 . . . . 0.0 109.823 179.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.69 10.19 55.64 Favored Glycine 0 N--CA 1.493 2.458 0 C-N-CA 120.19 -1.005 . . . . 0.0 111.129 -179.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -114.13 68.72 0.7 Allowed 'General case' 0 N--CA 1.495 1.808 0 CA-C-N 119.485 1.643 . . . . 0.0 110.044 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -90.22 -38.61 13.33 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.15 -0.969 . . . . 0.0 109.963 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.37 84.25 1.94 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.159 -0.963 . . . . 0.0 109.728 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.949 HD13 HD13 ' A' ' 109' ' ' ILE . 9.0 tp -125.86 137.13 53.73 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.373 -0.829 . . . . 0.0 109.881 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.428 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.6 p -111.37 -38.97 4.82 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.211 -0.931 . . . . 0.0 112.434 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.83 ' O ' HD11 ' A' ' 103' ' ' LEU . 5.9 m -138.75 -168.16 2.35 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 120.213 -1.554 . . . . 0.0 109.678 179.04 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.546 HD21 ' HA ' ' A' ' 91' ' ' LEU . 13.3 mt -97.99 -38.12 9.51 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 120.973 -1.079 . . . . 0.0 110.541 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 11.8 tpt85 -101.97 32.2 3.56 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 120.991 -1.068 . . . . 0.0 109.498 178.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.667 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.306 1.7 t -127.05 15.31 7.34 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.19 -0.944 . . . . 0.0 109.216 -179.289 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.949 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -158.26 36.91 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.333 0 O-C-N 120.842 -1.161 . . . . 0.0 110.658 -178.494 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.586 ' O ' HG23 ' A' ' 119' ' ' THR . 5.6 mm-40 -119.15 137.06 53.86 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 120.748 -1.22 . . . . 0.0 111.68 -178.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.558 ' HA ' ' HG1' ' A' ' 119' ' ' THR . 15.5 ptpt -137.62 -177.12 4.65 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.353 -0.842 . . . . 0.0 110.012 179.464 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -145.53 -59.32 0.33 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.126 -0.984 . . . . 0.0 110.421 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -120.11 -171.02 2.07 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.225 -0.922 . . . . 0.0 110.339 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 62.7 m -96.78 -36.89 10.49 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.216 -0.928 . . . . 0.0 110.682 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 55.9 t-20 -98.24 -43.29 7.03 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.935 -1.103 . . . . 0.0 110.44 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -113.63 88.63 2.89 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.17 -0.956 . . . . 0.0 110.363 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -142.35 169.77 25.31 Favored Glycine 0 N--CA 1.494 2.522 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.9 m -129.56 103.3 6.79 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.245 -1.15 . . . . 0.0 110.217 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.586 HG23 ' O ' ' A' ' 110' ' ' GLN . 5.4 m -141.92 166.0 25.93 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.296 -0.877 . . . . 0.0 110.316 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.441 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 45.8 t -82.44 154.02 25.37 Favored 'General case' 0 N--CA 1.5 2.067 0 C-N-CA 119.374 -0.93 . . . . 0.0 109.084 178.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.787 HD12 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -72.75 -37.16 54.68 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 O-C-N 121.082 -1.011 . . . . 0.0 110.796 -179.389 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.437 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 4.5 p -54.18 -32.74 56.36 Favored 'General case' 0 N--CA 1.512 2.671 0 O-C-N 120.727 -1.233 . . . . 0.0 111.021 -179.08 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.488 ' HG3' HG22 ' A' ' 109' ' ' ILE . 7.3 ttp85 -57.93 -34.06 69.46 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 120.909 -1.12 . . . . 0.0 109.641 178.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 62.0 t -81.42 125.09 79.68 Favored Pre-proline 0 N--CA 1.504 2.229 0 O-C-N 121.137 -0.977 . . . . 0.0 109.725 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.518 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.4 Cg_endo -65.77 172.87 7.61 Favored 'Trans proline' 0 N--CA 1.488 1.16 0 O-C-N 123.142 1.075 . . . . 0.0 110.772 179.604 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 2.0 tpt180 -75.07 -36.42 61.78 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.188 -0.945 . . . . 0.0 110.901 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.88 -44.01 91.06 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 120.943 -1.098 . . . . 0.0 109.985 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -65.27 -40.71 94.26 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.191 -0.943 . . . . 0.0 109.385 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.518 HD12 ' O ' ' A' ' 125' ' ' PRO . 1.4 mt -61.82 -40.85 96.7 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.199 -0.938 . . . . 0.0 109.757 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -58.18 -39.93 80.16 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.158 -0.964 . . . . 0.0 109.988 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -60.36 -36.8 78.86 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.19 -0.943 . . . . 0.0 110.056 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -62.75 -47.15 84.79 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.158 -0.964 . . . . 0.0 109.946 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.443 ' HA ' HG23 ' A' ' 138' ' ' THR . . . -63.29 -41.19 98.96 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.14 -0.975 . . . . 0.0 109.788 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 6.8 ttt85 -65.06 -32.59 74.38 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.226 -0.921 . . . . 0.0 110.378 179.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 31.7 mttt -81.78 -29.79 32.59 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 120.86 -1.15 . . . . 0.0 111.077 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 36.3 mttt -98.71 24.35 7.66 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 120.82 -1.175 . . . . 0.0 111.712 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.15 46.94 42.56 Favored Glycine 0 N--CA 1.5 2.951 0 O-C-N 120.772 -1.205 . . . . 0.0 111.119 179.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.443 HG23 ' HA ' ' A' ' 133' ' ' ALA . 9.3 t -148.35 -164.76 2.09 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.114 -1.227 . . . . 0.0 110.422 179.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . 0.408 ' HA ' ' HB1' ' A' ' 133' ' ' ALA . 58.6 mt-30 -132.65 159.57 39.22 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.185 -0.947 . . . . 0.0 110.283 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.8 p -147.34 161.01 8.3 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.227 -0.921 . . . . 0.0 110.24 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 25.5 t -170.57 83.51 0.1 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.188 -0.945 . . . . 0.0 111.167 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.787 ' CG ' HD12 ' A' ' 121' ' ' ILE . 52.0 t80 -95.02 159.07 15.19 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.139 -0.976 . . . . 0.0 110.263 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -135.81 -60.37 0.74 Allowed 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -138.71 151.9 47.54 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.401 -0.812 . . . . 0.0 109.518 179.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 26.5 p -93.6 156.1 16.92 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.157 -0.964 . . . . 0.0 110.891 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.8 p -74.55 -25.09 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 121.314 -0.866 . . . . 0.0 111.637 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 -50.88 -45.84 60.17 Favored 'General case' 0 N--CA 1.517 2.883 0 O-C-N 120.756 -1.215 . . . . 0.0 109.457 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.501 ' HB2' ' CE ' ' A' ' 53' ' ' MET . 29.1 p -143.43 177.52 8.39 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.348 -0.845 . . . . 0.0 110.537 179.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . 0.447 ' CA ' ' CE3' ' A' ' 50' ' ' TRP . . . -87.77 64.26 3.71 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 107.957 -2.057 . . . . 0.0 107.957 178.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 28.1 t -106.18 139.29 40.92 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.306 -1.114 . . . . 0.0 109.694 -179.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 31.1 mtt-85 -92.31 56.63 2.83 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.163 -0.961 . . . . 0.0 109.776 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 61.15 96.13 0.01 OUTLIER Glycine 0 N--CA 1.488 2.149 0 N-CA-C 109.764 -1.335 . . . . 0.0 109.764 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.8 p -105.13 129.21 53.58 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.288 -1.124 . . . . 0.0 110.4 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . 0.47 ' HB1' ' HD3' ' A' ' 125' ' ' PRO . . . -143.7 138.34 28.82 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.15 -0.968 . . . . 0.0 109.926 -179.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -103.03 -47.23 4.42 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.158 -0.964 . . . . 0.0 110.484 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 19.7 m -55.77 -39.81 71.74 Favored 'General case' 0 N--CA 1.512 2.646 0 O-C-N 121.142 -0.974 . . . . 0.0 110.521 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 . . . . . 0 N--CA 1.494 1.739 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.348 -179.914 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.366 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -85.64 167.27 40.45 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 45.3 t -121.32 81.55 37.99 Favored Pre-proline 0 N--CA 1.494 1.741 0 O-C-N 121.232 -1.157 . . . . 0.0 110.184 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.85 88.25 0.94 Allowed 'Trans proline' 0 C--N 1.315 -1.194 0 O-C-N 123.339 1.178 . . . . 0.0 110.444 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 36.2 mtt-85 -118.09 124.89 49.16 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.237 -0.915 . . . . 0.0 110.184 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 12.9 mt -117.76 126.43 74.78 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.264 -0.897 . . . . 0.0 109.935 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -121.99 85.05 2.35 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.17 -0.956 . . . . 0.0 110.131 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.1 t -142.35 179.67 6.8 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.286 -0.884 . . . . 0.0 110.299 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.1 mtt85 -126.89 98.88 5.51 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.243 -0.91 . . . . 0.0 110.151 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.5 mmt85 -132.78 165.38 24.68 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.189 -0.944 . . . . 0.0 110.249 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.8 t -116.45 141.26 48.41 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.305 -0.872 . . . . 0.0 110.006 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.2 mttt -142.39 171.21 7.5 Favored Pre-proline 0 N--CA 1.494 1.768 0 O-C-N 121.217 -0.927 . . . . 0.0 110.395 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.4 161.37 44.48 Favored 'Trans proline' 0 C--N 1.316 -1.145 0 O-C-N 123.509 1.268 . . . . 0.0 110.681 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.721 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -85.76 145.65 41.97 Favored Pre-proline 0 N--CA 1.505 2.294 0 C-N-CA 119.803 -0.759 . . . . 0.0 109.759 179.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.78 162.8 41.34 Favored 'Trans proline' 0 C--N 1.315 -1.185 0 O-C-N 123.34 1.179 . . . . 0.0 110.759 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -48.61 -31.87 7.31 Favored 'General case' 0 N--CA 1.514 2.772 0 O-C-N 121.444 -0.785 . . . . 0.0 111.408 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.78 -34.19 36.44 Favored Glycine 0 N--CA 1.5 2.947 0 O-C-N 120.871 -1.143 . . . . 0.0 110.569 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -55.16 -33.4 62.92 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 120.978 -1.307 . . . . 0.0 110.568 179.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -54.12 -37.12 63.99 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.064 -1.022 . . . . 0.0 110.227 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.9 mmtt -57.81 -35.63 71.1 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.155 -0.966 . . . . 0.0 110.27 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.868 HD12 HD11 ' A' ' 23' ' ' LEU . 3.7 pt -116.23 36.68 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.138 -0.976 . . . . 0.0 110.454 179.587 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.431 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.2 OUTLIER -84.68 -43.49 0.7 Allowed Pre-proline 0 N--CA 1.508 2.442 0 O-C-N 121.038 -1.039 . . . . 0.0 113.392 -179.21 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.2 Cg_endo -76.13 -38.33 1.19 Allowed 'Trans proline' 0 N--CA 1.488 1.149 0 O-C-N 122.51 0.742 . . . . 0.0 111.922 -178.037 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.675 HG21 ' CE2' ' A' ' 62' ' ' TYR . 85.0 m -59.56 -42.95 93.61 Favored 'General case' 0 N--CA 1.512 2.654 0 O-C-N 120.925 -1.11 . . . . 0.0 109.952 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.868 HD11 HD12 ' A' ' 19' ' ' ILE . 45.2 mt -65.55 -38.75 90.52 Favored 'General case' 0 N--CA 1.506 2.347 0 C-N-CA 119.404 -0.919 . . . . 0.0 109.31 179.296 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.0 m -57.7 -34.93 69.97 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.143 -0.973 . . . . 0.0 110.227 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -56.16 -36.87 68.81 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 121.015 -1.053 . . . . 0.0 110.235 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.624 ' CD1' HD22 ' A' ' 55' ' ' LEU . 15.4 m-85 -55.89 -36.79 68.02 Favored 'General case' 0 N--CA 1.511 2.621 0 O-C-N 121.108 -0.995 . . . . 0.0 110.256 179.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -57.13 -27.74 62.09 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.184 -0.947 . . . . 0.0 111.001 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.477 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.7 mp -76.67 -37.37 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 O-C-N 121.001 -1.062 . . . . 0.0 109.403 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.454 ' CG ' HD11 ' A' ' 55' ' ' LEU . 34.9 tp60 -79.24 -39.55 32.82 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 120.945 -1.097 . . . . 0.0 108.746 178.46 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.072 HD11 HG23 ' A' ' 52' ' ' ILE . 7.2 tp -70.21 -34.0 72.38 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.491 -0.884 . . . . 0.0 110.399 179.084 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.7 ptm85 -71.85 -36.14 70.07 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 120.824 -1.173 . . . . 0.0 109.746 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.14 -39.49 94.84 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.06 -1.025 . . . . 0.0 109.662 179.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.462 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -74.81 -40.98 60.79 Favored 'General case' 0 N--CA 1.505 2.287 0 C-N-CA 119.162 -1.015 . . . . 0.0 109.15 179.026 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -67.75 -29.97 69.32 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 119.531 -0.868 . . . . 0.0 110.423 179.357 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -87.08 -32.82 19.73 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.777 -1.202 . . . . 0.0 110.89 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -55.72 -37.55 68.57 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 120.923 -1.111 . . . . 0.0 110.386 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.44 -39.35 76.07 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 121.177 -0.952 . . . . 0.0 110.158 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 38.4 t 52.87 -166.85 0.06 Allowed 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.068 -1.02 . . . . 0.0 110.933 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.8 m -109.25 -51.93 2.82 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.281 -0.887 . . . . 0.0 110.311 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.9 mmmt -101.22 71.55 1.39 Allowed 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.205 -0.935 . . . . 0.0 109.789 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 15.8 tp -168.13 94.19 0.38 Allowed 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.254 -0.904 . . . . 0.0 110.762 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -98.0 106.11 18.36 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.229 -0.92 . . . . 0.0 110.325 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -168.49 109.81 0.54 Allowed 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.242 -0.911 . . . . 0.0 110.732 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 52.91 68.72 0.79 Allowed 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.013 -1.054 . . . . 0.0 110.546 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.1 m -98.3 -42.87 7.19 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.151 -0.968 . . . . 0.0 110.579 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.405 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 9.9 m120 -58.82 -40.12 83.21 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.171 -0.956 . . . . 0.0 109.977 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.426 ' HA ' ' CE3' ' A' ' 50' ' ' TRP . 20.7 mt-10 -60.12 -43.53 95.55 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.132 -0.98 . . . . 0.0 109.813 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.404 ' CG ' ' HA ' ' A' ' 33' ' ' ALA . 41.4 tp60 -62.89 -45.02 94.49 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.233 -0.917 . . . . 0.0 109.538 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.442 HD23 HD12 ' A' ' 52' ' ' ILE . 43.8 mt -59.29 -33.81 71.54 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.279 -0.888 . . . . 0.0 110.372 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.501 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 48.3 m0 -57.78 -40.55 80.07 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 120.834 -1.166 . . . . 0.0 109.581 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -62.41 -32.8 73.68 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 119.183 -1.007 . . . . 0.0 109.423 178.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 1.072 HG23 HD11 ' A' ' 30' ' ' LEU . 21.4 mt -71.04 -58.31 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.198 0 O-C-N 121.001 -1.062 . . . . 0.0 109.007 179.161 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 ptm -62.36 -29.11 70.23 Favored 'General case' 0 N--CA 1.508 2.448 0 C-N-CA 118.555 -1.258 . . . . 0.0 109.752 178.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -70.59 -38.75 74.08 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 120.859 -1.15 . . . . 0.0 109.124 178.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.624 HD22 ' CD1' ' A' ' 26' ' ' PHE . 11.0 mt -54.15 -32.87 56.47 Favored 'General case' 0 N--CA 1.513 2.696 0 O-C-N 121.054 -1.029 . . . . 0.0 110.214 178.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.44 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 6.7 t60 -55.94 -36.73 68.08 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.065 -1.022 . . . . 0.0 110.173 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.435 ' NE2' HD21 ' A' ' 91' ' ' LEU . 6.8 m170 -59.04 -47.32 85.65 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 121.023 -1.048 . . . . 0.0 109.544 179.352 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -59.73 -37.18 78.21 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.529 -0.868 . . . . 0.0 109.801 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.438 ' HG2' ' CE1' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -62.66 -48.29 79.99 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.096 -1.003 . . . . 0.0 109.447 179.421 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 26.6 p -62.99 -41.66 99.63 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.103 -0.998 . . . . 0.0 109.301 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.9 ttt85 -62.22 -40.27 95.57 Favored 'General case' 0 N--CA 1.505 2.314 0 C-N-CA 119.381 -0.928 . . . . 0.0 109.291 179.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.675 ' CE2' HG21 ' A' ' 22' ' ' THR . 43.5 t80 -63.3 -51.49 65.86 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.117 -0.989 . . . . 0.0 109.446 179.438 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.998 HD12 ' HB2' ' A' ' 87' ' ' ALA . 71.6 mt -68.99 -36.41 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.384 0 C-N-CA 119.303 -0.959 . . . . 0.0 109.422 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.45 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 10.3 t80 -67.54 -41.81 83.68 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.044 -1.035 . . . . 0.0 108.97 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 91.5 m -60.75 -40.97 94.45 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.071 -1.018 . . . . 0.0 110.143 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.632 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.8 pp -83.26 -36.36 24.61 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 120.966 -1.084 . . . . 0.0 112.411 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.607 ' N ' HD12 ' A' ' 66' ' ' LEU . 55.3 t80 -86.63 -35.26 19.49 Favored 'General case' 0 N--CA 1.512 2.641 0 O-C-N 120.608 -1.308 . . . . 0.0 111.826 -179.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.45 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 6.9 m-85 -98.36 -3.4 37.11 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 120.904 -1.123 . . . . 0.0 113.219 -178.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.79 -58.73 0.61 Allowed 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.352 -1.468 . . . . 0.0 110.8 179.437 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.412 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 11.7 tpt85 -62.52 -29.55 70.64 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 121.03 -1.043 . . . . 0.0 110.696 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 ttmm 59.72 44.26 14.4 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.819 -1.175 . . . . 0.0 110.021 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -118.2 37.73 3.92 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.389 -0.819 . . . . 0.0 109.87 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.72 HG13 HD23 ' A' ' 77' ' ' LEU . 14.8 tt -156.46 162.74 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.198 -0.939 . . . . 0.0 110.154 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 63.3 m -110.18 147.39 33.83 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.204 -0.935 . . . . 0.0 110.153 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.4 tttt -46.02 -32.21 2.69 Favored 'General case' 0 N--CA 1.516 2.864 0 O-C-N 121.328 -0.858 . . . . 0.0 111.606 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -62.11 -49.82 74.38 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.037 -1.039 . . . . 0.0 109.511 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.72 HD23 HG13 ' A' ' 73' ' ' ILE . 27.8 tp -67.39 -43.73 80.61 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 119.161 -1.016 . . . . 0.0 108.712 178.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.487 ' HA ' HD12 ' A' ' 81' ' ' LEU . 18.2 t80 -61.9 -38.13 87.21 Favored 'General case' 0 N--CA 1.506 2.327 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.325 179.135 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -73.73 -42.51 61.05 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.123 -0.986 . . . . 0.0 108.802 178.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.721 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 85.8 t90 -57.52 -37.01 72.32 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.31 -0.869 . . . . 0.0 109.712 178.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.541 HD22 ' CD2' ' A' ' 86' ' ' TYR . 14.6 mt -69.23 -48.57 61.6 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.21 -0.932 . . . . 0.0 108.897 179.089 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.497 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 32.4 mm -56.72 -31.74 35.95 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.614 0 O-C-N 121.124 -0.985 . . . . 0.0 109.911 179.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.7 mttt -86.67 -22.62 25.99 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 120.918 -1.114 . . . . 0.0 111.611 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.449 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 76.3 mm-40 -99.18 20.49 13.4 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 120.756 -1.215 . . . . 0.0 112.015 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.401 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 0.3 OUTLIER 74.03 77.22 0.12 Allowed 'General case' 0 N--CA 1.511 2.599 0 O-C-N 121.01 -1.056 . . . . 0.0 111.484 179.257 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.602 ' HE2' HD13 ' A' ' 23' ' ' LEU . 30.3 m-85 -135.69 -65.04 0.61 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.539 -0.726 . . . . 0.0 109.642 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.998 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -118.03 174.53 6.15 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.276 -0.89 . . . . 0.0 109.653 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.44 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 12.6 t0 -114.42 102.77 10.4 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.261 -0.899 . . . . 0.0 109.962 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.494 ' HG3' HD12 ' A' ' 82' ' ' ILE . 16.7 mttt -66.8 -40.21 88.02 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.303 -0.873 . . . . 0.0 109.886 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.759 HD23 HD13 ' A' ' 106' ' ' LEU . 60.7 tp -61.85 -40.3 94.85 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.188 -0.945 . . . . 0.0 109.735 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.657 ' N ' HD11 ' A' ' 106' ' ' LEU . 59.6 tp -71.93 -43.44 65.28 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.097 -1.002 . . . . 0.0 108.674 179.229 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 54.2 mt -58.36 -35.75 55.31 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.479 0 O-C-N 121.206 -0.934 . . . . 0.0 108.702 178.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.85 -39.52 83.8 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.17 -0.956 . . . . 0.0 109.091 178.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.432 ' CD ' ' CZ ' ' A' ' 100' ' ' TYR . 8.1 mmtm -57.17 -42.57 81.36 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.031 -1.043 . . . . 0.0 109.484 179.186 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.41 ' CZ3' ' HG ' ' A' ' 91' ' ' LEU . 2.7 m0 -65.36 -35.79 82.04 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.342 -0.849 . . . . 0.0 110.053 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.23 -31.78 38.49 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.125 -0.985 . . . . 0.0 110.655 179.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 20.4 mmtm -53.64 -176.86 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.706 0 O-C-N 120.996 -1.065 . . . . 0.0 110.745 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -104.62 135.46 45.99 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.211 -0.931 . . . . 0.0 109.765 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.04 11.94 53.52 Favored Glycine 0 N--CA 1.492 2.428 0 C-N-CA 120.262 -0.971 . . . . 0.0 110.993 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.563 ' HB3' HD23 ' A' ' 103' ' ' LEU . 48.4 m-85 -119.95 72.15 0.92 Allowed 'General case' 0 N--CA 1.492 1.664 0 CA-C-N 119.435 1.617 . . . . 0.0 109.973 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -93.69 -35.82 12.63 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.094 -1.004 . . . . 0.0 110.491 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -123.86 80.14 1.78 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.979 -1.075 . . . . 0.0 110.662 -179.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.563 HD23 ' HB3' ' A' ' 100' ' ' TYR . 2.8 pp -124.55 146.38 49.04 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.107 -0.996 . . . . 0.0 110.033 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.426 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.6 p -109.94 -30.87 7.61 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.154 -0.966 . . . . 0.0 112.967 -179.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.705 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.4 m -145.15 -169.79 3.28 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 120.194 -1.566 . . . . 0.0 110.098 179.39 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.759 HD13 HD23 ' A' ' 90' ' ' LEU . 16.7 mt -99.76 -35.99 9.61 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.295 -0.878 . . . . 0.0 110.227 178.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 3.3 ttt85 -103.06 33.69 3.17 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.869 -1.145 . . . . 0.0 109.653 178.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.705 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.276 1.6 t -124.82 -60.75 1.35 Allowed 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 105.18 -2.155 . . . . 0.0 105.18 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.718 ' O ' HG21 ' A' ' 119' ' ' THR . 4.2 pt -69.01 -21.95 25.9 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.671 0 O-C-N 120.879 -1.138 . . . . 0.0 110.784 176.47 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -130.61 151.83 50.65 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.837 -1.164 . . . . 0.0 109.756 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -116.26 -56.59 2.29 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.096 -1.002 . . . . 0.0 110.269 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -146.34 139.92 26.03 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.246 -0.909 . . . . 0.0 110.34 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 52.41 -173.57 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.036 -1.04 . . . . 0.0 110.668 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 16.2 m -106.86 76.99 1.14 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.151 -0.968 . . . . 0.0 110.086 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -140.36 -178.59 5.56 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.175 -0.953 . . . . 0.0 110.078 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -122.27 86.82 2.64 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.121 -0.987 . . . . 0.0 110.218 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -137.54 -73.91 0.06 OUTLIER Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.665 -1.374 . . . . 0.0 109.665 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 2.0 m -115.32 126.53 54.57 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.184 -1.186 . . . . 0.0 110.205 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.718 HG21 ' O ' ' A' ' 109' ' ' ILE . 0.4 OUTLIER -158.78 177.93 10.65 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.197 -0.939 . . . . 0.0 110.548 -179.922 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 34.2 t -59.35 154.97 15.59 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.137 -0.977 . . . . 0.0 109.485 179.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.956 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -76.84 -30.11 18.2 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.384 0 O-C-N 121.066 -1.021 . . . . 0.0 111.63 -179.013 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.48 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.7 p -58.67 -35.81 73.17 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 120.684 -1.26 . . . . 0.0 110.861 -178.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.18 -30.3 64.4 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 120.914 -1.116 . . . . 0.0 110.196 178.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.6 t -83.55 122.66 76.9 Favored Pre-proline 0 N--CA 1.505 2.303 0 O-C-N 120.976 -1.078 . . . . 0.0 110.217 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -66.08 179.2 2.0 Favored 'Trans proline' 0 N--CA 1.49 1.277 0 O-C-N 123.175 1.092 . . . . 0.0 110.94 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.26 -37.68 60.84 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.256 -0.902 . . . . 0.0 110.511 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.29 -40.62 78.19 Favored 'General case' 0 N--CA 1.511 2.622 0 O-C-N 121.047 -1.033 . . . . 0.0 110.057 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -70.41 -41.7 72.62 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 119.346 -0.941 . . . . 0.0 109.113 179.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.546 ' O ' HG11 ' A' ' 140' ' ' VAL . 4.3 mt -66.02 -38.77 89.27 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 121.288 -0.882 . . . . 0.0 109.402 178.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -59.95 -38.11 81.51 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.113 -0.992 . . . . 0.0 109.958 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -58.58 -37.75 76.46 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.064 -1.022 . . . . 0.0 110.379 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -63.84 -45.72 88.3 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.139 -0.976 . . . . 0.0 109.807 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.421 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -61.68 -40.97 96.84 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.169 -0.957 . . . . 0.0 109.776 179.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 34.7 mtt-85 -59.88 -36.12 76.25 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.245 -0.909 . . . . 0.0 110.121 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 20.7 mttm -70.54 -32.91 70.54 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.042 -1.036 . . . . 0.0 110.879 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 2.1 ttmm -100.59 22.01 12.48 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 120.97 -1.081 . . . . 0.0 111.713 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.18 45.98 57.04 Favored Glycine 0 N--CA 1.499 2.87 0 O-C-N 120.592 -1.318 . . . . 0.0 110.688 179.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.421 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.3 t -143.04 -165.46 2.07 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.186 -1.185 . . . . 0.0 110.164 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -134.35 149.48 50.85 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.147 -0.971 . . . . 0.0 110.302 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.546 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.7 p -130.98 161.34 41.17 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 121.241 -0.912 . . . . 0.0 109.954 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 30.3 t -166.17 100.2 0.63 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.187 -0.946 . . . . 0.0 111.19 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.956 ' CD1' HD12 ' A' ' 121' ' ' ILE . 74.3 t80 -101.31 160.54 14.32 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.311 -0.868 . . . . 0.0 110.371 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -138.44 -60.88 0.6 Allowed 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.05 149.25 41.43 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.392 -0.817 . . . . 0.0 109.419 179.122 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . 0.453 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.7 p -91.65 157.96 16.67 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 120.992 -1.067 . . . . 0.0 110.765 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 12.5 p -78.42 -23.06 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 O-C-N 121.29 -0.881 . . . . 0.0 111.906 -179.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -51.77 -57.92 7.88 Favored 'General case' 0 N--CA 1.515 2.825 0 O-C-N 120.725 -1.234 . . . . 0.0 109.956 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.501 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 24.2 p -126.78 -165.49 1.46 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.296 -0.878 . . . . 0.0 110.387 179.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . 0.416 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.42 65.07 0.58 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 107.891 -2.084 . . . . 0.0 107.891 178.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 33.6 t -101.72 141.76 34.09 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.344 -1.092 . . . . 0.0 109.813 -179.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 66.0 mtm-85 -100.38 43.56 1.05 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.18 -0.95 . . . . 0.0 109.772 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 80.61 95.55 0.39 Allowed Glycine 0 N--CA 1.486 2.002 0 N-CA-C 109.99 -1.244 . . . . 0.0 109.99 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.6 p -109.31 126.97 53.93 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.202 -1.176 . . . . 0.0 110.136 179.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -154.32 147.6 24.88 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.118 -0.989 . . . . 0.0 110.415 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -101.07 -45.32 5.43 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.228 -0.92 . . . . 0.0 110.542 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 2.4 m -57.8 -39.52 77.73 Favored 'General case' 0 N--CA 1.51 2.525 0 O-C-N 121.059 -1.026 . . . . 0.0 110.257 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 . . . . . 0 N--CA 1.495 1.781 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.254 179.917 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.296 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 135.98 -106.92 0.59 Allowed Glycine 0 N--CA 1.493 2.45 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 21.9 t -139.99 95.37 8.58 Favored Pre-proline 0 N--CA 1.494 1.733 0 O-C-N 121.202 -1.175 . . . . 0.0 110.222 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.72 78.54 2.06 Favored 'Trans proline' 0 C--N 1.317 -1.116 0 O-C-N 123.483 1.254 . . . . 0.0 110.449 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 11.6 mmt85 -134.87 -64.55 0.66 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.179 -0.951 . . . . 0.0 110.279 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 42.7 pt -133.65 40.88 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.321 -0.862 . . . . 0.0 110.25 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.6 mttt -131.78 98.75 4.56 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.193 -0.942 . . . . 0.0 110.232 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 10.4 m -131.92 158.95 40.07 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.204 -0.935 . . . . 0.0 110.276 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.6 ptt-85 -136.24 62.62 1.61 Allowed 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.261 -0.9 . . . . 0.0 110.197 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.0 ttt180 54.61 47.82 21.75 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.019 -1.05 . . . . 0.0 110.572 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.1 m -147.34 86.98 1.63 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.232 -0.918 . . . . 0.0 110.464 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.6 tptt -120.96 66.2 14.0 Favored Pre-proline 0 N--CA 1.494 1.73 0 O-C-N 121.173 -0.954 . . . . 0.0 110.019 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -73.13 158.57 48.97 Favored 'Trans proline' 0 C--N 1.318 -1.066 0 O-C-N 123.317 1.167 . . . . 0.0 110.846 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.685 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -104.65 149.68 37.72 Favored Pre-proline 0 N--CA 1.499 1.988 0 O-C-N 121.391 -0.818 . . . . 0.0 109.738 179.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.435 ' HG2' HD13 ' A' ' 77' ' ' LEU . 43.7 Cg_endo -69.72 162.76 40.82 Favored 'Trans proline' 0 C--N 1.314 -1.238 0 O-C-N 123.435 1.229 . . . . 0.0 110.84 -179.66 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -48.61 -31.43 6.63 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.417 -0.802 . . . . 0.0 111.532 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.41 -35.73 36.54 Favored Glycine 0 N--CA 1.499 2.881 0 O-C-N 120.958 -1.089 . . . . 0.0 110.6 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.427 ' CE2' ' HG2' ' A' ' 20' ' ' LYS . 22.7 t80 -56.98 -33.48 67.14 Favored 'General case' 0 N--CA 1.511 2.617 0 O-C-N 121.034 -1.274 . . . . 0.0 110.579 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -53.78 -38.71 64.76 Favored 'General case' 0 N--CA 1.512 2.647 0 O-C-N 120.991 -1.068 . . . . 0.0 110.166 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 79.6 mttt -60.73 -36.59 79.25 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.366 -0.833 . . . . 0.0 110.081 179.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.694 HD12 HD11 ' A' ' 23' ' ' LEU . 1.8 pt -114.32 33.49 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 O-C-N 121.247 -0.908 . . . . 0.0 110.757 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.427 ' HG2' ' CE2' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -83.99 -45.54 0.76 Allowed Pre-proline 0 N--CA 1.51 2.525 0 O-C-N 121.056 -1.027 . . . . 0.0 112.872 -179.279 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.412 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.3 Cg_endo -76.78 -36.45 1.55 Allowed 'Trans proline' 0 N--CA 1.485 1.017 0 O-C-N 122.688 0.836 . . . . 0.0 111.46 -178.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.789 HG21 ' CE2' ' A' ' 62' ' ' TYR . 87.1 m -59.08 -42.64 90.89 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 120.935 -1.103 . . . . 0.0 109.893 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.694 HD11 HD12 ' A' ' 19' ' ' ILE . 93.6 mt -66.11 -39.95 90.33 Favored 'General case' 0 N--CA 1.505 2.302 0 C-N-CA 119.442 -0.903 . . . . 0.0 109.468 179.314 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.9 m -57.95 -34.5 69.97 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.167 -0.958 . . . . 0.0 110.072 179.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -55.84 -35.14 66.07 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 121.018 -1.051 . . . . 0.0 110.332 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.724 ' CD2' HD22 ' A' ' 55' ' ' LEU . 15.0 m-85 -57.67 -39.45 77.12 Favored 'General case' 0 N--CA 1.51 2.526 0 O-C-N 121.006 -1.059 . . . . 0.0 110.486 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -59.99 -34.36 73.21 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.238 -0.914 . . . . 0.0 111.022 -179.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.4 mp -71.43 -39.62 71.53 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.369 0 O-C-N 121.017 -1.052 . . . . 0.0 109.265 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 -70.52 -43.77 68.94 Favored 'General case' 0 N--CA 1.507 2.378 0 C-N-CA 119.199 -1.0 . . . . 0.0 108.725 178.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.707 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -66.35 -34.92 79.06 Favored 'General case' 0 N--CA 1.506 2.357 0 C-N-CA 119.366 -0.933 . . . . 0.0 108.974 178.286 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -57.62 -40.61 79.53 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.102 -0.999 . . . . 0.0 109.962 179.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.95 -46.37 88.06 Favored 'General case' 0 N--CA 1.506 2.371 0 C-N-CA 119.301 -0.96 . . . . 0.0 109.829 -179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.549 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -67.89 -40.43 83.51 Favored 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 119.237 -0.985 . . . . 0.0 109.215 179.081 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -59.62 -35.06 73.62 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.249 -0.907 . . . . 0.0 110.346 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 46.4 mmtt -95.29 -38.49 10.51 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 120.992 -1.067 . . . . 0.0 110.641 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -57.41 -38.74 74.83 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 121.059 -1.025 . . . . 0.0 110.099 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.734 ' HE3' HD11 ' A' ' 49' ' ' LEU . 8.8 tttm -59.47 -49.5 77.55 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.139 -0.976 . . . . 0.0 109.952 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 6.2 t 51.04 -165.11 0.05 OUTLIER 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.024 -1.047 . . . . 0.0 110.803 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -112.87 -55.47 2.52 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.198 -0.939 . . . . 0.0 110.186 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.2 mtmm -142.16 54.9 1.46 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.269 -0.894 . . . . 0.0 110.2 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.9 tt -116.74 -56.65 2.26 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.099 -1.001 . . . . 0.0 110.293 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -117.12 -165.19 1.04 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.121 -0.987 . . . . 0.0 110.263 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -112.59 -169.96 1.58 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.116 -0.99 . . . . 0.0 110.157 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.0 mtmt 53.03 80.03 0.11 Allowed 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.977 -1.077 . . . . 0.0 110.731 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.423 ' OG ' ' N ' ' A' ' 46' ' ' ASN . 5.7 p -109.26 -53.57 2.64 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.271 -0.893 . . . . 0.0 110.228 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.423 ' N ' ' OG ' ' A' ' 45' ' ' SER . 3.1 m120 -57.09 -38.55 73.51 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.256 -0.902 . . . . 0.0 109.967 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.421 ' HA ' ' CE3' ' A' ' 50' ' ' TRP . 20.0 mt-10 -63.24 -41.09 99.04 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.155 -0.966 . . . . 0.0 109.797 179.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.0 tp60 -61.87 -39.99 93.83 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.141 -0.974 . . . . 0.0 109.782 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.734 HD11 ' HE3' ' A' ' 37' ' ' LYS . 12.5 mt -62.66 -36.87 84.24 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.188 -0.945 . . . . 0.0 110.283 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.514 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.9 m0 -54.41 -39.57 67.43 Favored 'General case' 0 N--CA 1.512 2.639 0 O-C-N 120.909 -1.119 . . . . 0.0 109.724 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -63.45 -38.08 89.77 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.258 -0.901 . . . . 0.0 109.635 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.707 HG23 ' CG ' ' A' ' 30' ' ' LEU . 78.8 mt -64.86 -44.96 96.23 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.394 0 O-C-N 121.135 -0.978 . . . . 0.0 109.173 179.632 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.463 ' CE ' ' HB3' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -68.17 -30.55 69.69 Favored 'General case' 0 N--CA 1.501 2.101 0 C-N-CA 118.889 -1.124 . . . . 0.0 109.743 178.999 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.446 ' N ' ' HG3' ' A' ' 53' ' ' MET . 48.1 mt-30 -67.39 -37.4 83.08 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.898 -1.126 . . . . 0.0 109.111 178.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.724 HD22 ' CD2' ' A' ' 26' ' ' PHE . 13.6 mt -52.35 -32.33 37.76 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.115 -0.99 . . . . 0.0 109.917 178.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.453 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 13.3 t60 -56.92 -40.27 76.01 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.023 -1.048 . . . . 0.0 109.389 179.024 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.423 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 8.0 m170 -60.44 -49.16 78.67 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.154 -0.966 . . . . 0.0 109.137 178.583 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -59.59 -39.45 84.19 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.343 -0.848 . . . . 0.0 109.365 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.426 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -62.42 -48.13 81.06 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.138 -0.976 . . . . 0.0 108.928 178.955 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 12.6 p -66.81 -40.57 88.09 Favored 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 119.384 -0.926 . . . . 0.0 108.699 178.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.8 ttt85 -63.01 -37.52 87.53 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.13 -0.981 . . . . 0.0 109.413 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.789 ' CE2' HG21 ' A' ' 22' ' ' THR . 44.5 t80 -61.1 -50.83 71.67 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.124 -0.985 . . . . 0.0 109.293 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.675 HD12 ' HB2' ' A' ' 87' ' ' ALA . 88.6 mt -73.33 -42.01 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.344 0 C-N-CA 119.37 -0.932 . . . . 0.0 108.855 179.06 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.507 ' CE1' HG23 ' A' ' 92' ' ' ILE . 47.7 t80 -57.85 -32.56 67.76 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.331 -0.855 . . . . 0.0 110.235 178.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 61.9 m -80.78 -36.97 31.08 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 120.881 -1.137 . . . . 0.0 110.59 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.622 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -82.93 -32.05 27.4 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 120.954 -1.092 . . . . 0.0 112.25 -179.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.503 ' HD1' HG23 ' A' ' 73' ' ' ILE . 90.3 t80 -86.47 -36.16 19.21 Favored 'General case' 0 N--CA 1.512 2.655 0 O-C-N 120.658 -1.277 . . . . 0.0 111.731 -179.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -98.56 -20.6 16.95 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 120.896 -1.128 . . . . 0.0 112.951 -178.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -119.27 -56.45 2.07 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 120.48 -1.387 . . . . 0.0 111.637 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.425 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 8.4 ttt-85 -66.76 -29.72 69.76 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.056 -1.027 . . . . 0.0 110.805 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 59.5 44.6 14.6 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.822 -1.174 . . . . 0.0 110.042 -179.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.52 37.17 3.3 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.336 -0.853 . . . . 0.0 109.523 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.774 HG13 HD23 ' A' ' 77' ' ' LEU . 13.6 tt -160.43 162.69 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 121.243 -0.911 . . . . 0.0 110.139 -179.583 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.8 p -108.26 148.83 29.43 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.135 -0.978 . . . . 0.0 110.024 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.8 tttt -46.71 -32.2 3.43 Favored 'General case' 0 N--CA 1.515 2.799 0 O-C-N 121.271 -0.893 . . . . 0.0 111.556 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -61.69 -50.32 72.94 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.917 -1.114 . . . . 0.0 109.337 179.542 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.774 HD23 HG13 ' A' ' 73' ' ' ILE . 34.8 tp -67.33 -42.16 84.04 Favored 'General case' 0 N--CA 1.504 2.235 0 C-N-CA 119.118 -1.033 . . . . 0.0 108.657 178.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.643 ' HA ' HD12 ' A' ' 81' ' ' LEU . 19.1 t80 -61.6 -39.71 92.19 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.227 -0.921 . . . . 0.0 109.194 178.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -70.36 -42.44 71.8 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.142 -0.974 . . . . 0.0 108.728 178.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.685 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 68.3 t90 -56.95 -35.16 68.79 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.215 -0.928 . . . . 0.0 109.859 178.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.643 HD12 ' HA ' ' A' ' 78' ' ' TYR . 13.2 mt -70.37 -49.82 45.24 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.077 -1.015 . . . . 0.0 108.902 179.116 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 36.1 mm -58.37 -32.52 45.36 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.567 0 O-C-N 121.26 -0.9 . . . . 0.0 110.032 179.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.9 mttm -89.27 -15.74 32.81 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 120.894 -1.128 . . . . 0.0 112.108 -179.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.426 ' HB2' ' CE1' ' A' ' 86' ' ' TYR . 26.3 mm-40 -105.36 20.64 18.54 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 120.581 -1.324 . . . . 0.0 112.063 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt 73.85 77.36 0.13 Allowed 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.05 -1.031 . . . . 0.0 111.578 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.466 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 28.6 m-85 -135.01 -63.45 0.69 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.531 -0.73 . . . . 0.0 109.711 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.675 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -120.23 -174.48 2.79 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.377 -0.827 . . . . 0.0 109.894 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.453 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.7 t0 -124.04 112.78 17.56 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.134 -0.979 . . . . 0.0 110.435 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -63.74 -40.74 97.46 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.117 -0.989 . . . . 0.0 109.395 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.488 ' HB3' HD13 ' A' ' 106' ' ' LEU . 13.0 tp -59.59 -40.64 88.11 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.126 -0.984 . . . . 0.0 109.596 179.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.688 HD12 ' CZ3' ' A' ' 95' ' ' TRP . 0.2 OUTLIER -65.22 -53.24 47.57 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.188 -0.945 . . . . 0.0 109.012 179.368 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.507 HG23 ' CE1' ' A' ' 64' ' ' TYR . 55.8 mt -62.32 -34.71 65.64 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.313 0 O-C-N 121.228 -0.92 . . . . 0.0 109.127 178.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.93 -40.07 91.08 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.052 -1.03 . . . . 0.0 109.9 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.652 ' HB3' HD22 ' A' ' 103' ' ' LEU . 9.4 mttp -64.98 -42.53 94.47 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.026 -1.047 . . . . 0.0 110.267 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.688 ' CZ3' HD12 ' A' ' 91' ' ' LEU . 3.1 m0 -62.15 -33.5 74.62 Favored 'General case' 0 N--CA 1.51 2.553 0 C-N-CA 118.983 -1.087 . . . . 0.0 110.107 178.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.12 -35.3 36.97 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 120.963 -1.086 . . . . 0.0 110.452 179.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.6 mmtp -53.13 -179.31 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.652 0 O-C-N 121.009 -1.057 . . . . 0.0 110.718 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.1 m -106.6 140.46 39.44 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.289 -0.882 . . . . 0.0 109.544 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 101.23 -24.53 31.5 Favored Glycine 0 N--CA 1.492 2.408 0 C-N-CA 119.834 -1.174 . . . . 0.0 110.45 -179.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.59 ' HB3' HD23 ' A' ' 103' ' ' LEU . 63.4 m-85 -91.95 58.56 3.41 Favored 'General case' 0 N--CA 1.503 2.224 0 CA-C-N 119.083 1.441 . . . . 0.0 110.047 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -71.18 -37.46 72.16 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.018 -1.051 . . . . 0.0 110.208 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.62 84.86 2.33 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.046 -1.034 . . . . 0.0 110.617 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.84 ' HB2' HD13 ' A' ' 109' ' ' ILE . 2.3 pp -120.54 140.83 50.9 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.086 -1.009 . . . . 0.0 110.303 179.583 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.423 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.5 p -108.03 -28.82 9.33 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.235 -0.916 . . . . 0.0 112.598 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.715 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 10.6 m -146.68 -169.83 3.37 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 120.366 -1.459 . . . . 0.0 110.005 179.314 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.661 HD21 ' HA ' ' A' ' 91' ' ' LEU . 93.9 mt -100.09 -35.1 9.8 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.211 -0.931 . . . . 0.0 110.583 178.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.92 36.67 2.37 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.757 -1.215 . . . . 0.0 109.187 178.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.715 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.284 1.6 t -127.72 -59.01 1.22 Allowed 'General case' 0 N--CA 1.498 1.946 0 N-CA-C 105.788 -1.931 . . . . 0.0 105.788 -179.411 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.84 HD13 ' HB2' ' A' ' 103' ' ' LEU . 18.8 pt -69.15 -26.22 31.49 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.617 0 O-C-N 121.001 -1.062 . . . . 0.0 110.741 177.034 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.414 ' N ' HG13 ' A' ' 109' ' ' ILE . 47.2 tt0 -124.6 161.96 25.1 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.865 -1.147 . . . . 0.0 110.175 -179.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.411 ' HE2' ' HA ' ' A' ' 119' ' ' THR . 7.3 tppt? -124.82 -57.93 1.51 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.145 -0.972 . . . . 0.0 110.369 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -115.74 -172.58 2.18 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.126 -0.984 . . . . 0.0 110.146 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -115.39 52.52 0.87 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.205 -0.935 . . . . 0.0 110.218 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.18 -58.8 0.34 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.152 -0.967 . . . . 0.0 110.414 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -144.62 -167.8 2.74 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.076 -1.015 . . . . 0.0 110.314 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -117.57 84.59 2.19 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.189 -0.944 . . . . 0.0 110.172 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -106.66 -55.27 0.66 Allowed Glycine 0 N--CA 1.493 2.465 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 1.5 m -126.46 120.53 29.96 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.221 -1.164 . . . . 0.0 110.306 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.759 HG21 ' O ' ' A' ' 109' ' ' ILE . 0.9 OUTLIER -140.96 177.46 8.03 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.206 -0.934 . . . . 0.0 109.877 179.931 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 35.1 t -55.48 153.68 7.28 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.047 -1.033 . . . . 0.0 110.047 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.801 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -74.22 -36.17 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.469 0 O-C-N 121.144 -0.973 . . . . 0.0 111.279 -179.07 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.483 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 10.7 p -52.72 -30.72 33.93 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.75 -1.219 . . . . 0.0 111.723 -178.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 1.5 ttt85 -61.61 -37.01 82.35 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 120.873 -1.142 . . . . 0.0 109.531 178.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 50.5 t -76.12 124.16 88.24 Favored Pre-proline 0 N--CA 1.505 2.286 0 O-C-N 121.109 -0.994 . . . . 0.0 110.031 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -66.09 172.83 8.07 Favored 'Trans proline' 0 N--CA 1.488 1.201 0 O-C-N 123.241 1.127 . . . . 0.0 110.707 179.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 27.1 mmm-85 -75.04 -36.2 61.88 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 121.19 -0.944 . . . . 0.0 110.675 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.05 -40.8 77.53 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 120.974 -1.079 . . . . 0.0 110.123 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -68.69 -41.6 78.93 Favored 'General case' 0 N--CA 1.506 2.348 0 C-N-CA 119.349 -0.94 . . . . 0.0 109.276 179.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.612 HD11 HD11 ' A' ' 121' ' ' ILE . 1.6 mt -64.53 -39.39 93.69 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.263 -0.898 . . . . 0.0 109.501 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -59.0 -37.82 77.75 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.181 -0.949 . . . . 0.0 110.13 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -58.15 -37.15 74.09 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.046 -1.034 . . . . 0.0 110.454 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.16 -47.67 81.69 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.237 -0.915 . . . . 0.0 109.892 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.582 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -61.2 -39.86 91.78 Favored 'General case' 0 N--CA 1.508 2.456 0 C-N-CA 119.33 -0.948 . . . . 0.0 109.787 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -37.33 79.63 Favored 'General case' 0 N--CA 1.512 2.631 0 O-C-N 121.174 -0.954 . . . . 0.0 110.149 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 13.5 mmtm -87.06 -38.86 16.14 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.084 -1.01 . . . . 0.0 110.261 179.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . 0.451 ' HB3' HG22 ' A' ' 138' ' ' THR . 0.1 OUTLIER -70.28 -26.71 63.93 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.14 -0.975 . . . . 0.0 111.158 179.668 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 91.69 32.28 8.73 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 110.006 -1.238 . . . . 0.0 110.006 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.582 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.6 t -139.96 -159.67 0.98 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.981 -1.305 . . . . 0.0 109.725 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -134.41 134.73 41.98 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.045 -1.034 . . . . 0.0 110.228 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 13.2 p -120.42 160.55 20.92 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.258 -0.902 . . . . 0.0 110.116 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 35.6 t -168.92 80.51 0.13 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.165 -0.959 . . . . 0.0 111.327 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.777 ' CG ' HD12 ' A' ' 121' ' ' ILE . 40.1 t80 -87.72 160.34 18.13 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.163 -0.961 . . . . 0.0 109.679 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -136.77 -61.26 0.68 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.515 -0.741 . . . . 0.0 109.092 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -135.57 153.25 51.75 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.435 -0.79 . . . . 0.0 109.504 179.184 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . 0.405 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.0 p -95.3 155.76 16.6 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.137 -0.977 . . . . 0.0 110.92 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.6 m -73.96 -25.85 20.66 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.522 0 O-C-N 121.271 -0.893 . . . . 0.0 111.814 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -51.64 -48.0 63.52 Favored 'General case' 0 N--CA 1.515 2.815 0 O-C-N 120.835 -1.166 . . . . 0.0 110.04 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.514 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 30.9 p -137.85 -168.87 2.43 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.161 -0.962 . . . . 0.0 111.01 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -98.85 57.41 0.93 Allowed Glycine 0 N--CA 1.492 2.429 0 N-CA-C 107.633 -2.187 . . . . 0.0 107.633 178.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 19.8 t -97.51 141.2 30.85 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.421 -1.046 . . . . 0.0 109.744 -179.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.21 51.74 1.11 Allowed 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.312 -0.868 . . . . 0.0 109.506 179.356 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 68.77 98.16 0.04 OUTLIER Glycine 0 N--CA 1.488 2.1 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.8 p -109.6 129.42 55.59 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.213 -1.169 . . . . 0.0 110.332 179.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -145.51 147.65 32.36 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.18 -0.95 . . . . 0.0 110.212 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.49 -48.28 3.47 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.206 -0.933 . . . . 0.0 110.735 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 37.5 p -51.32 -37.24 46.61 Favored 'General case' 0 N--CA 1.515 2.783 0 O-C-N 121.027 -1.045 . . . . 0.0 110.878 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 62.7 m-20 . . . . . 0 N--CA 1.495 1.815 0 CA-C-O 117.969 -1.015 . . . . 0.0 110.156 179.942 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.319 0 N-CA-C 109.489 -1.445 . . . . 0.0 109.489 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -79.27 -110.28 0.23 Allowed Glycine 0 N--CA 1.492 2.426 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.4 t -119.04 150.59 49.11 Favored Pre-proline 0 N--CA 1.494 1.759 0 O-C-N 121.208 -1.172 . . . . 0.0 110.222 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.59 174.72 11.24 Favored 'Trans proline' 0 C--N 1.316 -1.142 0 O-C-N 123.436 1.229 . . . . 0.0 110.388 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 12.7 mtp180 -132.9 118.89 19.47 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.067 -1.02 . . . . 0.0 110.258 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.461 ' N ' HD12 ' A' ' 4' ' ' ILE . 4.8 mp -128.88 71.6 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 O-C-N 121.258 -0.901 . . . . 0.0 109.849 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -158.59 174.53 14.92 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.186 -0.946 . . . . 0.0 110.811 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.426 ' O ' HG23 ' A' ' 6' ' ' THR . 7.7 t -144.42 59.07 1.33 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.153 -0.967 . . . . 0.0 110.41 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.8 ttm-85 59.97 113.51 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.148 -0.97 . . . . 0.0 110.718 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 13.4 mtp85 -107.6 159.83 16.15 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.055 -1.028 . . . . 0.0 110.116 179.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -116.38 -60.92 1.8 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.211 -0.931 . . . . 0.0 110.261 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.7 mtmp? -145.24 143.04 19.13 Favored Pre-proline 0 N--CA 1.495 1.789 0 O-C-N 121.127 -0.983 . . . . 0.0 110.392 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.475 ' O ' ' HB3' ' A' ' 12' ' ' ALA . 49.5 Cg_endo -74.89 158.24 42.73 Favored 'Trans proline' 0 C--N 1.318 -1.041 0 O-C-N 123.326 1.171 . . . . 0.0 110.484 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.75 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . 61.31 152.49 0.1 Allowed Pre-proline 0 N--CA 1.501 2.124 0 O-C-N 121.324 -0.86 . . . . 0.0 110.573 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -71.15 163.46 39.12 Favored 'Trans proline' 0 C--N 1.317 -1.113 0 O-C-N 123.309 1.162 . . . . 0.0 110.734 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -48.18 -32.51 7.14 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 121.479 -0.763 . . . . 0.0 111.358 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -54.37 -34.16 54.02 Favored Glycine 0 N--CA 1.497 2.744 0 O-C-N 120.984 -1.072 . . . . 0.0 110.431 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.471 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 27.5 t80 -54.46 -31.88 56.51 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.985 -1.303 . . . . 0.0 110.843 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.17 -37.73 64.78 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.02 -1.05 . . . . 0.0 110.272 179.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.7 mmmm -58.02 -35.78 71.76 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.232 -0.917 . . . . 0.0 110.342 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.818 HD12 HD11 ' A' ' 23' ' ' LEU . 2.8 pt -117.97 36.37 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.047 0 O-C-N 121.208 -0.933 . . . . 0.0 110.473 179.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.436 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -83.84 -43.64 0.79 Allowed Pre-proline 0 N--CA 1.508 2.448 0 O-C-N 120.998 -1.064 . . . . 0.0 113.132 -179.165 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.436 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.7 Cg_endo -76.66 -35.97 1.81 Allowed 'Trans proline' 0 N--CA 1.486 1.043 0 O-C-N 122.584 0.781 . . . . 0.0 111.869 -178.263 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.817 HG21 ' CE2' ' A' ' 62' ' ' TYR . 61.8 m -61.48 -47.16 86.92 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 120.893 -1.129 . . . . 0.0 110.015 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.818 HD11 HD12 ' A' ' 19' ' ' ILE . 10.9 mt -61.19 -38.07 85.21 Favored 'General case' 0 N--CA 1.509 2.487 0 C-N-CA 119.476 -0.89 . . . . 0.0 109.701 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.7 m -56.88 -35.43 68.93 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.07 -1.018 . . . . 0.0 110.278 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -56.82 -37.64 71.51 Favored 'General case' 0 N--CA 1.512 2.653 0 O-C-N 121.125 -0.985 . . . . 0.0 110.192 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.733 ' CD2' HD22 ' A' ' 55' ' ' LEU . 21.7 m-85 -58.92 -40.28 84.11 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.134 -0.979 . . . . 0.0 110.17 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -60.86 -23.16 64.94 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.269 -0.895 . . . . 0.0 111.471 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.554 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.7 mp -81.14 -34.59 13.65 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.313 0 O-C-N 120.829 -1.169 . . . . 0.0 109.719 179.428 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 57.5 tp60 -81.24 -37.03 29.23 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.898 -1.127 . . . . 0.0 109.211 178.448 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.734 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -73.43 -32.43 64.38 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.115 -0.991 . . . . 0.0 110.12 178.887 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.7 ptm180 -69.92 -36.7 75.57 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 120.842 -1.161 . . . . 0.0 109.742 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -64.82 -39.78 94.14 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.081 -1.012 . . . . 0.0 109.504 179.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.575 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -68.97 -41.7 77.56 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.15 -0.969 . . . . 0.0 109.369 179.18 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 9.2 mm-40 -61.64 -34.34 75.52 Favored 'General case' 0 N--CA 1.506 2.343 0 C-N-CA 119.568 -0.853 . . . . 0.0 110.449 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.2 mttt -94.02 -36.16 12.27 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 120.991 -1.068 . . . . 0.0 110.921 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -57.53 -38.38 74.61 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.031 -1.043 . . . . 0.0 110.238 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.1 ttpt -56.28 -40.32 74.09 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.045 -1.034 . . . . 0.0 110.147 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 52.11 -173.18 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.044 0 O-C-N 120.995 -1.066 . . . . 0.0 110.849 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.6 p -114.99 109.8 18.65 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.263 -0.898 . . . . 0.0 110.121 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 55.3 tttt 52.75 82.84 0.07 Allowed 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.069 -1.019 . . . . 0.0 110.714 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 44.1 tp -144.19 -58.95 0.38 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.292 -0.88 . . . . 0.0 110.436 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -120.53 -165.77 1.24 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.155 -0.966 . . . . 0.0 110.309 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -116.87 42.09 2.57 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.119 -0.988 . . . . 0.0 110.19 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.9 mtpt -144.02 64.48 1.32 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.391 -0.818 . . . . 0.0 110.118 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 m -104.58 -48.15 3.88 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.23 -0.919 . . . . 0.0 110.576 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.5 m-80 -57.55 -39.0 75.69 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.12 -0.988 . . . . 0.0 110.186 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -64.63 -44.24 91.14 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.141 -0.974 . . . . 0.0 109.61 179.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.8 tp60 -64.17 -41.41 97.15 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.224 -0.923 . . . . 0.0 109.481 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.628 HD23 HD12 ' A' ' 52' ' ' ILE . 12.9 mt -61.08 -36.94 81.0 Favored 'General case' 0 N--CA 1.507 2.412 0 C-N-CA 119.487 -0.885 . . . . 0.0 110.044 179.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.504 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 53.6 m0 -58.51 -38.43 77.67 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 120.993 -1.067 . . . . 0.0 110.105 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -62.17 -30.13 70.84 Favored 'General case' 0 N--CA 1.505 2.315 0 C-N-CA 119.147 -1.021 . . . . 0.0 109.802 178.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.734 HG23 ' CG ' ' A' ' 30' ' ' LEU . 77.6 mt -71.21 -57.58 7.24 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.288 0 O-C-N 120.886 -1.134 . . . . 0.0 109.284 179.41 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 ptm -62.44 -30.0 70.91 Favored 'General case' 0 N--CA 1.508 2.466 0 C-N-CA 118.621 -1.232 . . . . 0.0 109.77 179.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -67.34 -38.34 84.7 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 120.808 -1.182 . . . . 0.0 109.116 178.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.733 HD22 ' CD2' ' A' ' 26' ' ' PHE . 10.9 mt -53.13 -31.02 40.14 Favored 'General case' 0 N--CA 1.511 2.608 0 O-C-N 121.028 -1.045 . . . . 0.0 110.248 179.002 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.467 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 5.3 t60 -56.48 -38.35 71.61 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.007 -1.058 . . . . 0.0 109.965 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.503 ' CD2' HD21 ' A' ' 91' ' ' LEU . 5.4 m170 -60.38 -50.59 73.0 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.122 -0.986 . . . . 0.0 109.284 179.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.6 tp60 -59.38 -34.83 72.9 Favored 'General case' 0 N--CA 1.507 2.394 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.402 178.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.442 ' HD3' ' CE2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -66.52 -52.04 50.2 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.145 -0.972 . . . . 0.0 109.175 178.912 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.0 p -63.01 -38.37 90.91 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.208 -0.932 . . . . 0.0 109.2 179.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.426 ' O ' ' OG1' ' A' ' 65' ' ' THR . 1.5 ttt85 -64.59 -40.46 95.56 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.134 -0.979 . . . . 0.0 109.046 178.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.817 ' CE2' HG21 ' A' ' 22' ' ' THR . 38.6 t80 -62.19 -51.28 68.44 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.194 -0.941 . . . . 0.0 109.284 179.307 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.804 HD12 ' HB2' ' A' ' 87' ' ' ALA . 78.8 mt -69.41 -39.27 78.56 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.439 0 C-N-CA 119.453 -0.899 . . . . 0.0 109.247 179.304 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.409 ' HD2' HD13 ' A' ' 92' ' ' ILE . 12.6 t80 -65.12 -43.12 93.03 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.249 -0.907 . . . . 0.0 109.162 179.198 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.426 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 88.4 m -60.88 -41.8 96.69 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.083 -1.01 . . . . 0.0 110.468 -179.53 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.572 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.35 -32.59 26.17 Favored 'General case' 0 N--CA 1.503 2.207 0 C-N-CA 118.887 -1.125 . . . . 0.0 112.541 -178.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.455 ' N ' HD12 ' A' ' 66' ' ' LEU . 46.7 t80 -86.38 -32.24 21.06 Favored 'General case' 0 N--CA 1.512 2.666 0 O-C-N 120.605 -1.31 . . . . 0.0 111.851 -179.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.407 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 7.8 m-85 -98.27 -19.09 18.02 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 120.814 -1.179 . . . . 0.0 112.622 -178.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.404 ' HD3' ' HA ' ' A' ' 65' ' ' THR . 7.8 mtpt -121.18 -58.41 1.79 Allowed 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.501 -1.375 . . . . 0.0 110.916 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.411 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 6.9 ttm180 -64.71 -31.13 72.21 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.19 -0.944 . . . . 0.0 110.774 -179.504 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 57.93 43.16 21.82 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.814 -1.179 . . . . 0.0 110.019 -179.607 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.64 35.78 3.71 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.443 -0.785 . . . . 0.0 109.824 179.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.802 HG13 HD23 ' A' ' 77' ' ' LEU . 13.9 tt -154.52 162.67 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.26 -0.9 . . . . 0.0 109.98 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 4.6 t -109.31 146.46 34.29 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.128 -0.982 . . . . 0.0 110.192 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -45.03 -32.69 1.78 Allowed 'General case' 0 N--CA 1.516 2.851 0 O-C-N 121.316 -0.865 . . . . 0.0 111.728 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -61.53 -50.92 70.72 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 120.841 -1.162 . . . . 0.0 109.227 179.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.802 HD23 HG13 ' A' ' 73' ' ' ILE . 40.4 tp -66.8 -43.64 83.35 Favored 'General case' 0 N--CA 1.505 2.309 0 C-N-CA 119.252 -0.979 . . . . 0.0 108.46 178.628 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.433 ' HA ' HD12 ' A' ' 81' ' ' LEU . 16.9 t80 -60.38 -38.0 82.54 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.349 -0.844 . . . . 0.0 109.465 179.038 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.501 ' O ' HG22 ' A' ' 82' ' ' ILE . 34.8 t70 -74.8 -41.91 59.08 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.028 -1.045 . . . . 0.0 108.891 178.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.75 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 88.6 t90 -58.99 -38.92 80.29 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.168 -0.958 . . . . 0.0 109.245 178.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.468 HD23 ' CE2' ' A' ' 86' ' ' TYR . 13.9 mt -65.58 -54.88 21.74 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.226 -0.921 . . . . 0.0 109.244 179.056 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.632 HD12 ' HB3' ' A' ' 87' ' ' ALA . 0.8 OUTLIER -55.81 -27.43 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.512 0 O-C-N 121.077 -1.014 . . . . 0.0 110.751 -179.856 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.6 ttpm? -87.77 -21.99 24.81 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 120.943 -1.098 . . . . 0.0 111.582 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.446 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 27.4 mm-40 -99.87 23.44 9.73 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.684 -1.26 . . . . 0.0 111.866 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.412 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 7.8 ttpt 75.99 72.49 0.08 Allowed 'General case' 0 N--CA 1.512 2.64 0 O-C-N 121.177 -0.952 . . . . 0.0 111.743 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.751 ' HE2' HD13 ' A' ' 23' ' ' LEU . 32.0 m-85 -134.54 -62.55 0.74 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.516 -0.74 . . . . 0.0 109.218 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.804 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -129.67 -179.7 5.33 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.424 -0.798 . . . . 0.0 109.6 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.467 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 7.3 t0 -131.09 127.82 38.95 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.075 -1.016 . . . . 0.0 110.627 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 8.9 mttp -75.09 -37.44 61.54 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.242 -0.911 . . . . 0.0 109.835 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.444 HD12 ' HA ' ' A' ' 90' ' ' LEU . 13.8 tp -60.27 -42.33 95.18 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.079 -1.013 . . . . 0.0 109.932 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.503 HD21 ' CD2' ' A' ' 57' ' ' HIS . 53.6 tp -69.02 -50.05 52.2 Favored 'General case' 0 N--CA 1.505 2.277 0 C-N-CA 119.151 -1.02 . . . . 0.0 108.849 179.24 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.459 HG22 ' HD2' ' A' ' 96' ' ' ARG . 60.7 mt -59.37 -36.56 64.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.426 0 C-N-CA 119.142 -1.023 . . . . 0.0 108.693 178.282 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.88 -39.32 90.58 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.145 -0.972 . . . . 0.0 109.068 178.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.419 ' HD2' ' CE1' ' A' ' 100' ' ' TYR . 9.8 mmtm -57.1 -45.3 83.49 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.105 -0.997 . . . . 0.0 109.268 179.142 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.7 m0 -62.62 -36.68 83.57 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.402 -0.811 . . . . 0.0 110.003 179.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.459 ' HD2' HG22 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -75.59 -33.4 60.58 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.063 -1.023 . . . . 0.0 110.649 179.736 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.6 mmtt -53.65 -176.99 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.743 0 O-C-N 121.032 -1.042 . . . . 0.0 110.613 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 31.2 m -103.14 133.52 48.11 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.26 -0.9 . . . . 0.0 109.748 179.202 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.84 11.29 53.71 Favored Glycine 0 N--CA 1.494 2.52 0 C-N-CA 120.233 -0.984 . . . . 0.0 111.043 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.559 ' HB3' HD23 ' A' ' 103' ' ' LEU . 53.6 m-85 -118.71 71.02 0.83 Allowed 'General case' 0 N--CA 1.494 1.731 0 CA-C-N 119.463 1.631 . . . . 0.0 109.68 179.6 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -98.23 -33.87 10.94 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.065 -1.022 . . . . 0.0 111.336 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.58 60.59 1.08 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.99 -1.069 . . . . 0.0 111.088 -179.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.559 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.4 pp -108.91 151.76 25.84 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.906 -1.121 . . . . 0.0 109.618 179.082 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.427 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.5 p -112.72 -28.1 7.91 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.173 -0.954 . . . . 0.0 113.521 -178.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.638 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.7 m -144.05 -168.5 2.88 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 120.094 -1.629 . . . . 0.0 109.955 179.217 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' A' ' 106' ' ' LEU . 12.5 mt -95.62 -38.76 10.24 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.219 -0.926 . . . . 0.0 109.884 178.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 32.6 ttm-85 -102.22 29.63 5.01 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.032 -1.042 . . . . 0.0 110.129 178.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.638 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.8 t -127.67 17.23 6.91 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.053 -1.03 . . . . 0.0 108.935 -179.533 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.498 HG22 ' HG3' ' A' ' 123' ' ' ARG . 1.1 pt -158.07 38.68 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.264 0 O-C-N 120.863 -1.148 . . . . 0.0 110.179 -178.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.762 ' C ' HG23 ' A' ' 119' ' ' THR . 7.8 mt-30 -94.48 96.62 9.61 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.884 -1.135 . . . . 0.0 110.829 -178.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -110.01 -57.14 2.23 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.236 -0.915 . . . . 0.0 110.012 179.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 52.08 -174.14 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.025 -1.047 . . . . 0.0 110.903 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -117.47 40.8 2.97 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.211 -0.931 . . . . 0.0 110.215 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.78 -174.53 3.39 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.137 -0.977 . . . . 0.0 110.042 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -116.37 44.93 1.88 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.162 -0.961 . . . . 0.0 110.209 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -121.4 142.13 50.3 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.235 -0.915 . . . . 0.0 110.21 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 65.18 -163.37 38.43 Favored Glycine 0 N--CA 1.494 2.511 0 N-CA-C 109.471 -1.451 . . . . 0.0 109.471 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 29.4 m -144.34 170.97 15.0 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.209 -1.171 . . . . 0.0 110.398 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.762 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.5 m -116.76 171.37 7.93 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.155 -0.966 . . . . 0.0 110.155 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.423 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 48.8 t -94.48 154.17 17.55 Favored 'General case' 0 N--CA 1.495 1.807 0 C-N-CA 119.505 -0.878 . . . . 0.0 108.853 178.522 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.962 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -74.9 -31.2 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.445 0 O-C-N 121.051 -1.03 . . . . 0.0 111.606 -178.803 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.483 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.2 p -59.12 -35.73 73.97 Favored 'General case' 0 N--CA 1.512 2.625 0 O-C-N 120.663 -1.273 . . . . 0.0 110.594 -179.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.498 ' HG3' HG22 ' A' ' 109' ' ' ILE . 13.4 ttt-85 -57.31 -33.34 67.58 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.997 -1.065 . . . . 0.0 109.979 178.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.3 t -79.58 123.97 83.95 Favored Pre-proline 0 N--CA 1.506 2.372 0 O-C-N 121.092 -1.005 . . . . 0.0 110.117 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -67.01 178.72 2.72 Favored 'Trans proline' 0 N--CA 1.489 1.212 0 O-C-N 123.164 1.086 . . . . 0.0 110.801 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 25.1 mmm-85 -75.14 -37.39 61.4 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.238 -0.914 . . . . 0.0 110.422 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.36 -40.91 79.07 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.048 -1.033 . . . . 0.0 110.062 -179.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -69.64 -41.95 74.9 Favored 'General case' 0 N--CA 1.504 2.267 0 C-N-CA 119.31 -0.956 . . . . 0.0 109.193 179.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.61 ' O ' HG11 ' A' ' 140' ' ' VAL . 5.5 mt -66.56 -39.1 88.36 Favored 'General case' 0 N--CA 1.504 2.269 0 C-N-CA 119.41 -0.916 . . . . 0.0 109.422 178.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -60.86 -38.54 85.94 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.168 -0.957 . . . . 0.0 109.936 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -59.64 -38.98 82.85 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.163 -0.96 . . . . 0.0 110.203 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -61.54 -46.46 89.85 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.126 -0.984 . . . . 0.0 109.722 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.458 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -62.12 -43.88 97.86 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.209 -0.932 . . . . 0.0 109.651 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.29 -32.65 70.24 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.171 -0.955 . . . . 0.0 110.358 179.533 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 40.4 mttt -80.72 -30.03 36.3 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.988 -1.07 . . . . 0.0 111.136 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 46.5 mttt -99.05 25.04 7.09 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 120.817 -1.177 . . . . 0.0 111.593 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.16 46.97 50.78 Favored Glycine 0 N--CA 1.5 2.951 0 O-C-N 120.702 -1.249 . . . . 0.0 110.82 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.458 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.6 t -149.54 -165.65 2.34 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.114 -1.227 . . . . 0.0 110.604 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -133.64 153.38 51.72 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.179 -0.951 . . . . 0.0 110.396 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.61 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.8 p -133.21 161.57 41.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 121.215 -0.928 . . . . 0.0 110.161 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 34.3 t -167.43 99.1 0.5 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.195 -0.94 . . . . 0.0 111.149 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.962 ' CD1' HD12 ' A' ' 121' ' ' ILE . 81.5 t80 -103.49 160.06 15.05 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.184 -0.947 . . . . 0.0 110.67 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 6.5 m80 -138.23 -60.3 0.62 Allowed 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -143.97 148.69 35.67 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.446 -0.784 . . . . 0.0 109.184 178.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . 0.408 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.8 p -90.21 154.35 19.81 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.997 -1.064 . . . . 0.0 111.131 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.7 p -73.01 -24.71 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.457 0 C-N-CA 119.788 -0.765 . . . . 0.0 111.474 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -49.9 -60.54 2.82 Favored 'General case' 0 N--CA 1.516 2.871 0 O-C-N 120.933 -1.104 . . . . 0.0 110.047 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.504 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.7 p -126.41 -164.7 1.36 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.313 -0.867 . . . . 0.0 110.291 179.262 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . 0.431 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -101.34 65.72 0.49 Allowed Glycine 0 N--CA 1.493 2.481 0 N-CA-C 107.831 -2.108 . . . . 0.0 107.831 178.296 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 31.8 t -103.64 142.78 33.72 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.397 -1.06 . . . . 0.0 109.965 -178.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 26.4 mtt-85 -98.55 49.04 0.98 Allowed 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.247 -0.908 . . . . 0.0 109.42 179.002 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 71.56 99.01 0.06 OUTLIER Glycine 0 N--CA 1.486 2.007 0 N-CA-C 109.749 -1.34 . . . . 0.0 109.749 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 p -110.63 126.02 54.04 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.31 -1.112 . . . . 0.0 110.335 179.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -146.3 146.42 30.7 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.087 -1.008 . . . . 0.0 110.141 -179.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -103.02 -46.9 4.51 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.171 -0.955 . . . . 0.0 110.506 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 1.8 m -63.86 -40.51 96.73 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.056 -1.027 . . . . 0.0 110.012 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 . . . . . 0 N--CA 1.495 1.824 0 CA-C-O 118.039 -0.981 . . . . 0.0 110.56 179.947 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.235 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 120.41 -102.16 0.85 Allowed Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 35.4 p -129.96 163.01 50.25 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.207 -1.172 . . . . 0.0 110.288 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.88 117.44 5.12 Favored 'Trans proline' 0 C--N 1.317 -1.092 0 O-C-N 123.399 1.21 . . . . 0.0 110.49 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.88 53.04 1.22 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.126 -0.984 . . . . 0.0 110.051 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 69.7 mt -117.5 161.38 16.36 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.236 -0.915 . . . . 0.0 110.068 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.8 mmtp -132.36 133.95 44.58 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.205 -0.934 . . . . 0.0 110.17 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.7 t -149.16 -171.06 3.79 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.151 -0.968 . . . . 0.0 110.576 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 82.4 mtt85 -115.72 86.0 2.39 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.245 -0.909 . . . . 0.0 110.068 179.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.1 mmt85 -99.97 -39.65 8.04 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.159 -0.963 . . . . 0.0 110.791 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.3 t -111.33 158.48 18.99 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 120.989 -1.069 . . . . 0.0 110.399 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.06 162.91 53.92 Favored Pre-proline 0 N--CA 1.495 1.822 0 O-C-N 121.166 -0.959 . . . . 0.0 110.219 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.48 ' O ' ' HB3' ' A' ' 12' ' ' ALA . 45.3 Cg_endo -71.11 157.69 56.94 Favored 'Trans proline' 0 C--N 1.316 -1.134 0 O-C-N 123.42 1.221 . . . . 0.0 110.717 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.753 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . 62.52 142.33 0.06 OUTLIER Pre-proline 0 N--CA 1.502 2.158 0 O-C-N 121.332 -0.855 . . . . 0.0 110.704 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -73.97 162.5 38.98 Favored 'Trans proline' 0 C--N 1.318 -1.038 0 O-C-N 123.152 1.08 . . . . 0.0 110.599 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -49.26 -31.68 9.34 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 121.351 -0.843 . . . . 0.0 111.329 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.04 -33.95 45.55 Favored Glycine 0 N--CA 1.498 2.808 0 O-C-N 120.961 -1.087 . . . . 0.0 110.695 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -54.65 -32.92 59.92 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 120.862 -1.375 . . . . 0.0 110.734 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -54.33 -38.16 65.69 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 121.083 -1.011 . . . . 0.0 110.256 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -58.15 -35.07 70.99 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.294 -0.879 . . . . 0.0 110.341 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.649 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.7 pt -117.62 35.71 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.157 -0.965 . . . . 0.0 110.604 179.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.427 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -83.36 -43.73 0.84 Allowed Pre-proline 0 N--CA 1.509 2.492 0 O-C-N 121.037 -1.039 . . . . 0.0 113.186 -179.286 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.9 Cg_endo -75.48 -36.9 2.03 Favored 'Trans proline' 0 N--CA 1.486 1.087 0 O-C-N 122.656 0.819 . . . . 0.0 111.666 -178.151 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.805 HG21 ' CE2' ' A' ' 62' ' ' TYR . 69.9 m -61.04 -44.91 96.69 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 121.036 -1.04 . . . . 0.0 109.879 -179.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.649 HD12 ' O ' ' A' ' 19' ' ' ILE . 2.5 mt -62.77 -38.31 90.12 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.428 -0.909 . . . . 0.0 109.676 179.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.8 m -56.85 -35.04 68.4 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.096 -1.002 . . . . 0.0 110.371 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -56.9 -38.68 73.17 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.054 -1.029 . . . . 0.0 110.001 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.746 ' CD2' HD22 ' A' ' 55' ' ' LEU . 22.3 m-85 -59.05 -40.08 84.02 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.228 -0.92 . . . . 0.0 110.028 179.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -61.05 -22.59 64.72 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.266 -0.896 . . . . 0.0 111.501 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.537 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.9 mp -80.84 -36.1 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.465 0 O-C-N 120.836 -1.165 . . . . 0.0 109.571 179.566 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.511 ' HG2' HD11 ' A' ' 55' ' ' LEU . 23.7 tt0 -80.77 -37.11 30.92 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.028 -1.045 . . . . 0.0 108.9 178.378 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.736 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.4 OUTLIER -72.21 -33.51 67.67 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.18 -0.95 . . . . 0.0 110.135 178.896 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.0 ptm180 -70.71 -37.3 73.52 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.884 -1.135 . . . . 0.0 109.791 179.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.1 -39.14 92.74 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.04 -1.038 . . . . 0.0 109.54 179.199 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.529 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -66.65 -40.77 88.82 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.218 -0.927 . . . . 0.0 109.516 179.344 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -59.14 -35.77 74.07 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.213 -0.93 . . . . 0.0 110.475 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.9 mttt -94.96 -36.17 11.69 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 121.068 -1.02 . . . . 0.0 110.925 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -57.09 -37.37 71.82 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.007 -1.058 . . . . 0.0 110.379 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -56.61 -39.79 74.21 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.028 -1.045 . . . . 0.0 110.368 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.2 m 52.52 -166.25 0.06 Allowed 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.002 -1.061 . . . . 0.0 110.715 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.2 t -142.87 121.89 12.84 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.202 -0.936 . . . . 0.0 110.291 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.6 tmtm? 52.34 66.27 1.26 Allowed 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.07 -1.019 . . . . 0.0 110.866 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 tt -144.58 -59.14 0.37 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.094 -1.004 . . . . 0.0 110.29 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -130.29 -164.9 1.47 Allowed 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.189 -0.944 . . . . 0.0 110.088 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -113.52 -170.17 1.64 Allowed 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.207 -0.933 . . . . 0.0 110.176 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt 53.06 47.31 24.87 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.123 -0.985 . . . . 0.0 110.742 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -97.32 -39.48 9.2 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.219 -0.925 . . . . 0.0 110.655 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -57.35 -36.54 71.32 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.112 -0.993 . . . . 0.0 110.34 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.423 ' HA ' ' CE3' ' A' ' 50' ' ' TRP . 16.9 mt-10 -58.11 -39.77 79.51 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.137 -0.977 . . . . 0.0 110.201 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 43.4 tp60 -63.22 -43.05 99.21 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.385 -0.926 . . . . 0.0 109.643 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.643 HD23 HD12 ' A' ' 52' ' ' ILE . 12.5 mt -58.76 -37.78 77.02 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.109 -0.995 . . . . 0.0 110.166 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.499 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.8 m0 -59.81 -37.54 79.44 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.17 -0.956 . . . . 0.0 109.955 179.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -60.65 -29.77 69.48 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.012 -1.055 . . . . 0.0 109.705 178.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.736 HG23 ' CG ' ' A' ' 30' ' ' LEU . 77.2 mt -70.63 -60.42 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.289 0 O-C-N 121.024 -1.048 . . . . 0.0 108.918 179.157 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.6 ptm -61.24 -29.94 70.14 Favored 'General case' 0 N--CA 1.509 2.478 0 C-N-CA 118.691 -1.204 . . . . 0.0 109.778 178.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -68.06 -37.6 81.49 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.909 -1.12 . . . . 0.0 109.208 178.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.746 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.4 mt -53.22 -33.26 52.1 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.959 -1.088 . . . . 0.0 110.211 179.069 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.459 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 8.2 t60 -55.12 -36.79 66.1 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.057 -1.027 . . . . 0.0 110.178 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.562 ' CD2' HD21 ' A' ' 91' ' ' LEU . 5.8 m170 -59.86 -49.62 77.0 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.086 -1.008 . . . . 0.0 109.365 179.167 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 -61.06 -37.7 83.57 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.324 -0.95 . . . . 0.0 109.17 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.443 ' HD2' ' CD2' ' A' ' 26' ' ' PHE . 6.9 mtp85 -62.23 -49.16 76.83 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.213 -0.929 . . . . 0.0 109.167 178.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 87.5 p -63.34 -39.02 93.39 Favored 'General case' 0 N--CA 1.504 2.233 0 C-N-CA 119.415 -0.914 . . . . 0.0 109.257 179.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 33.6 ttp85 -64.67 -40.49 95.51 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.145 -0.972 . . . . 0.0 109.117 178.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.805 ' CE2' HG21 ' A' ' 22' ' ' THR . 38.0 t80 -63.05 -50.88 68.88 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.192 -0.942 . . . . 0.0 109.319 179.295 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.594 HD12 ' HB2' ' A' ' 87' ' ' ALA . 84.0 mt -69.65 -38.16 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.436 0 C-N-CA 119.386 -0.926 . . . . 0.0 109.341 179.27 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.461 ' HD2' HD13 ' A' ' 92' ' ' ILE . 12.4 t80 -66.42 -42.83 87.18 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.103 -0.998 . . . . 0.0 108.989 179.018 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.402 ' HA ' ' CD ' ' A' ' 69' ' ' LYS . 91.2 m -60.83 -40.64 93.55 Favored 'General case' 0 N--CA 1.502 2.173 0 C-N-CA 119.335 -0.946 . . . . 0.0 110.482 -179.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.575 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.22 -34.55 25.85 Favored 'General case' 0 N--CA 1.504 2.245 0 C-N-CA 118.796 -1.162 . . . . 0.0 112.54 -178.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.537 ' N ' HD12 ' A' ' 66' ' ' LEU . 33.5 t80 -86.52 -32.2 20.87 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 120.622 -1.299 . . . . 0.0 112.184 -179.212 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -98.35 -18.06 18.52 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.774 -1.203 . . . . 0.0 113.152 -178.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.402 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 4.6 mtpp -115.85 -57.24 2.25 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 120.46 -1.4 . . . . 0.0 110.993 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.5 mtt85 -76.02 -30.11 58.35 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.173 -0.954 . . . . 0.0 110.761 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.3 tptt 59.96 45.08 12.65 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 120.827 -1.17 . . . . 0.0 109.969 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -107.68 34.97 3.27 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.372 -0.83 . . . . 0.0 109.48 178.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.81 HG13 HD23 ' A' ' 77' ' ' LEU . 13.0 tt -151.82 162.68 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.239 -0.913 . . . . 0.0 109.742 -179.683 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 78.3 p -107.23 145.52 32.57 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.088 -1.008 . . . . 0.0 110.02 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -45.36 -32.84 2.23 Favored 'General case' 0 N--CA 1.518 2.932 0 O-C-N 121.328 -0.858 . . . . 0.0 111.455 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -60.94 -48.69 80.66 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 120.93 -1.106 . . . . 0.0 109.32 179.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.81 HD23 HG13 ' A' ' 73' ' ' ILE . 47.3 tp -68.26 -44.41 75.68 Favored 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 119.171 -1.011 . . . . 0.0 108.337 178.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.43 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 15.3 t80 -59.51 -37.29 77.92 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.389 -0.819 . . . . 0.0 109.557 179.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.418 ' O ' HG22 ' A' ' 82' ' ' ILE . 22.9 t70 -76.08 -41.67 49.81 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.125 -0.985 . . . . 0.0 108.842 178.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.753 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 82.9 t90 -58.82 -37.96 77.56 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.135 -0.978 . . . . 0.0 109.198 178.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.549 HD23 ' CE2' ' A' ' 86' ' ' TYR . 11.9 mt -66.95 -58.04 5.75 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.223 -0.923 . . . . 0.0 108.984 178.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.549 HD12 ' HB3' ' A' ' 87' ' ' ALA . 0.6 OUTLIER -56.19 -27.19 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 121.223 -0.923 . . . . 0.0 110.767 -179.976 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.6 ttpm? -89.13 -16.69 30.85 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 120.915 -1.115 . . . . 0.0 111.905 179.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.448 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 43.4 mm-40 -105.46 25.63 10.47 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 120.622 -1.299 . . . . 0.0 111.982 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.403 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 0.8 OUTLIER 76.47 68.37 0.06 Allowed 'General case' 0 N--CA 1.512 2.67 0 O-C-N 121.265 -0.897 . . . . 0.0 111.959 179.413 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.608 ' HE2' HD13 ' A' ' 23' ' ' LEU . 27.3 m-85 -131.12 -62.71 0.88 Allowed 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.594 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -134.84 168.4 19.12 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.476 -0.765 . . . . 0.0 109.303 179.281 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.459 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 15.3 t0 -116.09 109.92 18.16 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.093 -1.004 . . . . 0.0 110.555 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.513 ' N ' HD11 ' A' ' 82' ' ' ILE . 17.8 mttt -58.95 -38.04 78.12 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.208 -0.933 . . . . 0.0 109.927 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.64 HD23 HD13 ' A' ' 106' ' ' LEU . 18.0 tp -58.51 -38.22 77.22 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.131 -0.981 . . . . 0.0 110.033 179.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.562 HD21 ' CD2' ' A' ' 57' ' ' HIS . 58.4 tp -69.46 -47.23 64.64 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 120.996 -1.065 . . . . 0.0 108.856 179.299 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.461 HD13 ' HD2' ' A' ' 64' ' ' TYR . 72.8 mt -59.65 -39.16 78.85 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.42 0 O-C-N 121.155 -0.966 . . . . 0.0 108.527 178.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.17 -39.68 93.24 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.139 -0.976 . . . . 0.0 109.196 178.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.428 ' HB3' HD22 ' A' ' 103' ' ' LEU . 6.1 mmtm -56.74 -41.82 78.19 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.069 -1.019 . . . . 0.0 109.578 179.269 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.4 m0 -64.48 -33.65 76.37 Favored 'General case' 0 N--CA 1.507 2.41 0 C-N-CA 119.514 -0.875 . . . . 0.0 110.355 179.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -81.81 -34.51 30.23 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.089 -1.007 . . . . 0.0 110.586 179.523 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 25.3 mmtt -50.72 175.11 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.787 0 O-C-N 120.973 -1.079 . . . . 0.0 110.833 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 13.1 t -100.65 141.39 33.59 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.181 -0.949 . . . . 0.0 109.695 179.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.72 -24.96 30.09 Favored Glycine 0 N--CA 1.494 2.556 0 C-N-CA 119.888 -1.149 . . . . 0.0 110.523 -179.202 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.624 ' HB3' HD23 ' A' ' 103' ' ' LEU . 65.5 m-85 -91.82 58.11 3.36 Favored 'General case' 0 N--CA 1.503 2.206 0 CA-C-N 119.171 1.486 . . . . 0.0 110.225 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -71.96 -37.19 69.98 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.029 -1.044 . . . . 0.0 110.141 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -124.81 85.38 2.4 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.127 -0.983 . . . . 0.0 110.361 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.624 HD23 ' HB3' ' A' ' 100' ' ' TYR . 0.5 OUTLIER -126.05 150.1 48.38 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.149 -0.97 . . . . 0.0 110.35 179.72 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.476 ' N ' HD12 ' A' ' 103' ' ' LEU . 27.0 p -114.37 -31.35 6.29 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.227 -0.92 . . . . 0.0 113.144 -179.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.644 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.0 m -142.59 -167.94 2.63 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.171 -1.581 . . . . 0.0 109.928 179.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.64 HD13 HD23 ' A' ' 90' ' ' LEU . 15.3 mt -96.09 -39.56 9.66 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.266 -0.896 . . . . 0.0 109.943 179.035 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 46.7 ttt-85 -101.98 29.68 4.89 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 120.961 -1.087 . . . . 0.0 110.134 178.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.644 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.296 1.8 t -126.07 16.63 7.88 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.025 -1.047 . . . . 0.0 108.925 -179.784 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.461 HG23 ' C ' ' A' ' 108' ' ' CYS . 1.5 pt -156.29 34.56 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.17 0 O-C-N 120.791 -1.193 . . . . 0.0 110.776 -178.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.716 ' C ' HG23 ' A' ' 119' ' ' THR . 5.8 mt-30 -156.52 160.47 39.53 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 120.795 -1.191 . . . . 0.0 111.122 -179.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.451 ' HB3' ' OG1' ' A' ' 119' ' ' THR . 0.0 OUTLIER -116.81 -174.51 2.59 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.214 -0.929 . . . . 0.0 110.361 179.945 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 27.9 t30 -125.77 -57.66 1.43 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.248 -0.908 . . . . 0.0 110.364 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -140.79 -163.56 1.56 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.111 -0.993 . . . . 0.0 110.072 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -94.98 -42.13 8.8 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.125 -0.984 . . . . 0.0 109.916 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -118.34 39.22 3.49 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.15 -0.969 . . . . 0.0 110.113 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -165.75 49.87 0.09 Allowed 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.167 -0.958 . . . . 0.0 110.797 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 139.03 154.73 6.46 Favored Glycine 0 N--CA 1.493 2.455 0 N-CA-C 109.396 -1.482 . . . . 0.0 109.396 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 11.1 m -145.2 -166.12 2.34 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.208 -1.172 . . . . 0.0 110.406 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.716 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.2 OUTLIER -111.32 155.32 23.24 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.263 -0.898 . . . . 0.0 109.983 179.871 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 41.6 t -62.56 152.93 33.49 Favored 'General case' 0 N--CA 1.505 2.275 0 C-N-CA 118.962 -1.095 . . . . 0.0 108.985 179.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.81 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -75.57 -36.1 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 121.022 -1.049 . . . . 0.0 111.39 -178.803 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.466 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 10.8 p -53.46 -32.34 49.6 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 120.785 -1.197 . . . . 0.0 111.362 -178.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.47 HH12 HG21 ' A' ' 119' ' ' THR . 0.0 OUTLIER -59.91 -34.28 73.0 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 120.842 -1.161 . . . . 0.0 109.526 178.316 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.625 HG12 ' HG ' ' A' ' 129' ' ' LEU . 56.1 t -82.34 125.42 76.62 Favored Pre-proline 0 N--CA 1.503 2.22 0 O-C-N 121.053 -1.03 . . . . 0.0 109.647 179.457 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.511 ' HD3' ' HB1' ' A' ' 154' ' ' ALA . 38.7 Cg_endo -65.56 179.85 1.51 Allowed 'Trans proline' 0 N--CA 1.489 1.226 0 O-C-N 123.159 1.084 . . . . 0.0 110.721 179.589 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 2.6 tpp85 -75.18 -35.93 61.52 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.201 -0.937 . . . . 0.0 110.953 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.42 -47.38 86.35 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.023 -1.048 . . . . 0.0 109.797 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -64.62 -41.53 96.13 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.219 -0.926 . . . . 0.0 109.263 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.625 ' HG ' HG12 ' A' ' 124' ' ' VAL . 52.3 mt -62.59 -39.26 93.18 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.285 -0.884 . . . . 0.0 109.672 179.363 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -59.26 -39.62 83.44 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.102 -0.999 . . . . 0.0 110.059 179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -57.98 -36.53 72.74 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.145 -0.972 . . . . 0.0 110.467 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -59.74 -39.55 85.13 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.169 -0.957 . . . . 0.0 110.27 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.653 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -60.89 -44.91 96.47 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.082 -1.011 . . . . 0.0 109.93 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 10.4 mmt85 -59.72 -38.78 82.62 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.142 -0.974 . . . . 0.0 109.886 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 76.1 mttt -58.9 -36.35 74.55 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.147 -0.971 . . . . 0.0 110.554 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 22.6 mtmt -107.37 21.53 17.36 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.002 -1.061 . . . . 0.0 111.797 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.76 46.04 60.18 Favored Glycine 0 N--CA 1.5 2.918 0 O-C-N 120.648 -1.282 . . . . 0.0 110.545 179.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.653 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.9 t -140.6 -165.18 1.88 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.105 -1.232 . . . . 0.0 110.154 179.747 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -127.41 173.59 9.69 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.154 -0.966 . . . . 0.0 110.354 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.2 p -159.1 160.71 1.8 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.975 0 O-C-N 121.225 -0.922 . . . . 0.0 110.774 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 28.3 t -168.95 85.18 0.15 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.215 -0.928 . . . . 0.0 110.995 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.775 ' CG ' HD12 ' A' ' 121' ' ' ILE . 50.9 t80 -95.61 160.92 14.27 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.243 -0.911 . . . . 0.0 110.538 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 38.0 m80 -140.49 -60.54 0.51 Allowed 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.007 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -131.78 151.83 51.39 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.404 -0.81 . . . . 0.0 109.095 178.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . 0.404 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.8 p -95.57 153.65 17.6 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.027 -1.045 . . . . 0.0 110.96 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 27.3 m -71.98 -25.49 23.97 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.461 0 O-C-N 121.432 -0.793 . . . . 0.0 111.595 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -50.34 -61.67 2.04 Favored 'General case' 0 N--CA 1.514 2.748 0 O-C-N 120.888 -1.133 . . . . 0.0 110.336 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.499 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.3 p -124.56 -164.46 1.27 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.183 -0.948 . . . . 0.0 110.544 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.0 60.45 0.72 Allowed Glycine 0 N--CA 1.492 2.431 0 N-CA-C 108.13 -1.988 . . . . 0.0 108.13 178.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 28.4 t -102.26 142.44 33.48 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.333 -1.098 . . . . 0.0 109.818 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 6.2 mtt85 -99.04 49.04 0.96 Allowed 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.272 -0.892 . . . . 0.0 109.613 179.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 73.15 96.55 0.08 OUTLIER Glycine 0 N--CA 1.488 2.163 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.0 p -108.68 126.22 52.74 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.205 -1.174 . . . . 0.0 110.32 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . 0.511 ' HB1' ' HD3' ' A' ' 125' ' ' PRO . . . -152.77 148.93 27.81 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.098 -1.001 . . . . 0.0 110.467 -179.402 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 3.5 m -97.16 -38.35 9.75 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.328 -0.857 . . . . 0.0 110.572 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 5.5 m -55.05 -38.9 68.59 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 120.993 -1.067 . . . . 0.0 110.511 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.494 1.74 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.239 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.331 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 69.16 68.08 1.75 Allowed Glycine 0 N--CA 1.493 2.449 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -142.29 173.01 5.07 Favored Pre-proline 0 N--CA 1.494 1.736 0 O-C-N 121.231 -1.158 . . . . 0.0 110.214 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -72.19 -38.34 3.85 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.431 1.227 . . . . 0.0 110.672 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 16.5 ttt-85 53.69 88.59 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.076 -1.015 . . . . 0.0 110.689 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.0 pt -139.27 -172.78 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.189 -0.945 . . . . 0.0 110.264 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -130.28 105.01 7.62 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.132 -0.98 . . . . 0.0 110.233 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.0 p -120.2 -176.67 3.25 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.194 -0.941 . . . . 0.0 110.218 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.0 ttt85 -120.96 147.4 45.52 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.214 -0.929 . . . . 0.0 110.211 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.5 mtt85 -117.92 -174.92 2.73 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.235 -0.916 . . . . 0.0 110.249 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.42 ' OG ' ' N ' ' A' ' 10' ' ' LYS . 81.7 p -139.67 -62.38 0.52 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.171 -0.956 . . . . 0.0 110.197 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.42 ' N ' ' OG ' ' A' ' 9' ' ' SER . 5.2 mptt -129.08 82.93 67.5 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.217 -0.927 . . . . 0.0 110.209 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -73.84 159.77 44.59 Favored 'Trans proline' 0 C--N 1.317 -1.108 0 O-C-N 123.393 1.207 . . . . 0.0 110.696 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.843 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -67.83 135.72 92.24 Favored Pre-proline 0 N--CA 1.512 2.631 0 C-N-CA 119.511 -0.876 . . . . 0.0 109.009 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -84.36 82.68 1.8 Allowed 'Trans proline' 0 C--N 1.32 -0.922 0 O-C-N 123.129 1.068 . . . . 0.0 112.422 -178.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 48.73 92.67 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.258 -0.901 . . . . 0.0 111.737 178.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.73 -39.05 0.51 Allowed Glycine 0 N--CA 1.499 2.886 0 C-N-CA 119.792 -1.194 . . . . 0.0 110.538 179.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.605 ' N ' HD21 ' A' ' 77' ' ' LEU . 19.2 t80 -57.03 -29.74 63.63 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.063 -1.257 . . . . 0.0 110.462 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -52.86 -34.53 54.84 Favored 'General case' 0 N--CA 1.511 2.608 0 O-C-N 120.889 -1.132 . . . . 0.0 110.156 179.259 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.1 mtpp -58.73 -38.61 78.75 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.181 -0.949 . . . . 0.0 110.144 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.57 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.8 pt -116.74 36.58 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.17 -0.956 . . . . 0.0 110.43 179.765 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.423 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -84.08 -43.24 0.76 Allowed Pre-proline 0 N--CA 1.511 2.579 0 O-C-N 121.056 -1.028 . . . . 0.0 113.531 -178.804 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.2 Cg_endo -74.27 -34.55 4.66 Favored 'Trans proline' 0 N--CA 1.487 1.09 0 O-C-N 122.587 0.783 . . . . 0.0 112.043 -177.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.783 HG21 ' CE2' ' A' ' 62' ' ' TYR . 84.1 m -60.91 -43.56 98.4 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 120.973 -1.08 . . . . 0.0 110.071 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.57 HD12 ' O ' ' A' ' 19' ' ' ILE . 0.4 OUTLIER -63.46 -39.11 93.59 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.224 -0.923 . . . . 0.0 109.792 179.67 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -57.42 -35.04 69.55 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.102 -0.999 . . . . 0.0 110.29 179.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -57.31 -35.94 70.47 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.038 -1.039 . . . . 0.0 110.311 179.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.668 ' CD2' HD22 ' A' ' 55' ' ' LEU . 16.1 m-85 -57.67 -39.35 76.89 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.094 -1.003 . . . . 0.0 110.48 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -58.66 -39.69 81.36 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.223 -0.923 . . . . 0.0 110.487 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.42 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.1 mp -65.72 -41.1 89.68 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 C-N-CA 119.221 -0.992 . . . . 0.0 108.83 179.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -70.49 -49.59 46.81 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.198 -1.001 . . . . 0.0 108.619 178.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.048 HD11 HG23 ' A' ' 52' ' ' ILE . 0.9 OUTLIER -59.84 -34.46 73.13 Favored 'General case' 0 N--CA 1.507 2.42 0 C-N-CA 119.376 -0.929 . . . . 0.0 109.558 178.508 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 3.7 mtt85 -56.91 -39.63 74.78 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.041 -1.037 . . . . 0.0 110.071 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.48 -47.86 77.37 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.206 -0.997 . . . . 0.0 109.754 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.437 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -69.6 -37.93 77.08 Favored 'General case' 0 N--CA 1.504 2.265 0 C-N-CA 119.225 -0.99 . . . . 0.0 109.512 179.121 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 13.5 mt-30 -66.63 -32.73 74.25 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.222 -0.924 . . . . 0.0 110.277 179.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.1 mttp -95.05 -35.03 12.09 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 120.962 -1.086 . . . . 0.0 110.921 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -56.4 -37.77 70.6 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 120.988 -1.07 . . . . 0.0 110.261 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -58.43 -50.62 73.05 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.15 -0.969 . . . . 0.0 110.075 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 52.05 -166.55 0.05 Allowed 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.094 -1.004 . . . . 0.0 110.754 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.6 m -117.99 103.05 9.54 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.161 -0.962 . . . . 0.0 110.208 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 46.6 mttm 52.71 61.54 3.14 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.082 -1.011 . . . . 0.0 110.807 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.5 tp -121.46 -57.59 1.82 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.085 -1.01 . . . . 0.0 110.32 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -125.88 -164.92 1.36 Allowed 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.155 -0.966 . . . . 0.0 110.271 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -112.45 -169.75 1.53 Allowed 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.218 -0.926 . . . . 0.0 110.154 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 48.5 tttt 53.0 50.15 18.59 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.062 -1.024 . . . . 0.0 110.609 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -97.04 -40.68 8.73 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.236 -0.915 . . . . 0.0 110.488 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -58.63 -39.67 81.16 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.109 -0.994 . . . . 0.0 110.048 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -62.73 -42.5 99.69 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.266 -0.896 . . . . 0.0 109.829 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 58.1 tp60 -60.42 -39.26 86.78 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.168 -0.957 . . . . 0.0 109.872 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -57.85 -38.43 75.65 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.122 -0.986 . . . . 0.0 110.062 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.499 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.1 m0 -58.01 -36.12 72.24 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.157 -0.964 . . . . 0.0 109.989 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -61.95 -29.28 70.13 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.064 -1.022 . . . . 0.0 109.79 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 1.048 HG23 HD11 ' A' ' 30' ' ' LEU . 22.1 mt -72.26 -59.28 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.201 0 O-C-N 120.942 -1.099 . . . . 0.0 109.181 179.429 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.6 ptm -58.85 -27.89 65.56 Favored 'General case' 0 N--CA 1.511 2.6 0 C-N-CA 118.45 -1.3 . . . . 0.0 109.827 178.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.5 mm100 -69.86 -37.66 76.18 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 120.823 -1.173 . . . . 0.0 109.05 177.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.668 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.2 mt -53.36 -32.61 50.09 Favored 'General case' 0 N--CA 1.512 2.65 0 O-C-N 120.951 -1.093 . . . . 0.0 110.128 179.007 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.439 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 23.0 t60 -55.83 -36.82 67.9 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.145 -0.972 . . . . 0.0 110.198 179.73 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.424 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 7.4 m170 -59.64 -48.9 79.86 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.095 -1.003 . . . . 0.0 109.387 179.237 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.2 tp60 -58.37 -34.19 70.42 Favored 'General case' 0 N--CA 1.508 2.435 0 C-N-CA 119.461 -0.896 . . . . 0.0 109.573 178.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.467 ' HD3' ' CD1' ' A' ' 26' ' ' PHE . 38.8 mmm-85 -64.77 -52.87 54.64 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.031 -1.043 . . . . 0.0 109.28 179.066 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 84.5 p -64.02 -40.04 95.44 Favored 'General case' 0 N--CA 1.503 2.187 0 C-N-CA 119.3 -0.96 . . . . 0.0 108.997 179.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.423 ' HD3' ' OG1' ' A' ' 65' ' ' THR . 0.1 OUTLIER -63.11 -40.17 96.84 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.197 -0.939 . . . . 0.0 109.051 178.856 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.783 ' CE2' HG21 ' A' ' 22' ' ' THR . 30.5 t80 -63.58 -53.33 53.33 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.098 -1.001 . . . . 0.0 109.009 179.212 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.903 HD12 ' HB2' ' A' ' 87' ' ' ALA . 75.8 mt -65.64 -37.18 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.333 0 C-N-CA 119.223 -0.991 . . . . 0.0 109.19 179.307 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.438 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 8.1 t80 -66.03 -41.55 90.77 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.059 -1.026 . . . . 0.0 108.778 178.704 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.423 ' OG1' ' HD3' ' A' ' 61' ' ' ARG . 91.7 m -59.28 -41.44 88.92 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.211 -0.931 . . . . 0.0 110.806 -179.453 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.633 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.06 -34.9 26.1 Favored 'General case' 0 N--CA 1.505 2.282 0 C-N-CA 118.764 -1.174 . . . . 0.0 112.823 -178.523 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.56 ' N ' HD12 ' A' ' 66' ' ' LEU . 52.0 t80 -86.27 -32.02 21.32 Favored 'General case' 0 N--CA 1.514 2.751 0 O-C-N 120.564 -1.335 . . . . 0.0 111.961 -179.345 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.438 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 11.8 m-85 -97.05 -16.82 20.36 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 120.729 -1.232 . . . . 0.0 112.584 -178.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.419 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 5.8 mttt -124.74 -59.6 1.43 Allowed 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.495 -1.378 . . . . 0.0 110.996 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.406 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 5.2 ttt85 -59.94 -30.38 69.03 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.03 -1.044 . . . . 0.0 110.906 -179.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 27.2 tptt 57.1 41.2 27.69 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.803 -1.185 . . . . 0.0 110.131 -179.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.06 37.47 3.66 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.399 -0.813 . . . . 0.0 109.725 179.375 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.633 HG21 ' CD1' ' A' ' 66' ' ' LEU . 13.7 tt -154.23 162.77 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 O-C-N 121.249 -0.907 . . . . 0.0 109.904 -179.73 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 4.9 p -110.08 149.7 29.65 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.092 -1.005 . . . . 0.0 110.354 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 71.5 tttt -45.79 -32.35 2.5 Favored 'General case' 0 N--CA 1.515 2.799 0 O-C-N 121.338 -0.851 . . . . 0.0 111.596 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -65.49 -47.02 77.48 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 120.846 -1.159 . . . . 0.0 109.51 179.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.605 HD21 ' N ' ' A' ' 16' ' ' PHE . 0.3 OUTLIER -67.48 -41.61 84.27 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.183 -0.948 . . . . 0.0 108.727 179.02 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.453 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 14.6 t80 -67.85 -41.07 83.51 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.265 -0.897 . . . . 0.0 109.188 179.135 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -72.11 -40.7 67.98 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.19 -0.944 . . . . 0.0 108.795 178.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.843 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 80.5 t90 -55.11 -37.92 67.49 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.265 -0.897 . . . . 0.0 109.532 178.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.545 HD22 ' CD2' ' A' ' 86' ' ' TYR . 17.1 mt -69.69 -48.84 58.27 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 119.344 -0.942 . . . . 0.0 108.561 178.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.558 HD12 ' HG3' ' A' ' 89' ' ' LYS . 35.4 mm -57.4 -32.72 42.1 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.573 0 O-C-N 121.281 -0.887 . . . . 0.0 109.904 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.8 tttt -86.87 -23.9 25.09 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.952 -1.092 . . . . 0.0 111.589 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.428 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 16.7 mm-40 -97.39 19.4 13.31 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 120.707 -1.246 . . . . 0.0 111.948 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 28.2 tttt 73.38 80.53 0.13 Allowed 'General case' 0 N--CA 1.51 2.565 0 O-C-N 120.914 -1.116 . . . . 0.0 111.327 179.268 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.545 ' CD2' HD22 ' A' ' 81' ' ' LEU . 29.3 m-85 -137.24 -64.03 0.58 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.546 -0.722 . . . . 0.0 109.932 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.903 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -118.31 -172.55 2.29 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.419 -0.8 . . . . 0.0 109.593 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.439 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 7.1 t0 -122.56 102.77 8.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.058 -1.026 . . . . 0.0 110.373 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.558 ' HG3' HD12 ' A' ' 82' ' ' ILE . 12.0 mtpt -64.35 -40.19 95.38 Favored 'General case' 0 N--CA 1.508 2.429 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.63 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.574 HD23 HD13 ' A' ' 106' ' ' LEU . 32.4 tp -59.78 -37.21 78.44 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.23 -0.918 . . . . 0.0 110.056 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.564 HD21 ' CH2' ' A' ' 95' ' ' TRP . 34.3 tp -71.73 -48.16 48.86 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.005 -1.059 . . . . 0.0 108.756 179.142 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.485 HG22 ' HD2' ' A' ' 96' ' ' ARG . 50.7 mt -58.86 -36.19 60.01 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 C-N-CA 119.378 -0.929 . . . . 0.0 108.7 178.293 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.94 -39.48 83.44 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.128 -0.983 . . . . 0.0 109.062 178.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.427 ' HB3' ' CD2' ' A' ' 103' ' ' LEU . 7.1 mmtt -58.49 -44.35 89.34 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.139 -0.975 . . . . 0.0 109.364 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.564 ' CH2' HD21 ' A' ' 91' ' ' LEU . 7.8 m0 -65.72 -41.19 92.58 Favored 'General case' 0 N--CA 1.507 2.406 0 C-N-CA 119.557 -0.857 . . . . 0.0 109.506 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.485 ' HD2' HG22 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -65.71 -33.29 75.53 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.283 -0.885 . . . . 0.0 110.425 179.479 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.1 mmtp -54.31 -176.78 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.646 0 O-C-N 121.056 -1.028 . . . . 0.0 110.535 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 32.1 m -105.87 132.75 51.61 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.172 -0.955 . . . . 0.0 109.85 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 98.57 10.92 49.23 Favored Glycine 0 N--CA 1.492 2.427 0 C-N-CA 120.213 -0.994 . . . . 0.0 111.087 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -115.97 69.51 0.74 Allowed 'General case' 0 N--CA 1.495 1.778 0 CA-C-N 119.487 1.644 . . . . 0.0 110.117 179.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -92.08 -38.95 11.89 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.221 -0.924 . . . . 0.0 109.96 179.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -110.15 78.5 1.13 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.151 -0.968 . . . . 0.0 109.61 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.937 HD13 HD13 ' A' ' 109' ' ' ILE . 8.9 tp -122.23 137.87 54.69 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.242 -0.911 . . . . 0.0 109.823 -179.24 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.424 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 28.1 p -111.61 -38.6 4.86 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.234 -0.916 . . . . 0.0 112.483 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.821 ' O ' HD11 ' A' ' 103' ' ' LEU . 6.9 m -138.76 -168.49 2.42 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.17 -1.581 . . . . 0.0 109.85 179.077 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.574 HD13 HD23 ' A' ' 90' ' ' LEU . 13.9 mt -97.48 -38.15 9.7 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.177 -0.952 . . . . 0.0 110.295 179.189 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -102.2 31.34 4.02 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 120.953 -1.092 . . . . 0.0 109.804 178.221 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.676 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.7 t -125.86 16.28 8.01 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.131 -0.981 . . . . 0.0 108.929 -179.592 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.937 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -159.01 38.01 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.38 0 O-C-N 120.922 -1.111 . . . . 0.0 110.4 -178.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.575 ' O ' HG23 ' A' ' 119' ' ' THR . 2.0 tt0 -117.86 134.54 54.83 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.739 -1.226 . . . . 0.0 111.698 -178.273 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.497 ' HA ' ' HG1' ' A' ' 119' ' ' THR . 0.4 OUTLIER -138.73 155.56 48.12 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.372 -0.83 . . . . 0.0 110.122 179.357 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -135.95 165.9 24.59 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.171 -0.956 . . . . 0.0 110.185 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 52.86 -165.17 0.07 Allowed 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.035 -1.041 . . . . 0.0 110.55 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 31.8 m -109.29 110.76 22.03 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.085 -1.009 . . . . 0.0 109.989 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.5 m120 52.86 38.09 25.89 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.062 -1.024 . . . . 0.0 110.803 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -159.09 50.49 0.36 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.173 -0.954 . . . . 0.0 110.832 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -136.6 -158.0 7.9 Favored Glycine 0 N--CA 1.494 2.514 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 4.0 m -120.21 107.71 13.32 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.16 -1.2 . . . . 0.0 110.247 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.575 HG23 ' O ' ' A' ' 110' ' ' GLN . 4.4 m -138.01 166.71 23.4 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.223 -0.923 . . . . 0.0 110.249 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 48.6 t -87.17 154.15 20.95 Favored 'General case' 0 N--CA 1.499 2.017 0 C-N-CA 119.499 -0.88 . . . . 0.0 109.202 179.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.804 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -72.64 -36.11 52.46 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.433 0 O-C-N 121.16 -0.962 . . . . 0.0 111.012 -179.225 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 7.9 p -55.46 -34.32 64.42 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 120.846 -1.158 . . . . 0.0 110.911 -178.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.481 ' HG3' HG22 ' A' ' 109' ' ' ILE . 16.8 ttt-85 -59.32 -36.43 75.62 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 120.995 -1.066 . . . . 0.0 109.681 178.435 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 61.0 t -76.19 125.42 87.87 Favored Pre-proline 0 N--CA 1.504 2.24 0 O-C-N 121.171 -0.956 . . . . 0.0 109.795 179.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.495 ' O ' HD12 ' A' ' 129' ' ' LEU . 37.5 Cg_endo -64.02 178.2 1.59 Allowed 'Trans proline' 0 N--CA 1.49 1.283 0 O-C-N 123.228 1.12 . . . . 0.0 110.791 179.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.09 -37.27 61.61 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.22 -0.925 . . . . 0.0 110.635 -179.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.41 -41.64 85.4 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.013 -1.054 . . . . 0.0 109.929 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 37.3 tp60 -68.8 -41.44 78.69 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 119.395 -0.922 . . . . 0.0 109.103 179.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.62 HD11 HD11 ' A' ' 121' ' ' ILE . 3.9 mt -62.54 -38.69 90.99 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.288 -0.883 . . . . 0.0 109.757 179.306 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -60.2 -39.83 87.97 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.193 -0.942 . . . . 0.0 109.971 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -58.08 -35.88 72.03 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.151 -0.968 . . . . 0.0 110.475 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -59.98 -40.99 91.03 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.152 -0.968 . . . . 0.0 110.164 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.705 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -61.72 -45.02 95.76 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.144 -0.972 . . . . 0.0 109.798 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 15.2 mtp85 -58.69 -38.7 78.82 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.208 -0.932 . . . . 0.0 109.929 179.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -58.01 -36.38 72.59 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.17 -0.956 . . . . 0.0 110.486 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 2.6 mtpm? -107.82 21.08 17.94 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.008 -1.057 . . . . 0.0 111.806 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 53.88 45.87 69.62 Favored Glycine 0 N--CA 1.499 2.85 0 O-C-N 120.572 -1.33 . . . . 0.0 110.467 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.705 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.7 t -141.68 -164.36 1.76 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.217 -1.167 . . . . 0.0 110.145 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -130.46 155.1 47.01 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.12 -0.988 . . . . 0.0 110.237 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.512 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.4 p -131.51 161.52 41.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.213 -0.929 . . . . 0.0 110.148 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 31.2 t -165.53 86.01 0.37 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.24 -0.913 . . . . 0.0 111.087 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.764 ' CG ' HD12 ' A' ' 121' ' ' ILE . 52.0 t80 -97.26 159.57 14.84 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.216 -0.927 . . . . 0.0 110.382 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 22.5 m80 -138.08 -61.13 0.62 Allowed 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 179.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -133.73 151.01 51.5 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.418 -0.801 . . . . 0.0 108.93 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . 0.402 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.6 p -91.98 152.53 19.97 Favored 'General case' 0 N--CA 1.505 2.285 0 C-N-CA 119.063 -1.055 . . . . 0.0 111.142 -179.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 23.2 m -69.71 -26.46 30.69 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.449 0 C-N-CA 119.748 -0.781 . . . . 0.0 111.347 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.1 m-70 -50.91 -60.18 3.35 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 120.84 -1.163 . . . . 0.0 110.142 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.499 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 25.7 p -126.82 -167.41 1.72 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.3 -0.875 . . . . 0.0 110.797 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . 0.404 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -98.98 58.17 0.89 Allowed Glycine 0 N--CA 1.491 2.346 0 N-CA-C 108.04 -2.024 . . . . 0.0 108.04 178.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 16.8 t -99.67 145.97 27.01 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.442 -1.034 . . . . 0.0 109.755 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 4.9 ttm-85 -97.83 50.79 1.04 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.226 -0.922 . . . . 0.0 109.318 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.31 97.33 0.03 OUTLIER Glycine 0 N--CA 1.486 2.019 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.1 p -109.09 128.23 54.81 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.293 -1.122 . . . . 0.0 110.327 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -143.02 130.23 20.87 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.069 -1.02 . . . . 0.0 110.099 -179.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -96.04 -38.33 10.25 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.17 -0.957 . . . . 0.0 110.606 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 3.1 m -54.36 -38.43 66.07 Favored 'General case' 0 N--CA 1.512 2.66 0 O-C-N 121.02 -1.05 . . . . 0.0 110.614 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.216 179.98 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.333 0 N-CA-C 109.551 -1.419 . . . . 0.0 109.551 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -107.55 -97.08 2.49 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.4 t -117.5 148.84 43.69 Favored Pre-proline 0 N--CA 1.494 1.733 0 O-C-N 121.158 -1.201 . . . . 0.0 110.293 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -72.74 138.81 29.67 Favored 'Trans proline' 0 C--N 1.317 -1.114 0 O-C-N 123.392 1.206 . . . . 0.0 110.432 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.85 169.5 9.81 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.166 -0.958 . . . . 0.0 110.237 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 37.2 pt -143.26 157.86 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 O-C-N 121.163 -0.961 . . . . 0.0 110.289 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.9 mtmm -118.53 146.46 44.54 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.174 -0.954 . . . . 0.0 110.14 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.7 m -129.61 119.42 23.56 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.143 -0.973 . . . . 0.0 110.246 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.5 tpp85 -140.9 76.16 1.54 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.19 -0.944 . . . . 0.0 110.168 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.05 -164.43 1.89 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.229 -0.919 . . . . 0.0 110.156 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 45.9 t -112.24 -174.91 2.56 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.123 -0.985 . . . . 0.0 110.153 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.6 mmmm -140.02 155.47 70.78 Favored Pre-proline 0 N--CA 1.494 1.763 0 O-C-N 121.164 -0.96 . . . . 0.0 110.333 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.43 162.64 40.91 Favored 'Trans proline' 0 C--N 1.318 -1.069 0 O-C-N 123.543 1.286 . . . . 0.0 110.672 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.676 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -84.17 143.73 42.89 Favored Pre-proline 0 N--CA 1.504 2.269 0 O-C-N 121.416 -0.802 . . . . 0.0 109.655 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -71.95 166.41 29.65 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 O-C-N 123.308 1.162 . . . . 0.0 110.835 -179.667 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -47.97 -31.93 5.87 Favored 'General case' 0 N--CA 1.515 2.825 0 O-C-N 121.507 -0.745 . . . . 0.0 111.529 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.49 -34.46 34.74 Favored Glycine 0 N--CA 1.5 2.931 0 O-C-N 120.96 -1.087 . . . . 0.0 110.585 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.405 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 26.0 t80 -55.56 -33.27 63.72 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 120.938 -1.33 . . . . 0.0 110.555 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -54.32 -37.8 65.26 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.046 -1.034 . . . . 0.0 110.167 179.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.5 mtpt -57.4 -36.56 71.44 Favored 'General case' 0 N--CA 1.511 2.585 0 O-C-N 121.298 -0.877 . . . . 0.0 110.117 179.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.743 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.8 pt -118.69 35.28 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.2 -0.937 . . . . 0.0 110.388 179.453 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -83.73 -43.37 0.8 Allowed Pre-proline 0 N--CA 1.508 2.457 0 O-C-N 120.976 -1.077 . . . . 0.0 113.105 -179.087 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.8 Cg_endo -76.27 -36.4 1.85 Allowed 'Trans proline' 0 N--CA 1.487 1.113 0 O-C-N 122.583 0.78 . . . . 0.0 111.506 -178.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.825 HG21 ' CE2' ' A' ' 62' ' ' TYR . 78.5 m -59.8 -42.92 94.5 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.02 -1.05 . . . . 0.0 110.092 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.743 HD12 ' O ' ' A' ' 19' ' ' ILE . 2.7 mt -64.37 -39.84 94.66 Favored 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.672 179.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -57.97 -35.27 70.93 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.107 -0.996 . . . . 0.0 110.228 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -56.22 -34.52 66.4 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.127 -0.983 . . . . 0.0 110.528 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.669 ' CD1' HD22 ' A' ' 55' ' ' LEU . 13.9 m-85 -58.52 -40.35 82.65 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.037 -1.04 . . . . 0.0 110.642 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -60.41 -39.93 89.16 Favored 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.653 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.425 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.2 mp -66.08 -39.96 85.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.381 0 C-N-CA 119.195 -1.002 . . . . 0.0 109.126 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -70.34 -49.15 52.32 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.081 -1.012 . . . . 0.0 108.689 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.665 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -62.91 -32.94 74.33 Favored 'General case' 0 N--CA 1.508 2.433 0 C-N-CA 119.229 -0.988 . . . . 0.0 108.926 178.186 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 23.1 mtt180 -56.9 -40.31 76.04 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.009 -1.057 . . . . 0.0 110.018 179.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -62.9 -51.09 68.32 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.252 -0.979 . . . . 0.0 109.417 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.585 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -65.75 -40.35 92.0 Favored 'General case' 0 N--CA 1.504 2.263 0 C-N-CA 119.227 -0.989 . . . . 0.0 109.11 179.038 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.439 ' CG ' HD23 ' A' ' 30' ' ' LEU . 5.4 mm100 -62.74 -38.59 91.13 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.178 -0.951 . . . . 0.0 109.641 179.398 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.0 mmtm -60.5 -39.26 87.1 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.134 -0.979 . . . . 0.0 110.02 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -58.09 -38.67 76.86 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.142 -0.973 . . . . 0.0 110.114 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 35.2 tttm -56.33 -37.38 69.9 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.131 -0.981 . . . . 0.0 110.422 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 83.1 p -109.6 39.41 2.11 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.222 -0.924 . . . . 0.0 110.275 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.7 m -148.56 -59.37 0.23 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.22 -0.925 . . . . 0.0 110.217 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -137.69 101.49 4.48 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.294 -0.879 . . . . 0.0 109.924 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.6 tp -113.53 50.21 0.92 Allowed 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.21 -0.931 . . . . 0.0 110.244 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -118.04 -57.36 2.1 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.242 -0.911 . . . . 0.0 110.193 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -121.85 149.85 42.77 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.137 -0.977 . . . . 0.0 110.178 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.7 mtmt 52.47 49.01 21.39 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.993 -1.067 . . . . 0.0 110.819 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.9 p -111.15 -52.71 2.77 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.195 -0.941 . . . . 0.0 110.553 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -55.91 -37.97 69.62 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.163 -0.96 . . . . 0.0 110.142 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -61.01 -40.96 95.55 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.17 -0.957 . . . . 0.0 109.823 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -62.64 -40.23 96.37 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.195 -0.941 . . . . 0.0 109.82 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.477 HD23 HD12 ' A' ' 52' ' ' ILE . 12.5 mt -59.46 -38.03 79.69 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.203 -0.935 . . . . 0.0 110.26 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.492 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.5 m0 -58.36 -36.67 73.81 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.038 -1.039 . . . . 0.0 110.127 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -62.33 -30.34 71.09 Favored 'General case' 0 N--CA 1.506 2.327 0 C-N-CA 119.204 -0.998 . . . . 0.0 109.983 178.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.665 HG23 ' CG ' ' A' ' 30' ' ' LEU . 69.6 mt -71.91 -57.09 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.269 0 O-C-N 120.913 -1.117 . . . . 0.0 109.466 179.526 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.5 ptm -61.13 -29.48 69.8 Favored 'General case' 0 N--CA 1.509 2.49 0 C-N-CA 118.414 -1.314 . . . . 0.0 109.704 178.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -67.82 -37.42 81.93 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.841 -1.162 . . . . 0.0 109.09 178.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.669 HD22 ' CD1' ' A' ' 26' ' ' PHE . 11.0 mt -53.15 -31.87 44.72 Favored 'General case' 0 N--CA 1.512 2.636 0 O-C-N 120.965 -1.084 . . . . 0.0 110.169 178.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.466 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 70.6 t60 -54.79 -39.3 68.29 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.038 -1.038 . . . . 0.0 109.828 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.51 ' CD2' HD21 ' A' ' 91' ' ' LEU . 5.7 m170 -59.49 -46.61 88.31 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.158 -0.964 . . . . 0.0 109.404 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.9 tp-100 -59.44 -34.93 73.11 Favored 'General case' 0 N--CA 1.506 2.349 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.489 178.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.446 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 8.2 mmm-85 -65.39 -53.33 44.86 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.041 -1.037 . . . . 0.0 109.194 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 12.3 p -61.65 -38.58 88.23 Favored 'General case' 0 N--CA 1.505 2.277 0 C-N-CA 119.3 -0.96 . . . . 0.0 109.357 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.426 ' O ' ' OG1' ' A' ' 65' ' ' THR . 6.3 ttt85 -65.1 -41.37 95.02 Favored 'General case' 0 N--CA 1.504 2.259 0 C-N-CA 119.216 -0.993 . . . . 0.0 109.221 179.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.825 ' CE2' HG21 ' A' ' 22' ' ' THR . 40.1 t80 -62.62 -49.54 74.8 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.17 -0.956 . . . . 0.0 109.547 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.751 HD12 ' HB2' ' A' ' 87' ' ' ALA . 85.4 mt -71.85 -38.85 66.62 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.327 0 O-C-N 121.204 -0.935 . . . . 0.0 109.448 179.564 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.405 ' HD2' HD13 ' A' ' 92' ' ' ILE . 9.4 t80 -66.03 -42.25 89.86 Favored 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.107 -0.996 . . . . 0.0 108.832 178.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.426 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 91.6 m -60.97 -42.17 97.78 Favored 'General case' 0 N--CA 1.504 2.239 0 C-N-CA 119.253 -0.979 . . . . 0.0 110.171 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.567 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.1 -33.11 26.42 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.962 -1.086 . . . . 0.0 112.474 -178.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.495 ' N ' HD12 ' A' ' 66' ' ' LEU . 36.3 t80 -86.33 -32.86 20.78 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 120.554 -1.341 . . . . 0.0 111.896 -179.158 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -97.54 -21.1 17.29 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 120.878 -1.138 . . . . 0.0 112.527 -178.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.414 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 6.9 mtpt -118.3 -59.65 1.87 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 120.56 -1.337 . . . . 0.0 110.808 179.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.415 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 11.3 ttt85 -62.16 -29.7 70.54 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.129 -0.982 . . . . 0.0 110.865 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.2 mtpt 56.27 42.32 28.06 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.938 -1.102 . . . . 0.0 110.171 -179.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.51 35.6 3.95 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.444 -0.785 . . . . 0.0 110.0 179.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.776 HG13 HD23 ' A' ' 77' ' ' LEU . 14.1 tt -153.87 162.27 2.14 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.202 -0.936 . . . . 0.0 109.974 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 50.4 m -110.0 148.29 31.94 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.181 -0.95 . . . . 0.0 110.136 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.2 tttm -46.77 -31.72 3.18 Favored 'General case' 0 N--CA 1.515 2.781 0 O-C-N 121.302 -0.874 . . . . 0.0 111.55 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -62.88 -52.01 64.74 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 120.836 -1.165 . . . . 0.0 109.261 179.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.776 HD23 HG13 ' A' ' 73' ' ' ILE . 22.4 tp -64.76 -45.68 85.36 Favored 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 119.232 -0.987 . . . . 0.0 108.469 178.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.759 ' HA ' HD12 ' A' ' 81' ' ' LEU . 11.8 t80 -59.3 -40.84 87.47 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.337 -0.852 . . . . 0.0 109.424 179.177 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -71.65 -43.14 66.61 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.178 -0.951 . . . . 0.0 108.506 178.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.676 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 88.7 t90 -57.0 -34.68 68.38 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.229 -0.92 . . . . 0.0 109.353 178.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.759 HD12 ' HA ' ' A' ' 78' ' ' TYR . 11.3 mt -67.11 -59.89 3.08 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.115 -0.991 . . . . 0.0 108.889 179.012 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.423 HG13 ' HB3' ' A' ' 87' ' ' ALA . 5.4 mt -57.97 -26.51 28.86 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.555 0 O-C-N 120.941 -1.1 . . . . 0.0 110.035 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.9 tttp -80.03 -19.07 48.53 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 120.869 -1.144 . . . . 0.0 110.853 178.323 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.442 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 8.3 mm-40 -108.47 23.11 14.99 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 120.752 -1.217 . . . . 0.0 111.984 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.415 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 1.5 tmtt? 76.83 69.82 0.06 Allowed 'General case' 0 N--CA 1.515 2.794 0 O-C-N 121.148 -0.97 . . . . 0.0 111.882 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.678 ' HE2' HD13 ' A' ' 23' ' ' LEU . 21.8 m-85 -130.95 -62.34 0.9 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.488 -0.758 . . . . 0.0 109.215 179.354 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.751 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -127.75 166.99 17.11 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.458 -0.776 . . . . 0.0 109.812 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.466 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 19.1 t0 -115.41 109.45 17.89 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.231 -0.918 . . . . 0.0 110.156 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.44 -38.09 73.87 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.216 -0.927 . . . . 0.0 110.171 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.46 HD23 HD22 ' A' ' 106' ' ' LEU . 11.2 tp -59.52 -38.77 81.85 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.178 -0.951 . . . . 0.0 110.179 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.51 HD21 ' CD2' ' A' ' 57' ' ' HIS . 55.6 tp -68.32 -50.02 56.3 Favored 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 119.17 -1.012 . . . . 0.0 109.164 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.405 HD13 ' HD2' ' A' ' 64' ' ' TYR . 68.9 mt -60.94 -37.57 77.32 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 C-N-CA 119.117 -1.033 . . . . 0.0 108.817 178.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.81 -38.67 86.92 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.082 -1.011 . . . . 0.0 109.086 178.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.484 ' HB3' HD22 ' A' ' 103' ' ' LEU . 9.7 mmtm -58.3 -44.85 88.74 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.105 -0.997 . . . . 0.0 109.565 179.345 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 3.2 m0 -60.68 -35.86 77.31 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.317 -0.865 . . . . 0.0 110.053 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.83 -32.79 40.64 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.105 -0.997 . . . . 0.0 110.491 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 10.3 mmtp -51.66 177.93 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.728 0 O-C-N 120.952 -1.092 . . . . 0.0 110.841 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 3.5 m -105.4 141.77 36.33 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.22 -0.925 . . . . 0.0 109.39 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 103.68 -29.15 12.78 Favored Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.896 -1.282 . . . . 0.0 109.896 -179.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.603 ' HB3' HD23 ' A' ' 103' ' ' LEU . 55.9 m-85 -92.98 57.76 2.84 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 120.906 -1.349 . . . . 0.0 109.986 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.425 ' HB2' ' OG ' ' A' ' 155' ' ' SER . 5.4 mt-10 -63.02 -37.73 88.34 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 120.972 -1.08 . . . . 0.0 110.287 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -131.91 83.25 2.07 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.071 -1.018 . . . . 0.0 110.636 -179.781 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.603 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.2 pp -114.49 147.51 39.23 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.243 -0.911 . . . . 0.0 109.951 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.428 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.4 p -109.22 -27.63 9.45 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.215 -0.928 . . . . 0.0 113.003 -179.383 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.654 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 11.5 m -143.73 -167.72 2.66 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.202 -1.562 . . . . 0.0 109.789 179.107 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.46 HD22 HD23 ' A' ' 90' ' ' LEU . 13.2 mt -95.97 -38.54 10.19 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.149 -0.97 . . . . 0.0 110.098 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 22.6 ttt180 -103.37 31.73 4.18 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 120.972 -1.08 . . . . 0.0 109.876 178.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.654 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.7 t -128.38 19.44 6.32 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.266 -0.897 . . . . 0.0 108.733 -179.632 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.497 HG22 ' HG3' ' A' ' 123' ' ' ARG . 1.4 pt -158.34 39.01 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.345 0 O-C-N 120.974 -1.079 . . . . 0.0 110.064 -178.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.795 ' C ' HG23 ' A' ' 119' ' ' THR . 0.0 OUTLIER -93.11 101.12 13.42 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 120.95 -1.094 . . . . 0.0 111.004 -178.633 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.418 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 19.1 ttmt -103.31 -50.61 3.42 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.31 -0.869 . . . . 0.0 110.029 179.381 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -120.4 118.17 29.62 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.196 -0.94 . . . . 0.0 110.179 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -153.32 -173.03 4.43 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.219 -0.926 . . . . 0.0 110.72 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 75.9 p -116.21 43.89 2.07 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.221 -0.924 . . . . 0.0 110.168 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -133.18 -165.16 1.58 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.187 -0.946 . . . . 0.0 110.151 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -115.85 64.8 0.7 Allowed 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.198 -0.939 . . . . 0.0 110.19 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -133.92 -155.27 7.56 Favored Glycine 0 N--CA 1.493 2.454 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 10.0 m -143.9 -165.18 2.05 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.171 -1.193 . . . . 0.0 110.237 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.795 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.9 OUTLIER -114.52 158.05 22.16 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.249 -0.907 . . . . 0.0 110.175 179.953 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.432 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 49.9 t -82.19 153.9 25.73 Favored 'General case' 0 N--CA 1.499 2.005 0 C-N-CA 119.213 -0.995 . . . . 0.0 108.705 178.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.964 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -75.52 -30.62 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.52 0 O-C-N 121.053 -1.03 . . . . 0.0 111.759 -178.702 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.495 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 14.2 p -58.94 -35.41 73.07 Favored 'General case' 0 N--CA 1.511 2.61 0 O-C-N 120.692 -1.255 . . . . 0.0 110.869 -179.037 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.497 ' HG3' HG22 ' A' ' 109' ' ' ILE . 0.0 OUTLIER -57.12 -30.41 64.37 Favored 'General case' 0 N--CA 1.51 2.557 0 O-C-N 120.917 -1.114 . . . . 0.0 110.261 179.034 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.4 t -83.06 124.35 76.59 Favored Pre-proline 0 N--CA 1.505 2.298 0 O-C-N 121.061 -1.024 . . . . 0.0 110.147 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -66.17 174.8 5.51 Favored 'Trans proline' 0 N--CA 1.49 1.27 0 O-C-N 123.138 1.072 . . . . 0.0 110.774 179.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 31.1 mmm-85 -75.08 -37.0 61.7 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.216 -0.927 . . . . 0.0 110.57 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.36 -40.65 78.56 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 120.996 -1.065 . . . . 0.0 110.044 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 38.6 tp60 -69.35 -41.98 75.87 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.338 -0.945 . . . . 0.0 109.128 179.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.654 HD11 HD11 ' A' ' 121' ' ' ILE . 8.0 mt -65.23 -39.47 92.77 Favored 'General case' 0 N--CA 1.505 2.304 0 C-N-CA 119.461 -0.895 . . . . 0.0 109.407 179.044 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -59.84 -39.0 83.67 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.17 -0.956 . . . . 0.0 109.994 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -59.78 -40.07 87.01 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.127 -0.983 . . . . 0.0 110.054 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -61.62 -44.29 97.27 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.189 -0.944 . . . . 0.0 109.819 179.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.453 ' HB1' ' HA ' ' A' ' 139' ' ' GLN . . . -60.94 -41.41 96.21 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.209 -0.932 . . . . 0.0 109.953 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 18.3 ttt-85 -63.44 -33.13 74.88 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.111 -0.993 . . . . 0.0 110.492 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 24.5 mtmt -79.95 -30.85 39.95 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.014 -1.054 . . . . 0.0 111.197 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.37 23.51 8.35 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 120.836 -1.165 . . . . 0.0 111.739 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.89 46.6 49.17 Favored Glycine 0 N--CA 1.5 2.923 0 O-C-N 120.645 -1.284 . . . . 0.0 110.882 179.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.43 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 9.3 t -147.8 -164.01 1.91 Allowed 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.136 -1.214 . . . . 0.0 110.383 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . 0.453 ' HA ' ' HB1' ' A' ' 133' ' ' ALA . 27.5 mt-30 -136.25 151.42 49.64 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.135 -0.978 . . . . 0.0 110.224 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.584 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.8 p -132.12 161.07 41.99 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.123 -0.985 . . . . 0.0 110.222 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 34.7 t -168.33 92.99 0.34 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.249 -0.907 . . . . 0.0 111.001 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.964 ' CD1' HD12 ' A' ' 121' ' ' ILE . 78.3 t80 -100.53 159.97 14.73 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.161 -0.962 . . . . 0.0 110.57 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -138.27 -60.92 0.61 Allowed 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -142.46 149.57 39.4 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.48 -0.762 . . . . 0.0 109.079 178.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . 0.409 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.6 p -90.32 153.82 20.16 Favored 'General case' 0 N--CA 1.506 2.368 0 C-N-CA 119.102 -1.039 . . . . 0.0 111.195 -179.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 27.0 m -72.11 -24.96 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.439 0 O-C-N 121.445 -0.785 . . . . 0.0 111.396 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -50.06 -61.31 2.23 Favored 'General case' 0 N--CA 1.515 2.802 0 O-C-N 120.837 -1.164 . . . . 0.0 110.036 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.492 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.3 p -125.93 -166.13 1.52 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.273 -0.892 . . . . 0.0 110.459 179.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -99.43 64.52 0.67 Allowed Glycine 0 N--CA 1.492 2.376 0 N-CA-C 107.987 -2.045 . . . . 0.0 107.987 178.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 29.9 t -104.73 137.32 42.71 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.359 -1.083 . . . . 0.0 110.007 -179.074 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 18.7 ttt85 -95.3 53.79 1.55 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.306 -0.871 . . . . 0.0 109.419 178.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 68.95 98.09 0.04 OUTLIER Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.986 -1.245 . . . . 0.0 109.986 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 29.8 p -105.56 119.01 38.04 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.279 -1.13 . . . . 0.0 110.248 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -145.86 154.64 42.2 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.141 -0.975 . . . . 0.0 110.063 -179.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . 0.425 ' OG ' ' HB2' ' A' ' 101' ' ' GLU . 0.7 OUTLIER -83.52 -35.17 25.03 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.29 -0.881 . . . . 0.0 110.693 -179.897 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 81.8 p -79.41 -39.07 33.32 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.976 -1.078 . . . . 0.0 110.132 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 . . . . . 0 N--CA 1.493 1.711 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.22 179.894 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -81.98 -125.58 0.84 Allowed Glycine 0 N--CA 1.493 2.479 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.0 t -128.92 147.68 65.68 Favored Pre-proline 0 N--CA 1.493 1.705 0 O-C-N 121.192 -1.181 . . . . 0.0 110.236 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -73.23 149.99 46.62 Favored 'Trans proline' 0 C--N 1.316 -1.15 0 O-C-N 123.454 1.239 . . . . 0.0 110.399 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 13.1 ptp180 -143.13 139.43 30.39 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.278 -0.889 . . . . 0.0 110.308 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 63.5 mt -119.64 91.59 1.88 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 O-C-N 121.249 -0.907 . . . . 0.0 109.957 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 79.6 mttt -122.05 129.2 52.21 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.246 -0.909 . . . . 0.0 110.186 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 29.2 m -122.98 152.22 41.09 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.222 -0.924 . . . . 0.0 110.227 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 28.0 mtm-85 -128.28 142.11 51.24 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.23 -0.919 . . . . 0.0 110.231 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 52.57 85.86 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.039 -1.038 . . . . 0.0 110.776 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 34.3 t -121.33 141.73 50.65 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.211 -0.93 . . . . 0.0 110.222 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -136.73 87.06 20.81 Favored Pre-proline 0 N--CA 1.495 1.809 0 O-C-N 121.272 -0.893 . . . . 0.0 110.246 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -73.97 158.92 45.56 Favored 'Trans proline' 0 C--N 1.316 -1.144 0 O-C-N 123.518 1.272 . . . . 0.0 110.596 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.664 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -90.15 146.18 34.37 Favored Pre-proline 0 N--CA 1.504 2.236 0 O-C-N 121.335 -0.853 . . . . 0.0 109.741 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.415 ' HG2' HD13 ' A' ' 77' ' ' LEU . 44.8 Cg_endo -71.13 160.69 48.35 Favored 'Trans proline' 0 C--N 1.317 -1.097 0 O-C-N 123.358 1.188 . . . . 0.0 110.852 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -49.05 -31.72 8.25 Favored 'General case' 0 N--CA 1.515 2.791 0 O-C-N 121.411 -0.805 . . . . 0.0 111.361 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.8 -33.93 43.76 Favored Glycine 0 N--CA 1.498 2.826 0 O-C-N 120.957 -1.089 . . . . 0.0 110.503 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -55.66 -33.28 63.96 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.029 -1.277 . . . . 0.0 110.673 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -53.62 -38.29 63.89 Favored 'General case' 0 N--CA 1.513 2.687 0 O-C-N 121.047 -1.033 . . . . 0.0 110.2 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.7 mtmt -60.29 -37.42 80.47 Favored 'General case' 0 N--CA 1.509 2.482 0 C-N-CA 119.559 -0.856 . . . . 0.0 109.999 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.862 ' O ' HD12 ' A' ' 23' ' ' LEU . 1.3 pt -115.41 33.64 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.193 -0.942 . . . . 0.0 110.61 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 2.5 tttt -84.64 -43.08 0.71 Allowed Pre-proline 0 N--CA 1.51 2.557 0 O-C-N 120.936 -1.102 . . . . 0.0 113.393 -179.03 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.6 Cg_endo -75.57 -35.09 2.94 Favored 'Trans proline' 0 N--CA 1.487 1.094 0 O-C-N 122.604 0.792 . . . . 0.0 111.797 -178.093 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.472 HG21 ' CE2' ' A' ' 62' ' ' TYR . 82.9 m -60.43 -43.76 96.46 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 120.955 -1.091 . . . . 0.0 110.019 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.862 HD12 ' O ' ' A' ' 19' ' ' ILE . 6.2 mt -65.33 -39.49 92.49 Favored 'General case' 0 N--CA 1.507 2.377 0 C-N-CA 119.337 -0.945 . . . . 0.0 109.466 179.465 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.1 m -57.62 -35.54 70.6 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.085 -1.009 . . . . 0.0 110.185 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -56.81 -36.14 69.57 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.067 -1.021 . . . . 0.0 110.438 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.709 ' CD2' HD22 ' A' ' 55' ' ' LEU . 14.7 m-85 -58.46 -38.98 78.67 Favored 'General case' 0 N--CA 1.51 2.526 0 O-C-N 121.114 -0.991 . . . . 0.0 110.51 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -60.47 -38.48 84.35 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.185 -0.947 . . . . 0.0 110.711 -179.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.414 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.2 mp -66.9 -40.97 86.94 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.397 0 C-N-CA 119.238 -0.985 . . . . 0.0 109.089 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 29.2 tp60 -67.76 -47.17 69.99 Favored 'General case' 0 N--CA 1.506 2.354 0 C-N-CA 119.178 -1.009 . . . . 0.0 108.785 179.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.698 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.1 OUTLIER -63.58 -36.23 83.13 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 121.225 -0.922 . . . . 0.0 109.001 178.474 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.2 mtt85 -57.88 -41.41 82.46 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.026 -1.046 . . . . 0.0 109.874 179.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.86 -46.3 88.54 Favored 'General case' 0 N--CA 1.506 2.334 0 C-N-CA 119.27 -0.972 . . . . 0.0 109.602 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.53 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -66.91 -41.66 86.72 Favored 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 119.262 -0.975 . . . . 0.0 109.202 179.194 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -60.29 -34.24 73.49 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.566 -0.854 . . . . 0.0 110.191 179.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -92.72 -32.79 14.58 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.05 -1.031 . . . . 0.0 110.824 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -55.73 -36.58 67.39 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 120.933 -1.105 . . . . 0.0 110.357 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 11.6 ttpt -55.52 -43.47 75.75 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 120.973 -1.079 . . . . 0.0 110.355 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 52.09 -165.53 0.06 Allowed 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.05 -1.031 . . . . 0.0 110.846 179.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -108.87 -52.2 2.79 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.209 -0.932 . . . . 0.0 110.304 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.8 tttp -111.08 69.6 0.69 Allowed 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.104 -0.997 . . . . 0.0 110.16 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.6 tp -110.19 -50.19 2.99 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.21 -0.931 . . . . 0.0 110.625 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 54.5 34.04 20.2 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.961 -1.087 . . . . 0.0 110.963 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -143.72 109.55 5.24 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.23 -0.919 . . . . 0.0 110.158 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.8 mttt 52.72 70.62 0.55 Allowed 'General case' 0 N--CA 1.501 2.118 0 O-C-N 120.937 -1.102 . . . . 0.0 110.644 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.415 ' OG ' ' N ' ' A' ' 46' ' ' ASN . 24.0 p -112.16 -54.94 2.57 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.203 -0.936 . . . . 0.0 110.368 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.415 ' N ' ' OG ' ' A' ' 45' ' ' SER . 1.3 m-80 -57.0 -38.79 73.58 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.281 -0.887 . . . . 0.0 109.966 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -64.58 -40.09 94.91 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.213 -0.93 . . . . 0.0 109.687 179.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.8 tp60 -62.33 -41.05 98.24 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.207 -0.933 . . . . 0.0 109.765 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.452 ' HA ' HD13 ' A' ' 49' ' ' LEU . 4.3 mm? -60.5 -39.87 89.31 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.212 -0.93 . . . . 0.0 109.993 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.497 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 52.9 m0 -60.83 -37.63 82.68 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.132 -0.98 . . . . 0.0 110.041 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -61.15 -31.07 70.8 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.038 -1.039 . . . . 0.0 109.916 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.698 HG23 ' CG ' ' A' ' 30' ' ' LEU . 70.6 mt -71.57 -58.41 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.244 0 O-C-N 120.864 -1.148 . . . . 0.0 109.286 179.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.407 ' HE1' ' O ' ' A' ' 147' ' ' HIS . 3.2 ptm -60.62 -28.28 68.41 Favored 'General case' 0 N--CA 1.509 2.52 0 C-N-CA 118.503 -1.279 . . . . 0.0 109.847 178.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -68.45 -37.26 80.05 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.756 -1.215 . . . . 0.0 109.24 178.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.709 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.3 mt -52.78 -32.5 44.02 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 120.967 -1.083 . . . . 0.0 110.175 179.044 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.473 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 10.4 t60 -54.61 -37.82 66.04 Favored 'General case' 0 N--CA 1.511 2.579 0 O-C-N 121.049 -1.032 . . . . 0.0 110.178 179.562 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.437 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 5.2 m170 -62.06 -51.84 66.33 Favored 'General case' 0 N--CA 1.508 2.443 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.472 179.29 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 19.6 tp60 -57.74 -34.67 69.76 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.273 -0.892 . . . . 0.0 109.831 179.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.426 ' HD3' ' CE2' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -68.81 -49.94 54.36 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.005 -1.06 . . . . 0.0 109.142 178.938 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 65.5 p -61.78 -37.45 84.38 Favored 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.162 -0.961 . . . . 0.0 109.432 179.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.84 -39.0 93.17 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.068 -1.02 . . . . 0.0 109.546 179.34 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.752 ' OH ' HG22 ' A' ' 19' ' ' ILE . 36.8 t80 -61.7 -49.82 74.92 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.182 -0.949 . . . . 0.0 109.379 179.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.764 HD12 ' HB2' ' A' ' 87' ' ' ALA . 85.1 mt -73.61 -41.47 55.47 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 C-N-CA 119.398 -0.921 . . . . 0.0 109.137 179.151 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.443 ' CE1' HG23 ' A' ' 92' ' ' ILE . 45.9 t80 -60.81 -33.07 72.44 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.289 -0.882 . . . . 0.0 110.135 179.125 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.7 m -79.25 -35.82 40.9 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.886 -1.133 . . . . 0.0 110.748 -179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.631 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -82.93 -33.69 26.74 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.836 -1.165 . . . . 0.0 112.412 -179.035 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.529 ' N ' HD12 ' A' ' 66' ' ' LEU . 64.2 t80 -86.6 -34.94 19.71 Favored 'General case' 0 N--CA 1.511 2.617 0 O-C-N 120.674 -1.266 . . . . 0.0 112.047 -179.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -98.55 -20.73 16.88 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.778 -1.201 . . . . 0.0 112.862 -178.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.415 ' HE2' ' CD2' ' A' ' 64' ' ' TYR . 0.6 OUTLIER -118.75 -56.65 2.1 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.552 -1.343 . . . . 0.0 111.198 -179.523 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.424 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 6.9 ttt85 -66.2 -30.84 71.38 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 121.085 -1.01 . . . . 0.0 110.706 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.2 ttpt 58.64 44.0 18.13 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.785 -1.197 . . . . 0.0 110.133 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.65 38.12 3.56 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.367 -0.833 . . . . 0.0 109.701 179.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.824 HG13 HD23 ' A' ' 77' ' ' LEU . 14.2 tt -155.32 162.97 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.92 0 O-C-N 121.25 -0.906 . . . . 0.0 110.206 -179.604 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.8 m -108.11 146.05 33.2 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.118 -0.989 . . . . 0.0 109.978 179.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -45.99 -32.9 3.02 Favored 'General case' 0 N--CA 1.516 2.835 0 O-C-N 121.269 -0.894 . . . . 0.0 111.598 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -61.42 -49.63 76.08 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 120.947 -1.095 . . . . 0.0 109.324 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.824 HD23 HG13 ' A' ' 73' ' ' ILE . 34.5 tp -67.31 -43.01 82.73 Favored 'General case' 0 N--CA 1.504 2.26 0 C-N-CA 119.25 -0.98 . . . . 0.0 108.593 178.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.463 ' HA ' HD12 ' A' ' 81' ' ' LEU . 17.6 t80 -61.3 -38.69 87.72 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 121.352 -0.842 . . . . 0.0 109.35 178.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.464 ' O ' HG22 ' A' ' 82' ' ' ILE . 10.4 t0 -74.73 -41.2 60.57 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.171 -0.956 . . . . 0.0 108.954 178.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.664 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 81.6 t90 -59.73 -38.33 81.38 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.175 -0.953 . . . . 0.0 109.291 178.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.463 HD12 ' HA ' ' A' ' 78' ' ' TYR . 16.6 mt -66.01 -55.69 15.4 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.179 -0.951 . . . . 0.0 109.278 179.144 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.537 HD12 ' HB3' ' A' ' 87' ' ' ALA . 0.9 OUTLIER -56.48 -27.43 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 O-C-N 121.104 -0.997 . . . . 0.0 110.831 -179.726 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 10.2 tppt? -89.26 -15.37 33.71 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 120.918 -1.114 . . . . 0.0 111.868 179.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.438 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 75.0 mm-40 -107.48 25.04 11.95 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.564 -1.335 . . . . 0.0 111.927 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.408 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 7.0 ttmt 76.69 67.89 0.06 Allowed 'General case' 0 N--CA 1.514 2.741 0 O-C-N 121.252 -0.905 . . . . 0.0 112.022 179.278 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.603 ' HE2' HD13 ' A' ' 23' ' ' LEU . 27.2 m-85 -131.28 -62.58 0.88 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.406 -0.809 . . . . 0.0 108.977 178.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.764 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -132.89 168.53 18.26 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.388 -0.82 . . . . 0.0 109.391 179.318 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.473 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.7 t70 -121.29 111.88 17.91 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.132 -0.98 . . . . 0.0 110.546 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 7.8 mttt -58.61 -35.26 72.16 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.229 -0.919 . . . . 0.0 110.259 179.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.3 tp -57.61 -40.55 79.36 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 120.992 -1.067 . . . . 0.0 110.069 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.689 ' HA ' HD21 ' A' ' 106' ' ' LEU . 63.1 tp -71.03 -49.85 40.43 Favored 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 119.195 -1.002 . . . . 0.0 108.723 179.275 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.443 HG23 ' CE1' ' A' ' 64' ' ' TYR . 63.8 mt -60.76 -30.3 46.84 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.289 0 C-N-CA 119.32 -0.952 . . . . 0.0 109.377 178.501 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.9 -45.39 78.13 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 120.964 -1.085 . . . . 0.0 109.423 178.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.486 ' HD3' HD23 ' A' ' 106' ' ' LEU . 11.9 mttp -59.47 -44.27 93.05 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.003 -1.061 . . . . 0.0 109.859 179.282 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 3.3 m0 -57.49 -33.52 68.11 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.077 -1.014 . . . . 0.0 110.367 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.29 -35.58 35.6 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.129 -0.982 . . . . 0.0 110.282 179.418 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.8 mmtm -53.57 -178.62 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.641 0 O-C-N 120.953 -1.092 . . . . 0.0 110.62 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.87 140.18 39.3 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.257 -0.902 . . . . 0.0 109.472 179.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 102.52 -27.55 19.81 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 -178.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.604 ' HB3' HD23 ' A' ' 103' ' ' LEU . 66.0 m-85 -92.62 59.05 3.24 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 120.859 -1.377 . . . . 0.0 109.734 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -81.37 -35.98 30.16 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.064 -1.022 . . . . 0.0 110.456 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.17 66.71 0.83 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.049 -1.032 . . . . 0.0 110.694 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.604 HD23 ' HB3' ' A' ' 100' ' ' TYR . 0.7 OUTLIER -109.59 149.46 29.64 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 120.967 -1.083 . . . . 0.0 109.82 179.43 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.437 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 27.0 p -111.62 -27.88 8.37 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.193 -0.942 . . . . 0.0 113.264 -179.186 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.684 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 12.4 m -144.86 -168.77 3.01 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 120.168 -1.582 . . . . 0.0 109.865 179.207 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.689 HD21 ' HA ' ' A' ' 91' ' ' LEU . 17.3 mt -97.01 -37.34 10.2 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.165 -0.959 . . . . 0.0 110.234 179.002 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 7.9 ttp180 -104.07 33.32 3.51 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.93 -1.106 . . . . 0.0 109.675 178.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.684 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.304 1.7 t -128.37 20.84 6.19 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 108.388 -0.968 . . . . 0.0 108.388 -179.629 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.466 HG23 ' C ' ' A' ' 108' ' ' CYS . 1.6 pt -157.29 38.34 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.298 0 O-C-N 121.017 -1.052 . . . . 0.0 110.211 -178.776 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.751 ' C ' HG23 ' A' ' 119' ' ' THR . 83.4 mt-30 -77.57 72.73 4.13 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 120.953 -1.092 . . . . 0.0 110.675 -178.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 27.1 ttmt -96.43 -36.8 10.69 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.174 -0.954 . . . . 0.0 110.791 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -99.47 -43.12 6.65 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.994 -1.066 . . . . 0.0 110.558 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -113.29 128.29 56.42 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.067 -1.02 . . . . 0.0 110.365 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 62.3 m -142.3 142.2 32.51 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.177 -0.952 . . . . 0.0 110.166 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -121.17 -66.22 1.07 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.173 -0.954 . . . . 0.0 110.255 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -124.09 91.94 3.56 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.16 -0.963 . . . . 0.0 110.197 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 138.11 -146.06 17.75 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 12.2 m -144.68 -164.06 1.83 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.251 -1.146 . . . . 0.0 110.173 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.751 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.7 m -91.32 165.32 13.49 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.156 -0.965 . . . . 0.0 110.056 179.699 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 39.6 t -92.62 154.2 18.54 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 119.386 -0.926 . . . . 0.0 108.962 178.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.965 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -77.29 -30.15 17.28 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.443 0 O-C-N 121.025 -1.047 . . . . 0.0 111.775 -178.711 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.48 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.7 p -59.02 -35.55 73.47 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 120.676 -1.265 . . . . 0.0 110.75 -179.156 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.08 -32.57 64.25 Favored 'General case' 0 N--CA 1.512 2.629 0 O-C-N 120.94 -1.1 . . . . 0.0 110.001 178.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 62.5 t -81.3 124.76 80.36 Favored Pre-proline 0 N--CA 1.503 2.212 0 O-C-N 121.051 -1.031 . . . . 0.0 109.681 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.97 178.81 2.15 Favored 'Trans proline' 0 N--CA 1.488 1.174 0 O-C-N 123.114 1.06 . . . . 0.0 110.762 179.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -75.12 -38.44 61.07 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.308 -0.87 . . . . 0.0 110.355 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.2 -40.88 82.73 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.089 -1.007 . . . . 0.0 110.029 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -67.41 -42.2 83.64 Favored 'General case' 0 N--CA 1.506 2.368 0 C-N-CA 119.432 -0.907 . . . . 0.0 109.217 179.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.698 HD11 HD11 ' A' ' 121' ' ' ILE . 9.5 mt -63.59 -39.78 95.26 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.155 -0.966 . . . . 0.0 109.547 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -58.82 -37.79 77.21 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.096 -1.002 . . . . 0.0 110.059 179.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -57.42 -37.18 72.35 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.098 -1.001 . . . . 0.0 110.381 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 62.7 mt-10 -61.43 -47.59 85.05 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.144 -0.972 . . . . 0.0 109.695 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.85 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -59.81 -37.97 80.67 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.171 -0.956 . . . . 0.0 109.877 179.644 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 23.6 ttm-85 -61.69 -38.72 88.89 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.155 -0.966 . . . . 0.0 110.318 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 49.5 mttm -87.08 -39.66 15.38 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.105 -0.997 . . . . 0.0 110.212 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 67.7 mttt -69.13 -26.0 64.67 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.21 -0.931 . . . . 0.0 111.17 179.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 90.0 33.54 8.88 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.85 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.7 t -144.31 -161.41 1.28 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.049 -1.266 . . . . 0.0 109.946 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -125.74 150.86 47.37 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.089 -1.007 . . . . 0.0 109.979 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.514 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.0 p -132.14 160.72 42.29 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.17 -0.956 . . . . 0.0 110.434 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 46.9 t -170.26 98.04 0.27 Allowed 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.237 -0.915 . . . . 0.0 110.892 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.965 ' CD1' HD12 ' A' ' 121' ' ' ILE . 81.6 t80 -103.93 159.97 15.2 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.124 -0.985 . . . . 0.0 110.85 -179.608 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -138.75 -61.06 0.58 Allowed 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -141.69 148.51 39.21 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.536 -0.728 . . . . 0.0 109.155 178.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . 0.417 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 29.8 p -89.81 154.13 20.14 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.073 -1.051 . . . . 0.0 111.069 -179.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.2 p -72.34 -25.77 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.386 0 O-C-N 121.385 -0.822 . . . . 0.0 111.463 -179.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . 0.407 ' O ' ' HE1' ' A' ' 53' ' ' MET . 3.6 m-70 -49.78 -59.34 3.92 Favored 'General case' 0 N--CA 1.516 2.844 0 O-C-N 120.853 -1.154 . . . . 0.0 110.208 -179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.497 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.6 p -126.96 -165.23 1.44 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.278 -0.889 . . . . 0.0 110.333 179.289 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . 0.44 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -101.55 63.18 0.52 Allowed Glycine 0 N--CA 1.492 2.387 0 N-CA-C 107.879 -2.088 . . . . 0.0 107.879 178.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 20.6 t -101.49 141.26 34.62 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.347 -1.09 . . . . 0.0 109.819 -179.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 23.9 mtt85 -97.55 50.19 1.05 Allowed 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.246 -0.909 . . . . 0.0 109.546 179.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 71.42 98.37 0.06 OUTLIER Glycine 0 N--CA 1.486 2.017 0 N-CA-C 109.975 -1.25 . . . . 0.0 109.975 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.4 p -109.43 126.04 53.05 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.244 -1.15 . . . . 0.0 110.173 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -150.17 151.75 33.58 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.077 -1.015 . . . . 0.0 110.434 -179.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -104.28 -47.62 4.08 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.217 -0.927 . . . . 0.0 110.583 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 6.3 p -54.61 -38.67 67.07 Favored 'General case' 0 N--CA 1.512 2.67 0 O-C-N 121.004 -1.06 . . . . 0.0 110.644 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 . . . . . 0 N--CA 1.494 1.749 0 CA-C-O 117.987 -1.006 . . . . 0.0 110.192 179.96 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.336 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 110.18 85.48 1.63 Allowed Glycine 0 N--CA 1.493 2.48 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 55.34 175.52 0.04 OUTLIER Pre-proline 0 N--CA 1.503 2.182 0 O-C-N 121.117 -1.225 . . . . 0.0 110.432 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -73.43 -171.94 0.94 Allowed 'Trans proline' 0 C--N 1.318 -1.069 0 O-C-N 123.308 1.162 . . . . 0.0 110.365 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.3 ttt85 -115.16 -56.62 2.35 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.182 -0.949 . . . . 0.0 110.28 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 5.1 tp -131.29 145.06 35.9 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 O-C-N 121.304 -0.872 . . . . 0.0 110.193 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.4 tttm -147.4 173.8 12.28 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.114 -0.991 . . . . 0.0 110.355 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.7 m -121.12 41.6 3.28 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.167 -0.958 . . . . 0.0 110.151 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -142.68 121.75 12.89 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.265 -0.897 . . . . 0.0 110.243 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 10' ' ' LYS . 14.5 ttt85 -140.37 100.61 3.93 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.22 -0.925 . . . . 0.0 110.156 -179.909 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.01 -71.75 0.06 Allowed 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.232 -0.917 . . . . 0.0 110.791 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.401 ' N ' ' O ' ' A' ' 8' ' ' ARG . 5.3 mtmp? -117.2 148.96 43.57 Favored Pre-proline 0 N--CA 1.494 1.763 0 O-C-N 120.931 -1.106 . . . . 0.0 110.184 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.474 ' O ' ' HB3' ' A' ' 12' ' ' ALA . 46.6 Cg_endo -72.86 158.46 50.02 Favored 'Trans proline' 0 C--N 1.316 -1.138 0 O-C-N 123.408 1.215 . . . . 0.0 110.598 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.768 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . 61.77 150.52 0.1 OUTLIER Pre-proline 0 N--CA 1.504 2.24 0 O-C-N 121.366 -0.834 . . . . 0.0 110.539 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.45 165.05 33.82 Favored 'Trans proline' 0 C--N 1.317 -1.115 0 O-C-N 123.296 1.156 . . . . 0.0 110.514 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -48.18 -32.25 6.8 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 121.5 -0.75 . . . . 0.0 111.368 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.99 -33.99 51.47 Favored Glycine 0 N--CA 1.499 2.833 0 O-C-N 120.984 -1.072 . . . . 0.0 110.514 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.504 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 28.5 t80 -54.98 -31.63 60.94 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.039 -1.271 . . . . 0.0 110.689 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -53.27 -37.03 61.79 Favored 'General case' 0 N--CA 1.512 2.662 0 O-C-N 120.982 -1.074 . . . . 0.0 110.236 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp -59.0 -37.7 77.46 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.24 -0.913 . . . . 0.0 110.116 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.889 HD12 HD11 ' A' ' 23' ' ' LEU . 1.9 pt -119.51 35.07 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.223 -0.923 . . . . 0.0 110.537 179.77 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.439 ' HG3' ' CE2' ' A' ' 16' ' ' PHE . 3.0 tttt -84.9 -43.3 0.68 Allowed Pre-proline 0 N--CA 1.509 2.481 0 O-C-N 120.992 -1.067 . . . . 0.0 113.42 -178.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.42 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.7 Cg_endo -75.74 -35.45 2.64 Favored 'Trans proline' 0 N--CA 1.486 1.085 0 O-C-N 122.559 0.768 . . . . 0.0 111.867 -177.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.513 HG21 ' CE2' ' A' ' 62' ' ' TYR . 59.8 m -61.5 -45.62 93.45 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.985 -1.072 . . . . 0.0 110.061 -179.585 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.889 HD11 HD12 ' A' ' 19' ' ' ILE . 9.0 mt -63.53 -40.36 96.83 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.509 -0.877 . . . . 0.0 109.694 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.09 -35.34 73.23 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.157 -0.964 . . . . 0.0 110.087 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -57.92 -36.05 71.93 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.009 -1.057 . . . . 0.0 110.272 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.451 ' CD2' ' HD3' ' A' ' 59' ' ' ARG . 10.4 m-85 -55.46 -40.95 72.25 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 120.879 -1.138 . . . . 0.0 109.978 179.598 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -58.58 -25.1 62.2 Favored 'General case' 0 N--CA 1.505 2.323 0 C-N-CA 119.484 -0.887 . . . . 0.0 110.711 179.284 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 11.3 mm -70.53 -49.01 55.76 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.31 0 O-C-N 120.894 -1.129 . . . . 0.0 109.136 179.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.77 -43.35 72.39 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.154 -0.967 . . . . 0.0 108.867 179.155 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.67 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -64.43 -34.68 78.75 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.249 -0.98 . . . . 0.0 109.215 178.544 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.58 -40.86 84.37 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.014 -1.054 . . . . 0.0 109.957 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -62.43 -48.19 80.77 Favored 'General case' 0 N--CA 1.508 2.45 0 C-N-CA 119.28 -0.968 . . . . 0.0 109.541 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.615 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -67.68 -41.05 84.28 Favored 'General case' 0 N--CA 1.505 2.292 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.245 179.124 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.52 ' HG3' HD23 ' A' ' 30' ' ' LEU . 8.8 mm-40 -66.28 -34.21 77.49 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.309 -0.869 . . . . 0.0 110.159 179.401 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt -85.87 -34.32 21.04 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.033 -1.042 . . . . 0.0 110.631 179.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -55.89 -37.34 68.72 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.002 -1.062 . . . . 0.0 110.209 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.1 tttm -54.37 -37.57 65.11 Favored 'General case' 0 N--CA 1.512 2.648 0 O-C-N 121.196 -0.94 . . . . 0.0 110.493 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -110.29 -174.49 2.5 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.141 -0.974 . . . . 0.0 110.039 179.792 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 65.25 -68.17 0.12 Allowed 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.046 -1.033 . . . . 0.0 110.979 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.4 mmmt -113.46 142.31 46.07 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.786 -1.196 . . . . 0.0 110.116 179.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.9 tp -145.88 83.03 1.63 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.216 -0.928 . . . . 0.0 110.377 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -114.92 -66.26 1.1 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.203 -0.935 . . . . 0.0 110.179 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -150.76 -179.48 7.3 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.18 -0.95 . . . . 0.0 110.608 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.0 tttp 52.7 72.13 0.43 Allowed 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.122 -0.986 . . . . 0.0 110.785 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 27.9 t -116.04 -56.66 2.29 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.187 -0.946 . . . . 0.0 110.363 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -56.96 -39.45 74.62 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 121.169 -0.957 . . . . 0.0 109.911 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -63.07 -39.35 94.45 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.153 -0.967 . . . . 0.0 109.763 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 46.4 tp60 -62.15 -41.02 97.88 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.167 -0.958 . . . . 0.0 109.855 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -60.05 -39.99 87.87 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.225 -0.922 . . . . 0.0 110.169 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.496 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.3 m0 -59.13 -36.38 75.11 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.214 -0.929 . . . . 0.0 110.276 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -60.99 -29.86 69.93 Favored 'General case' 0 N--CA 1.507 2.378 0 C-N-CA 119.164 -1.014 . . . . 0.0 110.173 179.136 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.67 HG23 ' CG ' ' A' ' 30' ' ' LEU . 71.7 mt -72.58 -58.16 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.269 0 O-C-N 120.936 -1.103 . . . . 0.0 109.196 179.461 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.4 ptm -60.53 -29.96 69.45 Favored 'General case' 0 N--CA 1.51 2.548 0 C-N-CA 118.609 -1.237 . . . . 0.0 109.861 178.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.9 mt-30 -69.81 -37.66 76.35 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.894 -1.129 . . . . 0.0 109.075 178.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.414 ' HA ' HD23 ' A' ' 55' ' ' LEU . 12.5 mt -54.26 -32.65 56.69 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.003 -1.06 . . . . 0.0 110.211 178.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.449 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 6.2 t60 -55.0 -37.13 66.2 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.008 -1.057 . . . . 0.0 110.111 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.493 ' NE2' HD21 ' A' ' 91' ' ' LEU . 5.1 m170 -59.61 -48.3 82.19 Favored 'General case' 0 N--CA 1.509 2.508 0 C-N-CA 119.313 -0.955 . . . . 0.0 109.538 179.05 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -60.58 -36.15 77.81 Favored 'General case' 0 N--CA 1.506 2.327 0 C-N-CA 119.396 -0.921 . . . . 0.0 109.505 179.036 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.451 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -67.59 -49.58 62.46 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.182 -0.949 . . . . 0.0 109.304 179.073 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.6 p -61.26 -38.11 85.54 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.146 -0.971 . . . . 0.0 109.586 179.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.0 ttt85 -65.7 -39.0 90.77 Favored 'General case' 0 N--CA 1.507 2.392 0 C-N-CA 119.164 -1.014 . . . . 0.0 109.406 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.56 ' OH ' HG22 ' A' ' 19' ' ' ILE . 40.5 t80 -59.88 -47.13 86.98 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.21 -0.931 . . . . 0.0 109.561 179.496 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.772 HD12 ' HB2' ' A' ' 87' ' ' ALA . 86.2 mt -78.01 -44.06 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 O-C-N 121.186 -0.946 . . . . 0.0 108.947 179.212 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.523 ' CE1' HG23 ' A' ' 92' ' ' ILE . 37.7 t80 -59.17 -25.62 64.08 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.326 -0.859 . . . . 0.0 110.289 178.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.417 ' HA ' ' CD ' ' A' ' 69' ' ' LYS . 71.2 m -87.47 -37.12 17.25 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.774 -1.204 . . . . 0.0 110.283 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.58 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.6 pp -83.14 -31.82 26.99 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.005 -1.059 . . . . 0.0 112.485 -179.116 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.491 ' HD1' HG23 ' A' ' 73' ' ' ILE . 73.5 t80 -86.27 -36.2 19.5 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 120.697 -1.252 . . . . 0.0 111.482 -179.192 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -94.36 -17.11 22.87 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 120.889 -1.132 . . . . 0.0 112.726 -178.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.417 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 1.1 mttt -125.0 -60.48 1.35 Allowed 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.53 -1.356 . . . . 0.0 111.264 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.426 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 1.7 tpt180 -59.82 -29.89 68.56 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 120.986 -1.071 . . . . 0.0 110.825 -179.636 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.2 tttt 58.55 43.86 18.64 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.885 -1.134 . . . . 0.0 110.058 -179.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -114.07 36.63 3.62 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.366 -0.834 . . . . 0.0 109.798 179.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.755 HG13 HD23 ' A' ' 77' ' ' LEU . 13.8 tt -159.43 162.36 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.202 -0.936 . . . . 0.0 110.119 -179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.05 149.44 29.26 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.048 -1.032 . . . . 0.0 110.199 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.9 tttp -46.09 -32.7 3.03 Favored 'General case' 0 N--CA 1.515 2.804 0 O-C-N 121.375 -0.828 . . . . 0.0 111.588 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -62.46 -51.37 67.74 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 120.961 -1.087 . . . . 0.0 109.224 179.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.755 HD23 HG13 ' A' ' 73' ' ' ILE . 29.6 tp -65.92 -42.35 90.26 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.192 -1.003 . . . . 0.0 108.659 178.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.584 ' HA ' HD12 ' A' ' 81' ' ' LEU . 17.6 t80 -61.86 -40.13 94.29 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.302 -0.874 . . . . 0.0 109.244 179.022 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -70.84 -42.21 70.45 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.14 -0.975 . . . . 0.0 108.868 178.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.768 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 81.5 t90 -57.57 -36.84 72.21 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.248 -0.907 . . . . 0.0 109.65 179.049 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.584 HD12 ' HA ' ' A' ' 78' ' ' TYR . 15.8 mt -67.99 -51.37 47.99 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.059 -1.025 . . . . 0.0 109.082 179.176 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.494 HG21 ' HD2' ' A' ' 89' ' ' LYS . 34.8 mm -56.77 -29.27 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.53 0 O-C-N 121.208 -0.932 . . . . 0.0 110.209 179.415 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 25.2 tttt -89.1 -20.33 24.44 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 120.873 -1.142 . . . . 0.0 111.93 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.441 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 29.0 mm-40 -102.91 22.9 13.04 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 120.635 -1.291 . . . . 0.0 112.077 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? 73.81 77.65 0.13 Allowed 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.02 -1.05 . . . . 0.0 111.685 179.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.736 ' HE2' HD13 ' A' ' 23' ' ' LEU . 31.8 m-85 -135.9 -62.39 0.68 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.51 -0.743 . . . . 0.0 109.342 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.772 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -127.96 171.67 11.61 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.478 -0.763 . . . . 0.0 109.41 179.324 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.449 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 25.8 t0 -114.35 104.94 12.56 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.144 -0.973 . . . . 0.0 110.246 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.494 ' HD2' HG21 ' A' ' 82' ' ' ILE . 20.5 mttm -58.83 -39.91 82.6 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.219 -0.926 . . . . 0.0 109.934 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.596 HD23 HD13 ' A' ' 106' ' ' LEU . 27.5 tp -61.52 -38.59 87.95 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.135 -0.978 . . . . 0.0 109.924 179.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.493 HD21 ' NE2' ' A' ' 57' ' ' HIS . 57.0 tp -71.47 -47.25 56.86 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.056 -1.028 . . . . 0.0 108.702 179.241 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.523 HG23 ' CE1' ' A' ' 64' ' ' TYR . 23.1 mt -58.02 -36.44 56.49 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 O-C-N 121.16 -0.962 . . . . 0.0 108.627 178.305 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.99 -38.91 86.88 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 121.154 -0.966 . . . . 0.0 109.137 178.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.433 ' HD2' ' CZ ' ' A' ' 100' ' ' TYR . 4.9 mmtt -57.64 -42.91 84.41 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.152 -0.967 . . . . 0.0 109.474 179.288 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.5 m0 -64.79 -37.46 87.7 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.56 -0.856 . . . . 0.0 110.055 179.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.3 mtp85 -75.68 -32.81 60.29 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.194 -0.941 . . . . 0.0 110.543 179.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -54.06 -176.59 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.7 0 O-C-N 121.065 -1.022 . . . . 0.0 110.657 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -104.03 136.14 44.23 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.129 -0.982 . . . . 0.0 109.694 179.228 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 95.63 11.3 55.63 Favored Glycine 0 N--CA 1.494 2.553 0 C-N-CA 120.172 -1.013 . . . . 0.0 111.023 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.641 ' HB3' HD23 ' A' ' 103' ' ' LEU . 48.2 m-85 -119.28 71.95 0.88 Allowed 'General case' 0 N--CA 1.493 1.715 0 CA-C-N 119.403 1.602 . . . . 0.0 109.777 179.703 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -96.73 -36.26 10.72 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.177 -0.952 . . . . 0.0 110.807 -179.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.33 66.98 0.99 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.015 -1.053 . . . . 0.0 110.822 -179.598 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.641 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.2 pp -114.5 153.04 30.72 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.035 -1.041 . . . . 0.0 109.78 179.297 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.433 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.7 p -114.36 -29.92 6.74 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.172 -0.955 . . . . 0.0 113.569 -178.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.645 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.8 m -142.92 -167.99 2.67 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 120.051 -1.656 . . . . 0.0 109.907 179.263 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.596 HD13 HD23 ' A' ' 90' ' ' LEU . 15.0 mt -95.69 -39.04 10.09 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.2 -0.937 . . . . 0.0 109.937 179.083 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 5.7 ttm-85 -102.83 30.74 4.55 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.026 -1.046 . . . . 0.0 109.933 178.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.645 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.299 1.8 t -128.14 17.98 6.59 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.12 -0.988 . . . . 0.0 108.947 -179.554 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.461 HG23 ' C ' ' A' ' 108' ' ' CYS . 1.2 pt -158.28 37.83 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.275 0 O-C-N 120.864 -1.147 . . . . 0.0 110.571 -178.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.524 ' C ' HG23 ' A' ' 119' ' ' THR . 12.1 mm-40 -71.04 76.24 0.66 Allowed 'General case' 0 N--CA 1.51 2.559 0 O-C-N 120.854 -1.154 . . . . 0.0 110.509 -178.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.603 ' NZ ' HG22 ' A' ' 124' ' ' VAL . 0.0 OUTLIER -110.58 -166.17 1.06 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.196 -0.94 . . . . 0.0 110.106 179.562 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 1.4 m120 53.28 -171.91 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.986 -1.071 . . . . 0.0 110.575 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -115.14 100.09 7.91 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.183 -0.948 . . . . 0.0 110.276 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -144.84 -58.81 0.36 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.137 -0.977 . . . . 0.0 110.453 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -117.26 -172.48 2.23 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.188 -0.945 . . . . 0.0 110.212 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -116.64 161.62 18.9 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.174 -0.954 . . . . 0.0 110.165 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 134.25 -144.99 17.1 Favored Glycine 0 N--CA 1.493 2.457 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 4.1 m -125.79 163.26 23.27 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.214 -1.168 . . . . 0.0 110.129 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.524 HG23 ' C ' ' A' ' 110' ' ' GLN . 2.7 m -112.61 168.44 9.65 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.261 -0.899 . . . . 0.0 110.127 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.428 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 41.7 t -102.74 155.28 18.42 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.247 -0.908 . . . . 0.0 109.698 179.521 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.778 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -72.96 -36.34 51.13 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.457 0 O-C-N 121.114 -0.991 . . . . 0.0 111.052 -179.36 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.483 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 11.9 p -53.65 -33.17 54.33 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 120.84 -1.163 . . . . 0.0 111.253 -178.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.32 -32.57 70.2 Favored 'General case' 0 N--CA 1.512 2.65 0 O-C-N 120.952 -1.092 . . . . 0.0 109.666 178.392 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.603 HG22 ' NZ ' ' A' ' 111' ' ' LYS . 49.3 t -82.84 125.41 75.45 Favored Pre-proline 0 N--CA 1.505 2.297 0 O-C-N 121.06 -1.025 . . . . 0.0 109.85 179.603 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.64 175.29 4.49 Favored 'Trans proline' 0 N--CA 1.488 1.189 0 O-C-N 123.155 1.082 . . . . 0.0 110.797 179.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.11 -36.71 61.66 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.256 -0.902 . . . . 0.0 110.73 -179.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.65 -40.22 78.8 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 121.031 -1.043 . . . . 0.0 110.105 -179.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -69.84 -41.35 75.02 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 119.356 -0.938 . . . . 0.0 109.288 179.316 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.728 HD11 HD11 ' A' ' 121' ' ' ILE . 2.9 mt -65.04 -38.45 90.87 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.246 -0.909 . . . . 0.0 109.648 179.231 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -61.22 -40.46 94.08 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.088 -1.008 . . . . 0.0 109.842 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -59.8 -37.49 79.29 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.144 -0.973 . . . . 0.0 110.294 179.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -61.53 -43.44 98.86 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.169 -0.957 . . . . 0.0 110.071 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.618 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -60.29 -40.89 92.09 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.186 -0.946 . . . . 0.0 110.015 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.94 -33.82 69.22 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.183 -0.948 . . . . 0.0 110.401 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 25.1 mttt -76.88 -30.93 56.44 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.065 -1.022 . . . . 0.0 110.949 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 14.8 mtpp -98.42 22.33 9.9 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 120.916 -1.115 . . . . 0.0 111.688 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.67 39.38 46.13 Favored Glycine 0 N--CA 1.5 2.964 0 O-C-N 120.691 -1.255 . . . . 0.0 110.727 179.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.618 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 7.0 t -143.55 -166.64 2.38 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.089 -1.242 . . . . 0.0 110.338 179.898 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . 0.438 ' HA ' ' HB1' ' A' ' 133' ' ' ALA . 37.6 mt-30 -132.94 155.05 49.81 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.245 -0.91 . . . . 0.0 110.248 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.611 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.2 p -130.63 161.36 40.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.152 -0.968 . . . . 0.0 109.961 179.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 42.2 t -166.41 85.52 0.3 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.138 -0.976 . . . . 0.0 111.285 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.762 ' CG ' HD12 ' A' ' 121' ' ' ILE . 55.1 t80 -97.43 159.94 14.62 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.207 -0.933 . . . . 0.0 110.136 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 9.8 m-70 -136.82 -61.47 0.67 Allowed 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 179.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -136.7 151.0 48.76 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.45 -0.781 . . . . 0.0 108.928 178.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . 0.402 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 29.0 p -91.49 154.48 19.09 Favored 'General case' 0 N--CA 1.506 2.331 0 C-N-CA 119.121 -1.032 . . . . 0.0 111.093 -179.456 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.5 m -72.7 -25.1 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.462 0 C-N-CA 119.742 -0.783 . . . . 0.0 111.541 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -50.43 -60.81 2.63 Favored 'General case' 0 N--CA 1.516 2.856 0 O-C-N 120.906 -1.121 . . . . 0.0 110.022 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.496 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.9 p -126.43 -165.39 1.44 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.215 -0.928 . . . . 0.0 110.393 179.263 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . 0.441 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.39 63.52 0.61 Allowed Glycine 0 N--CA 1.492 2.42 0 N-CA-C 108.053 -2.019 . . . . 0.0 108.053 178.543 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 30.5 t -103.69 138.89 39.69 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.357 -1.084 . . . . 0.0 110.074 -179.191 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -95.03 54.38 1.68 Allowed 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.266 -0.896 . . . . 0.0 109.444 179.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.66 97.93 0.03 OUTLIER Glycine 0 N--CA 1.486 2.024 0 N-CA-C 109.819 -1.312 . . . . 0.0 109.819 -179.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.5 p -107.22 126.23 52.14 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.219 -1.165 . . . . 0.0 110.391 179.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -150.29 148.5 28.93 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.193 -0.942 . . . . 0.0 110.343 -179.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -98.01 -38.72 9.27 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.248 -0.907 . . . . 0.0 110.772 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.34 -40.42 74.1 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.037 -1.04 . . . . 0.0 110.101 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 . . . . . 0 N--CA 1.495 1.8 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.348 179.937 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.366 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 111.86 -53.36 0.59 Allowed Glycine 0 N--CA 1.493 2.464 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -134.68 80.82 49.19 Favored Pre-proline 0 N--CA 1.493 1.703 0 O-C-N 121.219 -1.165 . . . . 0.0 110.2 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.87 86.86 1.04 Allowed 'Trans proline' 0 C--N 1.316 -1.179 0 O-C-N 123.443 1.233 . . . . 0.0 110.363 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 9.0 mtp85 -140.79 151.86 44.73 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.243 -0.911 . . . . 0.0 110.246 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.3 pt -142.95 79.34 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 121.161 -0.962 . . . . 0.0 110.35 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 11.5 tttt -113.77 139.09 49.4 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.078 -1.014 . . . . 0.0 110.166 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 86.8 m -140.84 105.51 4.91 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.261 -0.899 . . . . 0.0 110.25 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.05 123.77 14.16 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.282 -0.886 . . . . 0.0 110.123 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 22.7 ttt180 -145.11 99.67 3.36 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.142 -0.974 . . . . 0.0 110.356 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 85.0 p -145.72 139.59 26.61 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.203 -0.936 . . . . 0.0 110.387 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -137.68 73.4 47.84 Favored Pre-proline 0 N--CA 1.494 1.731 0 O-C-N 121.169 -0.957 . . . . 0.0 110.309 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -73.13 159.69 46.96 Favored 'Trans proline' 0 C--N 1.317 -1.124 0 O-C-N 123.388 1.204 . . . . 0.0 110.568 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.712 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -81.35 142.51 50.62 Favored Pre-proline 0 N--CA 1.507 2.405 0 C-N-CA 119.591 -0.844 . . . . 0.0 109.648 179.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -71.82 162.1 43.01 Favored 'Trans proline' 0 C--N 1.318 -1.072 0 O-C-N 123.281 1.148 . . . . 0.0 110.896 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -48.82 -31.96 7.94 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 121.464 -0.773 . . . . 0.0 111.344 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.35 -33.91 40.28 Favored Glycine 0 N--CA 1.498 2.827 0 O-C-N 120.992 -1.067 . . . . 0.0 110.584 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -54.89 -32.6 61.08 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 120.972 -1.311 . . . . 0.0 110.634 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -54.44 -37.94 65.73 Favored 'General case' 0 N--CA 1.512 2.659 0 O-C-N 121.04 -1.037 . . . . 0.0 110.251 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.8 mttm -57.94 -37.14 73.58 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.27 -0.894 . . . . 0.0 110.115 179.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.89 HD12 HD11 ' A' ' 23' ' ' LEU . 2.6 pt -116.1 35.31 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.206 -0.934 . . . . 0.0 110.402 179.392 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.432 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -83.59 -43.09 0.81 Allowed Pre-proline 0 N--CA 1.51 2.529 0 O-C-N 121.082 -1.011 . . . . 0.0 113.17 -179.179 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.432 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.2 Cg_endo -76.12 -35.79 2.23 Favored 'Trans proline' 0 N--CA 1.487 1.123 0 O-C-N 122.632 0.806 . . . . 0.0 111.66 -178.392 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.781 HG21 ' CE2' ' A' ' 62' ' ' TYR . 88.6 m -60.5 -44.96 95.44 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 120.946 -1.096 . . . . 0.0 109.828 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.89 HD11 HD12 ' A' ' 19' ' ' ILE . 8.4 mt -65.01 -39.36 93.33 Favored 'General case' 0 N--CA 1.505 2.321 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.416 179.401 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 20.2 m -58.5 -35.41 72.19 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.076 -1.015 . . . . 0.0 110.051 179.16 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -56.37 -35.87 68.18 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 121.037 -1.039 . . . . 0.0 110.394 179.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.685 ' CD2' HD22 ' A' ' 55' ' ' LEU . 12.9 m-85 -56.82 -36.4 69.9 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.075 -1.016 . . . . 0.0 110.475 179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -57.79 -38.61 75.8 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.069 -1.02 . . . . 0.0 110.499 -179.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.422 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.1 mp -65.96 -41.01 88.98 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.412 0 C-N-CA 119.31 -0.956 . . . . 0.0 109.033 179.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 8.7 tp60 -68.97 -46.75 67.31 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.108 -0.995 . . . . 0.0 108.826 179.044 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.026 HD11 HG23 ' A' ' 52' ' ' ILE . 2.4 tp -61.89 -36.97 82.86 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.205 -0.935 . . . . 0.0 109.235 178.735 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.1 mtt85 -57.24 -36.46 70.96 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.138 -0.976 . . . . 0.0 110.298 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -62.93 -51.78 65.59 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.072 -1.017 . . . . 0.0 109.503 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.456 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -69.08 -42.27 76.43 Favored 'General case' 0 N--CA 1.504 2.274 0 C-N-CA 119.045 -1.062 . . . . 0.0 108.614 178.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -61.26 -33.19 73.13 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 119.455 -0.898 . . . . 0.0 110.297 179.369 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.8 mmtt -94.25 -29.23 15.19 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 120.897 -1.127 . . . . 0.0 111.289 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -53.92 -36.16 62.47 Favored 'General case' 0 N--CA 1.513 2.69 0 O-C-N 120.79 -1.194 . . . . 0.0 110.473 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.6 tptt -55.01 -38.81 68.38 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 121.1 -1.0 . . . . 0.0 110.428 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.5 m -117.63 41.8 2.76 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.203 -0.936 . . . . 0.0 110.208 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.07 -58.37 1.56 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.259 -0.901 . . . . 0.0 110.36 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -98.3 -41.07 8.02 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.199 -0.938 . . . . 0.0 110.446 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.446 HD23 ' C ' ' A' ' 41' ' ' LEU . 4.1 tt 54.16 71.07 0.54 Allowed 'General case' 0 N--CA 1.502 2.135 0 O-C-N 120.988 -1.07 . . . . 0.0 110.616 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -144.9 -65.56 0.33 Allowed 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.224 -0.923 . . . . 0.0 110.228 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -149.6 -177.72 6.03 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.209 -0.932 . . . . 0.0 110.553 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 52.76 85.27 0.05 OUTLIER 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.056 -1.027 . . . . 0.0 110.963 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.8 m -115.19 -56.92 2.32 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.19 -0.944 . . . . 0.0 110.168 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -56.81 -39.07 73.5 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 121.226 -0.921 . . . . 0.0 109.763 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -58.54 -35.16 71.88 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.243 -0.911 . . . . 0.0 110.137 179.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.422 ' HG2' ' CB ' ' A' ' 33' ' ' ALA . 0.3 OUTLIER -58.72 -46.31 87.63 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 120.974 -1.079 . . . . 0.0 109.585 179.72 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 92.1 mt -63.28 -37.78 88.58 Favored 'General case' 0 N--CA 1.508 2.463 0 C-N-CA 119.305 -0.958 . . . . 0.0 109.916 179.517 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.498 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 38.3 m0 -59.36 -33.99 71.84 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.153 -0.967 . . . . 0.0 109.405 179.413 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -68.03 -33.49 74.68 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 120.727 -1.233 . . . . 0.0 109.326 178.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 1.026 HG23 HD11 ' A' ' 30' ' ' LEU . 11.2 mt -70.82 -53.64 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.245 0 O-C-N 121.03 -1.044 . . . . 0.0 109.491 179.222 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.496 ' CE ' ' HB2' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -59.83 -33.1 71.32 Favored 'General case' 0 N--CA 1.51 2.538 0 C-N-CA 118.764 -1.174 . . . . 0.0 109.718 179.169 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.36 -39.59 91.18 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 120.91 -1.119 . . . . 0.0 109.44 179.129 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.685 HD22 ' CD2' ' A' ' 26' ' ' PHE . 18.0 mt -54.46 -34.31 61.27 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.158 -0.964 . . . . 0.0 110.097 179.235 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.441 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 4.8 t60 -58.55 -39.21 79.6 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 120.983 -1.073 . . . . 0.0 109.85 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.439 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 7.6 m170 -59.95 -48.39 81.91 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.086 -1.009 . . . . 0.0 109.064 179.24 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.88 -38.51 88.59 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.55 -0.86 . . . . 0.0 109.397 179.065 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.23 -44.71 96.83 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.246 -0.909 . . . . 0.0 109.502 179.478 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 52.7 p -66.34 -39.96 89.56 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.091 -1.006 . . . . 0.0 109.151 179.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 60.3 ttt-85 -63.04 -40.24 97.11 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.117 -0.989 . . . . 0.0 109.298 179.086 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.781 ' CE2' HG21 ' A' ' 22' ' ' THR . 40.1 t80 -62.2 -50.58 71.23 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.151 -0.968 . . . . 0.0 109.383 179.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.842 HD12 ' HB2' ' A' ' 87' ' ' ALA . 82.3 mt -70.59 -37.56 70.19 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 C-N-CA 119.289 -0.964 . . . . 0.0 109.332 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.413 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 8.5 t80 -66.56 -41.65 88.28 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.146 -0.971 . . . . 0.0 108.996 178.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 86.3 m -60.84 -41.82 96.54 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.112 -0.992 . . . . 0.0 110.098 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.603 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.18 -35.65 25.32 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 120.958 -1.089 . . . . 0.0 112.716 -178.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.58 ' N ' HD12 ' A' ' 66' ' ' LEU . 41.8 t80 -86.58 -33.56 20.17 Favored 'General case' 0 N--CA 1.514 2.751 0 O-C-N 120.614 -1.304 . . . . 0.0 112.044 -179.066 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.413 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 6.8 m-85 -98.25 -3.35 37.56 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.854 -1.153 . . . . 0.0 113.308 -178.351 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -136.32 -57.52 0.75 Allowed 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.374 -1.454 . . . . 0.0 111.134 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.422 ' HB2' ' HA ' ' A' ' 66' ' ' LEU . 14.3 mtp85 -69.19 -28.58 66.51 Favored 'General case' 0 N--CA 1.51 2.557 0 O-C-N 120.949 -1.094 . . . . 0.0 110.731 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.0 tttp 60.22 44.78 12.27 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.781 -1.199 . . . . 0.0 109.985 -179.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.54 35.73 3.71 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.343 -0.848 . . . . 0.0 109.817 179.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.804 HG13 HD23 ' A' ' 77' ' ' LEU . 14.3 tt -155.99 162.69 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 O-C-N 121.151 -0.968 . . . . 0.0 110.052 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.7 p -109.5 147.08 33.53 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.085 -1.009 . . . . 0.0 110.095 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.3 tttt -45.87 -32.23 2.52 Favored 'General case' 0 N--CA 1.515 2.809 0 O-C-N 121.309 -0.869 . . . . 0.0 111.621 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -61.8 -50.54 71.93 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.955 -1.091 . . . . 0.0 109.274 179.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.804 HD23 HG13 ' A' ' 73' ' ' ILE . 38.5 tp -66.68 -44.44 81.78 Favored 'General case' 0 N--CA 1.505 2.295 0 C-N-CA 119.241 -0.984 . . . . 0.0 108.442 178.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.435 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 18.5 t80 -60.43 -38.74 85.06 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.327 -0.858 . . . . 0.0 109.564 179.208 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -73.39 -41.92 62.77 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.059 -1.026 . . . . 0.0 109.016 178.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.712 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 84.1 t90 -57.65 -37.3 73.13 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.219 -0.926 . . . . 0.0 109.756 179.143 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.779 HD22 ' CD2' ' A' ' 86' ' ' TYR . 60.9 mt -69.28 -47.86 63.35 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.209 -0.932 . . . . 0.0 108.949 179.217 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.566 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 33.1 mm -56.23 -31.72 32.96 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.64 0 O-C-N 121.264 -0.897 . . . . 0.0 109.975 179.383 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 8.3 ttmt -89.24 -16.55 30.99 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 120.868 -1.145 . . . . 0.0 112.136 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.454 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 15.5 mm-40 -104.53 22.73 14.46 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 120.583 -1.323 . . . . 0.0 112.158 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.6 tptt 75.75 71.44 0.08 Allowed 'General case' 0 N--CA 1.512 2.643 0 O-C-N 121.149 -0.969 . . . . 0.0 111.903 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.779 ' CD2' HD22 ' A' ' 81' ' ' LEU . 33.2 m-85 -134.1 -63.03 0.74 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.42 -0.8 . . . . 0.0 109.019 179.198 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.842 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -128.36 164.08 23.44 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.485 -0.759 . . . . 0.0 109.26 179.168 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.441 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 3.3 t0 -112.04 107.33 16.24 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.102 -0.999 . . . . 0.0 110.468 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.6 mttt -58.82 -39.59 81.64 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.13 -0.981 . . . . 0.0 109.914 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.597 HD23 HD22 ' A' ' 106' ' ' LEU . 16.2 tp -60.61 -39.3 87.65 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.233 -0.917 . . . . 0.0 110.05 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.43 ' HA ' HD21 ' A' ' 106' ' ' LEU . 61.0 tp -70.11 -48.2 58.58 Favored 'General case' 0 N--CA 1.507 2.4 0 C-N-CA 119.203 -0.999 . . . . 0.0 108.669 179.229 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.441 HG22 ' HD2' ' A' ' 96' ' ' ARG . 62.9 mt -61.34 -38.22 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.434 0 C-N-CA 119.32 -0.952 . . . . 0.0 108.552 178.285 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.99 -39.06 83.31 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.146 -0.971 . . . . 0.0 109.087 178.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.467 ' HB3' HD22 ' A' ' 103' ' ' LEU . 5.8 mmtt -57.7 -41.85 82.5 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.043 -1.036 . . . . 0.0 109.43 179.363 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.418 ' CZ3' ' HG ' ' A' ' 91' ' ' LEU . 4.7 m0 -68.11 -40.21 82.62 Favored 'General case' 0 N--CA 1.506 2.352 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.475 179.296 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.441 ' HD2' HG22 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -66.16 -36.0 81.95 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.274 -0.891 . . . . 0.0 110.229 179.503 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.2 mmtp -53.84 -179.41 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.637 0 O-C-N 121.075 -1.016 . . . . 0.0 110.471 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -106.03 141.26 37.7 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.308 -0.87 . . . . 0.0 109.58 179.428 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.36 -20.49 49.62 Favored Glycine 0 N--CA 1.491 2.366 0 C-N-CA 119.854 -1.165 . . . . 0.0 110.608 -179.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -92.55 57.06 2.85 Favored 'General case' 0 N--CA 1.504 2.233 0 CA-C-N 119.313 1.556 . . . . 0.0 110.282 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -74.93 -38.57 61.76 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.009 -1.057 . . . . 0.0 109.66 179.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -111.91 83.95 1.88 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.239 -0.913 . . . . 0.0 109.602 179.583 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.881 HD13 HD13 ' A' ' 109' ' ' ILE . 9.3 tp -121.02 137.39 54.67 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.268 -0.895 . . . . 0.0 110.017 -179.293 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.439 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.8 p -111.6 -38.54 4.88 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.208 -0.932 . . . . 0.0 112.327 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.819 ' O ' HD11 ' A' ' 103' ' ' LEU . 5.5 m -139.65 -168.71 2.54 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 120.25 -1.531 . . . . 0.0 109.884 178.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.597 HD22 HD23 ' A' ' 90' ' ' LEU . 12.4 mt -97.59 -37.98 9.72 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.006 -1.059 . . . . 0.0 110.557 179.425 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.8 ttt-85 -101.89 32.2 3.54 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.939 -1.101 . . . . 0.0 109.464 178.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.672 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.306 1.7 t -127.36 16.22 7.13 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.231 -0.918 . . . . 0.0 109.119 -179.21 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.881 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -159.77 39.21 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 O-C-N 120.905 -1.122 . . . . 0.0 110.1 -178.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.769 ' C ' HG23 ' A' ' 119' ' ' THR . 1.7 tt0 -104.52 105.26 15.29 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.813 -1.179 . . . . 0.0 111.124 -178.518 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.646 ' HG3' HG21 ' A' ' 119' ' ' THR . 2.9 tttt -116.1 176.01 5.29 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.217 -0.927 . . . . 0.0 109.809 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 8.6 m-20 -165.81 -54.61 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.078 -1.014 . . . . 0.0 110.965 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -140.66 -160.2 1.05 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.178 -0.951 . . . . 0.0 109.701 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 1.4 p -90.09 -35.75 15.26 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 120.792 -1.193 . . . . 0.0 110.788 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 20.0 p30 -111.2 165.0 12.28 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.021 -1.049 . . . . 0.0 110.535 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 53.26 -174.22 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.994 -1.066 . . . . 0.0 110.609 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 91.8 -179.23 41.31 Favored Glycine 0 N--CA 1.494 2.521 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 65.1 m -146.07 96.87 2.86 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.177 -1.19 . . . . 0.0 110.531 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.769 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.3 OUTLIER -125.16 171.97 9.88 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.26 -0.9 . . . . 0.0 110.198 179.866 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.462 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 42.5 t -106.59 155.49 19.57 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.25 -0.906 . . . . 0.0 109.282 178.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.793 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -71.22 -36.81 63.66 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.336 0 O-C-N 121.098 -1.001 . . . . 0.0 110.757 -179.637 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.439 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 5.1 p -54.92 -32.68 61.44 Favored 'General case' 0 N--CA 1.512 2.636 0 O-C-N 120.84 -1.163 . . . . 0.0 110.968 -179.161 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.45 ' HG2' HG22 ' A' ' 109' ' ' ILE . 0.0 OUTLIER -58.5 -35.59 72.47 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.914 -1.116 . . . . 0.0 109.378 178.171 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 55.8 t -79.92 125.42 82.01 Favored Pre-proline 0 N--CA 1.503 2.187 0 O-C-N 121.21 -0.931 . . . . 0.0 109.478 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -64.94 167.94 14.78 Favored 'Trans proline' 0 N--CA 1.488 1.173 0 O-C-N 123.145 1.076 . . . . 0.0 110.662 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.03 -36.86 61.86 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.259 -0.901 . . . . 0.0 110.794 -179.529 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.11 -40.37 81.02 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.045 -1.035 . . . . 0.0 110.077 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -68.14 -41.52 81.5 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.201 -0.937 . . . . 0.0 109.323 179.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.781 HD11 HD11 ' A' ' 121' ' ' ILE . 10.9 mt -62.49 -38.48 90.05 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.496 -0.882 . . . . 0.0 109.859 179.495 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -59.98 -40.32 88.73 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.081 -1.012 . . . . 0.0 109.958 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -64.3 -38.96 92.88 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.174 -0.954 . . . . 0.0 109.822 179.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -60.61 -39.94 89.99 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.24 -0.913 . . . . 0.0 109.99 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.08 -45.06 95.18 Favored 'General case' 0 N--CA 1.508 2.452 0 C-N-CA 119.351 -0.94 . . . . 0.0 109.85 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 10.2 ttp85 -60.83 -39.05 87.58 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.203 -0.936 . . . . 0.0 109.789 179.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 27.8 mtmt -61.86 -34.38 75.89 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.144 -0.973 . . . . 0.0 110.602 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 29.4 mttt -102.49 18.48 21.06 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.005 -1.059 . . . . 0.0 111.921 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 55.35 45.45 83.34 Favored Glycine 0 N--CA 1.498 2.792 0 O-C-N 120.607 -1.308 . . . . 0.0 110.38 179.491 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.8 t -140.67 -163.44 1.53 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.171 -1.194 . . . . 0.0 110.079 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -138.51 145.41 40.73 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.184 -0.948 . . . . 0.0 110.253 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.571 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.6 p -132.03 160.85 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 O-C-N 121.147 -0.971 . . . . 0.0 110.109 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 41.4 t -168.8 80.68 0.14 Allowed 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.22 -0.925 . . . . 0.0 111.149 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.781 ' CG ' HD12 ' A' ' 121' ' ' ILE . 49.6 t80 -94.4 159.8 14.95 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.222 -0.924 . . . . 0.0 110.195 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 28.8 m170 -136.16 -61.13 0.71 Allowed 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 178.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -136.79 152.6 50.48 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.459 -0.776 . . . . 0.0 109.357 179.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 26.2 p -94.74 155.65 16.74 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.156 -0.965 . . . . 0.0 110.904 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.8 p -74.15 -25.28 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.532 0 O-C-N 121.344 -0.848 . . . . 0.0 111.583 -179.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -50.59 -46.68 58.04 Favored 'General case' 0 N--CA 1.517 2.896 0 O-C-N 120.755 -1.216 . . . . 0.0 109.594 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.498 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 29.5 p -141.5 -178.58 5.7 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.411 -0.806 . . . . 0.0 110.411 179.315 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -91.02 62.21 2.93 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 107.781 -2.128 . . . . 0.0 107.781 178.116 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.5 t -105.68 138.77 41.33 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.382 -1.069 . . . . 0.0 109.626 -178.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 3.7 tpt85 -92.65 57.05 2.81 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.276 -0.89 . . . . 0.0 109.727 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 61.82 96.25 0.01 OUTLIER Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.739 -1.344 . . . . 0.0 109.739 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.3 p -104.71 128.51 52.82 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.308 -1.113 . . . . 0.0 110.401 179.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -138.44 142.67 39.5 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.168 -0.957 . . . . 0.0 109.85 -179.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -110.54 -58.18 2.12 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.205 -0.934 . . . . 0.0 110.174 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 7.8 t -158.53 39.71 0.24 Allowed 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.149 -0.969 . . . . 0.0 110.824 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 . . . . . 0 N--CA 1.494 1.746 0 CA-C-O 118.065 -0.969 . . . . 0.0 110.394 -179.98 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.233 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -81.62 158.54 39.38 Favored Glycine 0 N--CA 1.493 2.438 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.2 m -125.6 154.42 72.86 Favored Pre-proline 0 N--CA 1.493 1.718 0 O-C-N 121.129 -1.218 . . . . 0.0 110.235 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.8 103.45 1.58 Allowed 'Trans proline' 0 C--N 1.317 -1.111 0 O-C-N 123.325 1.171 . . . . 0.0 110.433 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.1 mtt85 -125.64 57.41 1.34 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.287 -0.883 . . . . 0.0 110.13 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.8 mm -115.49 -57.39 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.161 -0.962 . . . . 0.0 110.105 -179.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 41.0 tttp -131.64 154.9 48.44 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.313 -0.867 . . . . 0.0 110.291 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 16.1 p -118.03 176.16 5.34 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.133 -0.979 . . . . 0.0 110.209 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 10.0 mtt85 -142.14 173.89 11.11 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.221 -0.924 . . . . 0.0 110.218 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.5 ttt-85 -127.01 133.22 50.58 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.231 -0.918 . . . . 0.0 110.259 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 34.6 t -130.84 137.71 49.51 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.134 -0.979 . . . . 0.0 110.137 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.4 mtpp -124.7 150.74 66.32 Favored Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.153 -0.967 . . . . 0.0 110.278 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.481 ' O ' ' HB3' ' A' ' 12' ' ' ALA . 46.7 Cg_endo -73.06 158.08 49.97 Favored 'Trans proline' 0 C--N 1.317 -1.118 0 O-C-N 123.437 1.23 . . . . 0.0 110.655 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.726 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . 61.96 147.79 0.09 OUTLIER Pre-proline 0 N--CA 1.503 2.183 0 O-C-N 121.307 -0.871 . . . . 0.0 110.691 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.56 162.63 40.83 Favored 'Trans proline' 0 C--N 1.318 -1.039 0 O-C-N 123.245 1.129 . . . . 0.0 110.675 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -48.77 -32.14 8.13 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 121.466 -0.771 . . . . 0.0 111.325 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -54.31 -33.42 52.73 Favored Glycine 0 N--CA 1.499 2.847 0 O-C-N 121.067 -1.021 . . . . 0.0 110.572 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -53.51 -31.48 46.27 Favored 'General case' 0 N--CA 1.512 2.662 0 O-C-N 120.903 -1.351 . . . . 0.0 110.818 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -54.37 -36.97 64.45 Favored 'General case' 0 N--CA 1.513 2.711 0 O-C-N 121.038 -1.039 . . . . 0.0 110.33 179.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.6 mmmt -57.14 -35.02 69.0 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.262 -0.899 . . . . 0.0 110.406 179.424 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.656 ' O ' HD12 ' A' ' 23' ' ' LEU . 3.2 pt -117.32 37.55 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.137 -0.977 . . . . 0.0 110.366 179.577 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.435 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 2.7 tmtt? -83.79 -42.91 0.79 Allowed Pre-proline 0 N--CA 1.507 2.394 0 O-C-N 121.142 -0.974 . . . . 0.0 113.254 -179.155 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.435 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.4 Cg_endo -75.85 -39.68 0.89 Allowed 'Trans proline' 0 N--CA 1.487 1.118 0 O-C-N 122.615 0.797 . . . . 0.0 111.853 -178.306 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.806 HG21 ' CE2' ' A' ' 62' ' ' TYR . 90.7 m -59.39 -43.25 92.96 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 120.906 -1.121 . . . . 0.0 109.952 -179.695 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.656 HD12 ' O ' ' A' ' 19' ' ' ILE . 3.6 mt -63.48 -37.8 88.67 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 119.425 -0.91 . . . . 0.0 109.506 179.304 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.3 m -56.63 -34.82 67.65 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.058 -1.026 . . . . 0.0 110.353 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.11 -38.81 73.95 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.004 -1.06 . . . . 0.0 110.014 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.723 ' CD2' HD22 ' A' ' 55' ' ' LEU . 22.6 m-85 -57.85 -40.09 79.28 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.121 -0.987 . . . . 0.0 110.025 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -57.02 -27.64 61.8 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.267 -0.896 . . . . 0.0 111.066 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.499 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.7 mp -78.09 -35.7 20.53 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.386 0 O-C-N 120.996 -1.065 . . . . 0.0 109.423 179.392 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.1 tp60 -79.78 -39.85 30.0 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 120.985 -1.072 . . . . 0.0 108.61 178.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.131 HD11 HG23 ' A' ' 52' ' ' ILE . 6.6 tp -69.6 -34.31 73.93 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.235 -0.916 . . . . 0.0 110.369 179.103 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -71.01 -35.54 72.07 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 120.885 -1.134 . . . . 0.0 109.953 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -65.44 -38.58 90.29 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.062 -1.024 . . . . 0.0 110.006 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.431 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -73.81 -42.02 61.51 Favored 'General case' 0 N--CA 1.504 2.251 0 C-N-CA 118.975 -1.09 . . . . 0.0 109.097 179.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -63.76 -33.19 75.1 Favored 'General case' 0 N--CA 1.505 2.322 0 C-N-CA 119.471 -0.892 . . . . 0.0 110.129 179.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.1 mttm -82.16 -31.35 30.53 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 120.857 -1.152 . . . . 0.0 110.893 179.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -54.0 -32.73 55.05 Favored 'General case' 0 N--CA 1.512 2.653 0 O-C-N 120.97 -1.081 . . . . 0.0 110.709 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 31.2 tttt -91.72 -47.15 7.52 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.117 -0.989 . . . . 0.0 110.062 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 71.0 m 52.21 45.37 28.52 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.033 -1.042 . . . . 0.0 110.974 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.1 t 52.88 84.29 0.06 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.049 -1.032 . . . . 0.0 110.854 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 32.6 ttmt 52.49 90.02 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.099 -1.0 . . . . 0.0 110.96 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.7 tt -148.22 -58.34 0.24 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.205 -0.935 . . . . 0.0 110.486 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -115.01 -164.08 0.92 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.205 -0.934 . . . . 0.0 110.08 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -103.95 -170.7 1.81 Allowed 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.103 -0.998 . . . . 0.0 110.054 179.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 52.82 73.49 0.35 Allowed 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.001 -1.062 . . . . 0.0 110.422 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.3 m -105.97 -50.89 3.08 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.227 -0.92 . . . . 0.0 110.434 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.416 ' O ' ' CG ' ' A' ' 50' ' ' TRP . 35.7 m120 -57.92 -40.01 79.36 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.168 -0.958 . . . . 0.0 109.924 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -66.13 -42.88 88.55 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.163 -0.96 . . . . 0.0 109.59 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.401 ' CG ' ' HA ' ' A' ' 33' ' ' ALA . 49.5 tp60 -68.51 -40.58 80.78 Favored 'General case' 0 N--CA 1.505 2.278 0 C-N-CA 119.293 -0.963 . . . . 0.0 109.347 179.283 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.586 HD23 HD12 ' A' ' 52' ' ' ILE . 13.1 mt -63.41 -36.85 85.1 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.238 -0.914 . . . . 0.0 109.924 179.574 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.516 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 53.6 m0 -58.04 -37.28 74.06 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 120.955 -1.09 . . . . 0.0 109.908 179.663 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -30.17 71.32 Favored 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 119.125 -1.03 . . . . 0.0 109.516 178.181 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 1.131 HG23 HD11 ' A' ' 30' ' ' LEU . 17.7 mt -69.61 -58.66 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.268 0 O-C-N 120.875 -1.14 . . . . 0.0 109.181 179.371 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.8 ptm -61.48 -29.96 70.31 Favored 'General case' 0 N--CA 1.51 2.557 0 C-N-CA 118.462 -1.295 . . . . 0.0 109.779 179.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -65.92 -38.23 88.13 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 120.887 -1.133 . . . . 0.0 109.167 178.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.723 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.3 mt -53.3 -32.23 47.82 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 120.962 -1.086 . . . . 0.0 110.182 179.108 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.461 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 72.6 t60 -55.61 -38.23 69.17 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 120.982 -1.074 . . . . 0.0 110.113 179.634 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.422 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.3 m170 -58.57 -47.17 85.18 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.091 -1.006 . . . . 0.0 109.412 179.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 -61.26 -35.64 77.82 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 119.407 -0.917 . . . . 0.0 109.219 178.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.459 ' HD3' ' CD1' ' A' ' 26' ' ' PHE . 20.2 mmm-85 -63.9 -51.14 65.88 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.105 -0.997 . . . . 0.0 109.37 179.212 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 52.0 p -60.58 -39.63 88.74 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.22 -0.925 . . . . 0.0 109.661 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.3 ttt85 -65.18 -41.76 94.28 Favored 'General case' 0 N--CA 1.504 2.255 0 C-N-CA 119.115 -1.034 . . . . 0.0 109.012 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.806 ' CE2' HG21 ' A' ' 22' ' ' THR . 46.1 t80 -63.37 -50.06 71.42 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.244 -0.91 . . . . 0.0 109.502 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.578 HD12 ' HB2' ' A' ' 87' ' ' ALA . 84.9 mt -70.2 -37.68 72.31 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.292 0 O-C-N 121.211 -0.931 . . . . 0.0 109.524 179.451 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.461 ' HD2' HD13 ' A' ' 92' ' ' ILE . 12.9 t80 -67.56 -42.17 83.04 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.168 -0.958 . . . . 0.0 108.995 179.04 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.404 ' HA ' ' HD3' ' A' ' 69' ' ' LYS . 90.0 m -61.19 -40.76 95.14 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.123 -0.986 . . . . 0.0 110.322 -179.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.599 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.35 -33.28 25.89 Favored 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 118.894 -1.122 . . . . 0.0 112.504 -178.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.502 ' N ' HD12 ' A' ' 66' ' ' LEU . 45.6 t80 -86.35 -32.12 21.15 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 120.611 -1.305 . . . . 0.0 111.927 -179.295 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -98.34 -18.98 18.04 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 120.874 -1.141 . . . . 0.0 112.721 -178.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.404 ' HD3' ' HA ' ' A' ' 65' ' ' THR . 13.5 mtpt -119.38 -58.77 1.89 Allowed 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.483 -1.385 . . . . 0.0 110.794 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.41 ' HB3' ' HA ' ' A' ' 66' ' ' LEU . 5.8 tpt180 -64.53 -30.59 71.62 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.11 -0.994 . . . . 0.0 110.99 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt 57.51 41.8 25.36 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 120.815 -1.178 . . . . 0.0 110.056 -179.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.07 35.46 3.93 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.409 -0.807 . . . . 0.0 109.941 179.288 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.81 HG13 HD23 ' A' ' 77' ' ' LEU . 13.8 tt -152.83 162.19 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.145 -0.972 . . . . 0.0 109.874 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.0 m -109.64 147.58 32.82 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.038 -1.039 . . . . 0.0 110.133 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.7 ttmt -45.81 -32.42 2.56 Favored 'General case' 0 N--CA 1.514 2.774 0 O-C-N 121.317 -0.865 . . . . 0.0 111.556 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.75 -50.28 73.02 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 120.987 -1.071 . . . . 0.0 109.205 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.81 HD23 HG13 ' A' ' 73' ' ' ILE . 41.7 tp -67.24 -44.48 79.35 Favored 'General case' 0 N--CA 1.505 2.292 0 C-N-CA 119.208 -0.997 . . . . 0.0 108.354 178.708 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.436 ' HA ' HD12 ' A' ' 81' ' ' LEU . 14.3 t80 -59.97 -37.58 80.04 Favored 'General case' 0 N--CA 1.507 2.397 0 C-N-CA 119.628 -0.829 . . . . 0.0 109.511 179.117 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.455 ' O ' HG22 ' A' ' 82' ' ' ILE . 32.3 t70 -75.22 -40.93 58.65 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.141 -0.974 . . . . 0.0 108.902 178.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.726 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 87.4 t90 -59.26 -37.83 78.6 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.05 -1.031 . . . . 0.0 109.263 178.744 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.54 HD23 ' CE2' ' A' ' 86' ' ' TYR . 11.4 mt -66.68 -57.28 7.48 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.188 -0.945 . . . . 0.0 109.057 178.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.553 HD11 ' N ' ' A' ' 89' ' ' LYS . 0.7 OUTLIER -56.01 -27.36 22.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.406 0 O-C-N 121.228 -0.92 . . . . 0.0 110.837 -179.877 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.9 tttt -89.52 -16.75 30.02 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 120.938 -1.101 . . . . 0.0 111.919 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.445 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 76.3 mm-40 -104.89 25.72 10.1 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.516 -1.365 . . . . 0.0 111.98 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.403 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 18.8 ttmt 76.64 66.92 0.05 Allowed 'General case' 0 N--CA 1.511 2.623 0 O-C-N 121.198 -0.938 . . . . 0.0 112.053 179.274 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.609 ' HE2' HD13 ' A' ' 23' ' ' LEU . 26.1 m-85 -129.95 -63.31 0.92 Allowed 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 178.751 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.578 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -135.75 171.21 14.78 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.497 -0.752 . . . . 0.0 109.23 179.164 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.461 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 11.0 t0 -119.49 111.72 18.46 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.151 -0.968 . . . . 0.0 110.273 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.553 ' N ' HD11 ' A' ' 82' ' ' ILE . 8.3 mtpt -57.58 -37.93 73.99 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.207 -0.933 . . . . 0.0 110.077 179.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.489 HD23 HD22 ' A' ' 106' ' ' LEU . 17.5 tp -59.08 -37.16 76.44 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.181 -0.949 . . . . 0.0 110.163 179.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.442 ' HA ' HD21 ' A' ' 106' ' ' LEU . 58.8 tp -70.03 -49.34 52.29 Favored 'General case' 0 N--CA 1.506 2.354 0 C-N-CA 119.231 -0.988 . . . . 0.0 108.764 179.275 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.461 HD13 ' HD2' ' A' ' 64' ' ' TYR . 68.1 mt -57.57 -38.51 64.37 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.52 0 O-C-N 121.148 -0.97 . . . . 0.0 108.693 178.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.04 -41.59 86.29 Favored 'General case' 0 N--CA 1.502 2.165 0 C-N-CA 119.356 -0.938 . . . . 0.0 108.742 178.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 8.3 mmtm -53.21 -39.84 64.02 Favored 'General case' 0 N--CA 1.512 2.669 0 O-C-N 121.162 -0.961 . . . . 0.0 109.892 179.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 3.6 m0 -68.85 -26.48 65.17 Favored 'General case' 0 N--CA 1.508 2.447 0 C-N-CA 119.436 -0.906 . . . . 0.0 110.723 179.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.49 -33.84 25.48 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 120.809 -1.182 . . . . 0.0 110.776 179.48 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? -53.26 -177.7 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.767 0 O-C-N 120.992 -1.068 . . . . 0.0 110.793 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -102.55 146.86 27.53 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.237 -0.914 . . . . 0.0 109.525 179.1 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 86.0 0.31 87.34 Favored Glycine 0 N--CA 1.495 2.619 0 C-N-CA 119.979 -1.105 . . . . 0.0 111.277 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.583 ' HB3' HD23 ' A' ' 103' ' ' LEU . 48.4 m-85 -111.06 67.17 0.64 Allowed 'General case' 0 N--CA 1.498 1.936 0 CA-C-N 119.576 1.688 . . . . 0.0 109.593 179.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -96.17 -35.35 11.34 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.111 -0.993 . . . . 0.0 110.935 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.54 63.0 0.77 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.021 -1.049 . . . . 0.0 110.895 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.583 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.5 pp -111.95 154.61 25.0 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.932 -1.105 . . . . 0.0 109.798 179.319 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.422 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.4 p -115.6 -30.47 6.16 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -178.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.634 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.5 m -142.09 -167.45 2.47 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 120.052 -1.655 . . . . 0.0 110.087 179.399 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.489 HD22 HD23 ' A' ' 90' ' ' LEU . 13.6 mt -95.53 -40.13 9.61 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.142 -0.974 . . . . 0.0 109.89 179.17 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -101.15 28.51 5.3 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.044 -1.035 . . . . 0.0 110.067 178.189 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.634 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.8 t -126.92 15.6 7.4 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.047 -1.033 . . . . 0.0 109.112 -179.584 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.501 HG22 ' HG3' ' A' ' 123' ' ' ARG . 1.0 OUTLIER -159.34 38.75 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 O-C-N 120.931 -1.106 . . . . 0.0 110.345 -178.783 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.695 ' C ' HG23 ' A' ' 119' ' ' THR . 1.2 tt0 -110.11 117.44 33.73 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 120.79 -1.194 . . . . 0.0 111.452 -178.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.444 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 21.9 ttmt -107.82 -57.73 2.06 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.292 -0.88 . . . . 0.0 110.18 179.34 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 50.89 -174.59 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.092 0 O-C-N 120.974 -1.079 . . . . 0.0 110.934 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -167.87 84.61 0.2 Allowed 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.194 -0.941 . . . . 0.0 111.018 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 91.1 m -144.01 -59.27 0.39 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.226 -0.921 . . . . 0.0 110.411 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -154.45 -57.63 0.11 Allowed 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.098 -1.001 . . . . 0.0 110.676 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 53.3 t-20 -119.33 73.22 0.93 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.236 -0.915 . . . . 0.0 110.203 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -93.3 128.67 9.55 Favored Glycine 0 N--CA 1.493 2.457 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 14.1 m -117.27 124.54 49.26 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.202 -1.175 . . . . 0.0 110.141 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.695 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.2 OUTLIER -125.41 174.82 7.91 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.208 -0.932 . . . . 0.0 110.476 -179.931 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.458 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 48.5 t -109.25 155.48 21.07 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.359 -0.838 . . . . 0.0 109.116 178.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.962 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -73.65 -30.83 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 121.026 -1.046 . . . . 0.0 111.475 -179.163 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.478 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.4 p -59.79 -35.85 75.51 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 120.598 -1.314 . . . . 0.0 110.486 -179.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.501 ' HG3' HG22 ' A' ' 109' ' ' ILE . 0.1 OUTLIER -57.03 -33.13 66.88 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.041 -1.037 . . . . 0.0 109.961 178.807 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 61.6 t -79.78 123.93 83.65 Favored Pre-proline 0 N--CA 1.504 2.25 0 O-C-N 121.062 -1.024 . . . . 0.0 109.965 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.462 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.8 Cg_endo -66.33 -178.22 1.08 Allowed 'Trans proline' 0 N--CA 1.488 1.149 0 O-C-N 123.112 1.059 . . . . 0.0 110.785 179.574 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -75.06 -38.0 61.48 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.208 -0.932 . . . . 0.0 110.413 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.1 -43.37 91.87 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.052 -1.03 . . . . 0.0 109.95 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 64.1 tp60 -67.3 -41.54 85.21 Favored 'General case' 0 N--CA 1.506 2.331 0 C-N-CA 119.296 -0.962 . . . . 0.0 109.298 179.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.497 HD11 HD11 ' A' ' 121' ' ' ILE . 4.6 mt -63.44 -38.95 93.11 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.274 -0.891 . . . . 0.0 109.508 179.195 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -59.07 -39.55 82.43 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.058 -1.026 . . . . 0.0 109.989 179.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -58.59 -38.04 77.08 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.122 -0.986 . . . . 0.0 110.212 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -59.98 -41.99 93.23 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.177 -0.952 . . . . 0.0 110.048 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.662 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -61.49 -45.12 95.57 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.17 -0.956 . . . . 0.0 109.809 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 14.2 mmt180 -59.58 -39.26 83.55 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.155 -0.966 . . . . 0.0 109.9 179.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 3.4 ttmt -58.82 -35.75 73.39 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.148 -0.97 . . . . 0.0 110.515 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 43.8 mttt -107.74 21.62 17.16 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 120.961 -1.087 . . . . 0.0 111.827 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.5 46.26 58.57 Favored Glycine 0 N--CA 1.499 2.888 0 O-C-N 120.695 -1.253 . . . . 0.0 110.656 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.662 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 9.0 t -141.03 -165.06 1.87 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.155 -1.203 . . . . 0.0 110.176 179.822 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -126.54 171.98 10.62 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.12 -0.988 . . . . 0.0 110.355 -179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 8.7 p -157.06 160.94 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.326 -0.859 . . . . 0.0 110.664 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 27.3 t -167.58 107.31 0.57 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.185 -0.947 . . . . 0.0 110.911 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.962 ' CD1' HD12 ' A' ' 121' ' ' ILE . 84.2 t80 -108.79 160.23 16.14 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.247 -0.908 . . . . 0.0 111.035 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -138.61 -61.03 0.59 Allowed 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -142.15 149.12 39.35 Favored 'General case' 0 N--CA 1.495 1.821 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 178.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . 0.415 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 29.6 p -89.88 153.88 20.3 Favored 'General case' 0 N--CA 1.506 2.342 0 C-N-CA 119.078 -1.049 . . . . 0.0 111.187 -179.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 19.6 m -72.54 -23.43 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 121.428 -0.795 . . . . 0.0 111.385 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -51.52 -62.6 1.52 Allowed 'General case' 0 N--CA 1.513 2.723 0 O-C-N 120.781 -1.2 . . . . 0.0 110.021 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.516 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 21.9 p -123.9 -164.5 1.24 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.27 -0.894 . . . . 0.0 110.321 179.255 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . 0.434 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -101.58 64.45 0.5 Allowed Glycine 0 N--CA 1.493 2.462 0 N-CA-C 107.897 -2.081 . . . . 0.0 107.897 178.501 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 28.4 t -104.36 141.42 36.35 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.314 -1.109 . . . . 0.0 109.965 -179.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 46.0 ttt180 -97.06 51.01 1.1 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.271 -0.893 . . . . 0.0 109.476 179.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.2 99.32 0.05 OUTLIER Glycine 0 N--CA 1.486 2.028 0 N-CA-C 109.969 -1.252 . . . . 0.0 109.969 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 26.2 p -110.19 126.37 54.04 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.269 -1.136 . . . . 0.0 110.148 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -150.33 148.44 28.82 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.038 -1.039 . . . . 0.0 110.472 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -102.24 -45.67 5.05 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.26 -0.9 . . . . 0.0 110.562 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.97 -38.7 68.11 Favored 'General case' 0 N--CA 1.511 2.607 0 O-C-N 121.061 -1.025 . . . . 0.0 110.543 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.494 1.744 0 CA-C-O 118.019 -0.991 . . . . 0.0 110.149 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.28 0 N-CA-C 109.511 -1.435 . . . . 0.0 109.511 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -74.76 155.21 47.95 Favored Glycine 0 N--CA 1.493 2.49 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.5 t -141.79 149.83 54.61 Favored Pre-proline 0 N--CA 1.494 1.747 0 O-C-N 121.154 -1.204 . . . . 0.0 110.245 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.05 -171.22 0.74 Allowed 'Trans proline' 0 C--N 1.317 -1.109 0 O-C-N 123.388 1.204 . . . . 0.0 110.425 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 52.65 95.17 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.098 -1.001 . . . . 0.0 110.845 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.3 tp -142.43 138.66 29.28 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.236 -0.915 . . . . 0.0 110.117 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.2 tttm -134.72 -169.66 2.39 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.216 -0.927 . . . . 0.0 110.023 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.2 p -119.03 75.73 1.06 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.149 -0.969 . . . . 0.0 110.297 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 21.5 mtt180 -141.21 142.84 33.94 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.141 -0.974 . . . . 0.0 110.082 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.8 mmt85 -116.4 107.74 15.17 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.282 -0.886 . . . . 0.0 110.288 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.6 m -129.28 81.02 2.0 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.184 -0.948 . . . . 0.0 110.221 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.12 175.39 0.04 OUTLIER Pre-proline 0 N--CA 1.502 2.146 0 O-C-N 121.102 -0.999 . . . . 0.0 110.687 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.484 ' O ' ' HB3' ' A' ' 12' ' ' ALA . 46.5 Cg_endo -72.57 158.92 50.06 Favored 'Trans proline' 0 C--N 1.315 -1.193 0 O-C-N 123.405 1.213 . . . . 0.0 110.484 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.757 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . 61.86 152.1 0.11 Allowed Pre-proline 0 N--CA 1.504 2.235 0 O-C-N 121.221 -0.925 . . . . 0.0 110.394 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.01 163.77 38.09 Favored 'Trans proline' 0 C--N 1.317 -1.095 0 O-C-N 123.387 1.204 . . . . 0.0 110.718 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -48.27 -32.39 7.22 Favored 'General case' 0 N--CA 1.516 2.841 0 O-C-N 121.435 -0.791 . . . . 0.0 111.426 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.81 -34.89 51.77 Favored Glycine 0 N--CA 1.498 2.812 0 O-C-N 120.967 -1.083 . . . . 0.0 110.417 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.436 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 27.3 t80 -55.17 -33.14 62.72 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 121.039 -1.271 . . . . 0.0 110.739 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.7 tm-20 -54.4 -38.06 65.78 Favored 'General case' 0 N--CA 1.511 2.623 0 O-C-N 120.984 -1.073 . . . . 0.0 110.206 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.8 mttm -59.06 -35.62 73.65 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.257 -0.902 . . . . 0.0 110.21 179.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.64 ' O ' HD12 ' A' ' 23' ' ' LEU . 1.9 pt -117.99 37.07 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 121.074 -1.016 . . . . 0.0 110.34 179.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.432 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 2.5 tmtt? -84.82 -43.35 0.69 Allowed Pre-proline 0 N--CA 1.509 2.488 0 O-C-N 121.12 -0.988 . . . . 0.0 113.379 -179.041 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.432 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.7 Cg_endo -76.3 -37.15 1.52 Allowed 'Trans proline' 0 N--CA 1.486 1.065 0 O-C-N 122.586 0.782 . . . . 0.0 111.892 -178.018 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.67 HG21 ' CE2' ' A' ' 62' ' ' TYR . 88.2 m -59.85 -42.07 92.84 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 120.919 -1.113 . . . . 0.0 110.131 -179.579 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.704 HD13 ' HE2' ' A' ' 86' ' ' TYR . 2.4 mt -64.85 -39.07 92.98 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 119.387 -0.925 . . . . 0.0 109.577 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.0 -35.59 69.4 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.159 -0.963 . . . . 0.0 110.247 179.502 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -57.24 -36.33 70.8 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.056 -1.027 . . . . 0.0 110.389 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.528 ' CD2' HD22 ' A' ' 55' ' ' LEU . 15.5 m-85 -59.05 -39.64 82.64 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.07 -1.019 . . . . 0.0 110.525 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -59.45 -39.43 83.6 Favored 'General case' 0 N--CA 1.508 2.427 0 C-N-CA 119.362 -0.935 . . . . 0.0 110.42 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.431 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.1 mp -65.37 -41.78 92.04 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.341 0 C-N-CA 119.204 -0.998 . . . . 0.0 108.764 179.452 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.66 -50.83 40.31 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 119.209 -0.997 . . . . 0.0 108.443 178.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.054 HD11 HG23 ' A' ' 52' ' ' ILE . 5.2 tp -58.9 -34.53 71.78 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.25 -0.906 . . . . 0.0 109.502 178.404 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.08 -39.8 79.47 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 121.061 -1.025 . . . . 0.0 110.194 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -63.03 -51.12 67.97 Favored 'General case' 0 N--CA 1.507 2.403 0 C-N-CA 119.27 -0.972 . . . . 0.0 109.57 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.495 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -68.26 -38.71 82.03 Favored 'General case' 0 N--CA 1.505 2.314 0 C-N-CA 119.249 -0.98 . . . . 0.0 109.262 179.031 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -67.41 -34.04 76.42 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.207 -0.933 . . . . 0.0 110.117 179.293 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 9.2 mmtt -78.79 -38.03 39.44 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.0 -1.063 . . . . 0.0 110.293 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -58.45 -39.09 78.93 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.06 -1.025 . . . . 0.0 110.162 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 72.9 tttt -56.72 -37.53 71.09 Favored 'General case' 0 N--CA 1.511 2.579 0 O-C-N 121.131 -0.98 . . . . 0.0 110.382 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.5 m -112.04 50.3 0.86 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.113 -0.992 . . . . 0.0 110.218 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.442 ' OG ' ' HD3' ' A' ' 40' ' ' LYS . 1.6 t -142.98 -62.08 0.42 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.205 -0.935 . . . . 0.0 110.19 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.442 ' HD3' ' OG ' ' A' ' 39' ' ' SER . 0.1 OUTLIER -114.07 -54.9 2.55 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.24 -0.912 . . . . 0.0 110.209 179.969 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.428 ' O ' HD23 ' A' ' 41' ' ' LEU . 1.0 OUTLIER 54.37 47.51 22.76 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.045 -1.035 . . . . 0.0 110.656 -179.959 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -120.62 -58.17 1.85 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.212 -0.93 . . . . 0.0 110.148 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -129.85 153.6 48.11 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.252 -0.905 . . . . 0.0 110.138 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.9 mmmt 52.68 61.35 3.23 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.06 -1.025 . . . . 0.0 110.678 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -111.13 -53.46 2.7 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.227 -0.921 . . . . 0.0 110.406 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -56.87 -39.44 74.33 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 121.167 -0.958 . . . . 0.0 109.962 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -61.48 -40.53 94.86 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.238 -0.914 . . . . 0.0 109.766 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 49.7 tp60 -61.4 -40.54 94.74 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.147 -0.971 . . . . 0.0 109.848 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.5 mt -60.01 -39.19 84.94 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.124 -0.985 . . . . 0.0 110.083 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.505 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.8 m0 -58.09 -37.03 73.74 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.011 -1.055 . . . . 0.0 110.023 179.603 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -60.59 -30.36 69.76 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.081 -1.012 . . . . 0.0 110.089 178.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 1.054 HG23 HD11 ' A' ' 30' ' ' LEU . 17.1 mt -72.27 -58.78 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.237 0 O-C-N 120.871 -1.143 . . . . 0.0 109.107 179.424 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.3 ptm -60.79 -29.53 69.5 Favored 'General case' 0 N--CA 1.509 2.515 0 C-N-CA 118.52 -1.272 . . . . 0.0 109.684 178.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -70.33 -38.91 74.98 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 120.904 -1.122 . . . . 0.0 108.931 177.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.528 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.3 mt -53.69 -31.53 48.29 Favored 'General case' 0 N--CA 1.512 2.642 0 O-C-N 121.058 -1.026 . . . . 0.0 110.3 178.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.451 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 3.9 t60 -57.13 -37.38 71.92 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.002 -1.062 . . . . 0.0 110.097 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.489 ' NE2' HD21 ' A' ' 91' ' ' LEU . 5.8 m170 -59.31 -48.67 80.77 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.006 -1.059 . . . . 0.0 109.457 179.044 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.6 tp60 -60.82 -37.27 81.43 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 119.34 -0.944 . . . . 0.0 109.071 178.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.434 ' HD2' ' CD2' ' A' ' 26' ' ' PHE . 11.5 mtp85 -66.36 -51.79 53.58 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.147 -0.971 . . . . 0.0 109.024 178.7 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.453 ' HA ' ' HB1' ' A' ' 87' ' ' ALA . 22.2 p -63.46 -38.78 92.45 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.241 -0.912 . . . . 0.0 109.177 179.156 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -65.18 -38.82 91.72 Favored 'General case' 0 N--CA 1.507 2.41 0 C-N-CA 119.242 -0.983 . . . . 0.0 109.25 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.67 ' CE2' HG21 ' A' ' 22' ' ' THR . 37.1 t80 -60.99 -49.8 75.99 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.155 -0.966 . . . . 0.0 109.313 179.441 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.63 HD12 ' HB2' ' A' ' 87' ' ' ALA . 87.7 mt -74.3 -41.76 50.63 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 C-N-CA 119.42 -0.912 . . . . 0.0 109.128 179.219 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.497 ' CD1' ' CD2' ' A' ' 68' ' ' TYR . 45.8 t80 -60.51 -35.38 75.83 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.259 -0.901 . . . . 0.0 109.653 178.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.401 ' HA ' ' CD ' ' A' ' 69' ' ' LYS . 79.7 m -74.52 -38.24 62.85 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.926 -1.109 . . . . 0.0 110.422 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.561 ' C ' HD12 ' A' ' 66' ' ' LEU . 3.7 pp -83.08 -30.86 27.66 Favored 'General case' 0 N--CA 1.505 2.288 0 C-N-CA 119.028 -1.069 . . . . 0.0 112.512 -179.046 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.482 ' N ' HD12 ' A' ' 66' ' ' LEU . 42.1 t80 -86.04 -33.25 21.07 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 120.634 -1.291 . . . . 0.0 111.724 -179.203 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.497 ' CD2' ' CD1' ' A' ' 64' ' ' TYR . 29.4 m-85 -97.4 -25.73 15.11 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.708 -1.245 . . . . 0.0 112.432 -178.774 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.401 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 4.6 mttt -113.37 -60.14 1.92 Allowed 'General case' 0 N--CA 1.501 2.078 0 O-C-N 120.659 -1.275 . . . . 0.0 111.131 -179.645 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.418 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 3.0 ttt85 -62.68 -31.06 71.88 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.127 -0.983 . . . . 0.0 110.641 -179.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.1 tttt 58.29 44.33 18.78 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 120.813 -1.18 . . . . 0.0 110.001 -179.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.33 36.36 3.59 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.358 -0.839 . . . . 0.0 109.891 179.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.79 HG13 HD23 ' A' ' 77' ' ' LEU . 14.2 tt -157.32 162.53 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.206 -0.934 . . . . 0.0 110.175 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.56 149.49 29.57 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.164 -0.96 . . . . 0.0 110.232 179.848 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.9 tttt -46.29 -32.35 3.06 Favored 'General case' 0 N--CA 1.515 2.807 0 O-C-N 121.362 -0.836 . . . . 0.0 111.584 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -63.1 -51.96 64.49 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.925 -1.109 . . . . 0.0 109.274 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.79 HD23 HG13 ' A' ' 73' ' ' ILE . 40.5 tp -65.04 -43.48 92.2 Favored 'General case' 0 N--CA 1.506 2.347 0 C-N-CA 119.141 -1.024 . . . . 0.0 108.559 178.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.71 ' HA ' HD12 ' A' ' 81' ' ' LEU . 14.0 t80 -60.99 -41.72 97.03 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.301 -0.875 . . . . 0.0 109.242 179.151 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -70.57 -42.69 70.77 Favored 'General case' 0 N--CA 1.503 2.221 0 C-N-CA 119.321 -0.951 . . . . 0.0 108.518 178.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.757 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 86.6 t90 -56.99 -35.19 68.89 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.338 -0.851 . . . . 0.0 109.519 178.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.71 HD12 ' HA ' ' A' ' 78' ' ' TYR . 13.4 mt -67.53 -57.94 5.6 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.084 -1.01 . . . . 0.0 109.081 179.077 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.417 ' CD1' ' CE1' ' A' ' 78' ' ' TYR . 0.5 OUTLIER -57.24 -27.22 27.45 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.685 0 C-N-CA 119.044 -1.063 . . . . 0.0 109.897 179.218 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -83.34 -20.42 34.35 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 120.885 -1.134 . . . . 0.0 111.391 179.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.437 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 16.5 mm-40 -107.21 22.97 15.17 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 120.652 -1.28 . . . . 0.0 111.989 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 8.1 tttp 74.44 78.45 0.12 Allowed 'General case' 0 N--CA 1.511 2.61 0 O-C-N 121.072 -1.017 . . . . 0.0 111.37 179.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.704 ' HE2' HD13 ' A' ' 23' ' ' LEU . 28.4 m-85 -136.52 -63.79 0.61 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.622 -0.674 . . . . 0.0 109.707 -179.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.63 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -128.5 -173.42 2.95 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.349 -0.844 . . . . 0.0 109.755 179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.451 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 7.8 t0 -126.18 102.57 7.26 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.151 -0.968 . . . . 0.0 110.53 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.6 mtmt -59.37 -38.48 80.57 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 121.184 -0.948 . . . . 0.0 109.95 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.665 HD23 HD13 ' A' ' 106' ' ' LEU . 26.0 tp -60.44 -41.71 94.62 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.194 -0.941 . . . . 0.0 109.864 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.495 ' N ' HD11 ' A' ' 106' ' ' LEU . 60.5 tp -67.01 -49.42 65.38 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.068 -1.02 . . . . 0.0 108.961 179.321 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.482 HG23 ' CE1' ' A' ' 64' ' ' TYR . 40.7 mt -56.81 -36.36 49.32 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.47 0 O-C-N 121.124 -0.985 . . . . 0.0 108.918 178.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.77 -39.64 94.79 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.121 -0.987 . . . . 0.0 109.082 178.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.436 ' HD2' ' CZ ' ' A' ' 100' ' ' TYR . 4.3 mmtt -59.32 -46.58 88.19 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.087 -1.008 . . . . 0.0 109.276 179.274 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.0 m0 -60.17 -37.54 80.48 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.247 -0.908 . . . . 0.0 110.111 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.6 mtp85 -75.14 -31.92 61.21 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.064 -1.023 . . . . 0.0 110.615 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -53.97 -176.9 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.699 0 O-C-N 121.014 -1.054 . . . . 0.0 110.572 179.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 2.4 m -102.89 133.38 48.08 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.183 -0.948 . . . . 0.0 109.751 179.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 96.39 9.09 57.08 Favored Glycine 0 N--CA 1.493 2.486 0 C-N-CA 120.152 -1.023 . . . . 0.0 111.242 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.486 ' HB3' HD23 ' A' ' 103' ' ' LEU . 51.4 m-85 -116.08 69.02 0.73 Allowed 'General case' 0 N--CA 1.495 1.801 0 CA-C-N 119.569 1.685 . . . . 0.0 109.971 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -97.29 -35.25 10.79 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.143 -0.973 . . . . 0.0 110.915 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.98 71.88 0.95 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.999 -1.063 . . . . 0.0 110.8 -179.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.486 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.3 pp -123.58 161.78 24.3 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.038 -1.039 . . . . 0.0 109.946 179.38 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.483 ' N ' HD12 ' A' ' 103' ' ' LEU . 26.8 p -120.48 -33.0 3.95 Favored 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -178.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.626 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.8 m -140.92 -168.39 2.59 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.067 -1.646 . . . . 0.0 110.162 179.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.665 HD13 HD23 ' A' ' 90' ' ' LEU . 13.2 mt -95.47 -39.4 10.0 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.235 -0.916 . . . . 0.0 109.909 178.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 9.3 ttm180 -101.15 27.23 6.28 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.913 -1.117 . . . . 0.0 110.271 178.174 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.626 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.287 1.8 t -124.82 14.38 8.6 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.054 -1.029 . . . . 0.0 109.213 -179.779 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.458 HG23 ' C ' ' A' ' 108' ' ' CYS . 1.0 OUTLIER -158.67 35.64 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.339 0 O-C-N 120.714 -1.241 . . . . 0.0 111.116 -178.8 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.59 ' O ' HG23 ' A' ' 119' ' ' THR . 12.3 mt-30 -136.31 152.76 51.03 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 120.604 -1.31 . . . . 0.0 111.498 -178.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.439 ' HB3' ' OG1' ' A' ' 119' ' ' THR . 0.0 OUTLIER -132.13 -176.09 3.95 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.213 -0.93 . . . . 0.0 110.065 179.581 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -124.29 175.92 6.77 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.247 -0.908 . . . . 0.0 110.24 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -116.13 154.21 30.39 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.147 -0.971 . . . . 0.0 110.124 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 65.32 -68.53 0.11 Allowed 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.13 -0.982 . . . . 0.0 110.888 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 13.6 t30 -149.21 -172.76 4.2 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.837 -1.164 . . . . 0.0 110.457 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 4.0 t30 53.05 50.94 16.76 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 120.945 -1.097 . . . . 0.0 110.794 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -83.19 134.61 12.99 Favored Glycine 0 N--CA 1.493 2.485 0 N-CA-C 109.469 -1.452 . . . . 0.0 109.469 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 13.8 m -147.06 95.16 2.52 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.174 -1.192 . . . . 0.0 110.48 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.59 HG23 ' O ' ' A' ' 110' ' ' GLN . 2.8 m -132.96 169.84 16.22 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.22 -0.925 . . . . 0.0 110.069 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 46.7 t -101.49 155.55 18.01 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.259 -0.9 . . . . 0.0 109.785 179.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.815 HD12 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -71.64 -37.47 63.33 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.347 0 O-C-N 121.087 -1.008 . . . . 0.0 110.682 -179.554 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.463 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 9.2 p -52.82 -32.98 47.13 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 120.953 -1.092 . . . . 0.0 111.262 -178.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -33.19 68.71 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 120.907 -1.121 . . . . 0.0 109.852 178.34 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 48.4 t -81.11 125.73 78.85 Favored Pre-proline 0 N--CA 1.503 2.216 0 O-C-N 121.1 -1.0 . . . . 0.0 109.746 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.661 ' HD3' ' HB1' ' A' ' 154' ' ' ALA . 38.1 Cg_endo -65.91 172.02 9.04 Favored 'Trans proline' 0 N--CA 1.489 1.224 0 O-C-N 123.145 1.076 . . . . 0.0 110.815 179.696 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 5.1 tpt180 -75.07 -37.88 61.47 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.304 -0.873 . . . . 0.0 110.426 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.53 -40.28 78.45 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.071 -1.018 . . . . 0.0 110.107 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -69.41 -40.89 77.03 Favored 'General case' 0 N--CA 1.505 2.302 0 C-N-CA 119.344 -0.942 . . . . 0.0 109.333 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.663 ' O ' HG11 ' A' ' 140' ' ' VAL . 4.3 mt -67.14 -38.93 86.39 Favored 'General case' 0 N--CA 1.507 2.377 0 C-N-CA 119.494 -0.882 . . . . 0.0 109.591 179.254 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -65.96 -40.07 90.96 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.133 -0.98 . . . . 0.0 109.573 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.71 -39.64 94.66 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.165 -0.959 . . . . 0.0 109.791 179.551 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -60.41 -41.78 94.64 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.287 -0.883 . . . . 0.0 110.031 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.41 -40.63 91.69 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.223 -0.923 . . . . 0.0 110.025 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -60.16 -39.59 86.94 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.239 -0.913 . . . . 0.0 109.95 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -61.76 -34.92 76.71 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.247 -0.908 . . . . 0.0 110.697 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.14 19.24 19.93 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 120.948 -1.095 . . . . 0.0 111.942 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 53.35 41.47 62.7 Favored Glycine 0 N--CA 1.5 2.903 0 O-C-N 120.612 -1.305 . . . . 0.0 110.593 179.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.7 t -131.54 -163.49 1.33 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.091 -1.241 . . . . 0.0 109.969 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -142.1 140.78 32.61 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.131 -0.981 . . . . 0.0 110.494 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.663 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.4 p -131.87 161.2 41.69 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.186 -0.946 . . . . 0.0 109.886 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 33.2 t -167.59 83.25 0.21 Allowed 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.175 -0.953 . . . . 0.0 111.48 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.815 ' CG ' HD12 ' A' ' 121' ' ' ILE . 36.5 t80 -93.56 162.1 14.09 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.187 -0.946 . . . . 0.0 109.943 179.501 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -139.07 -59.51 0.59 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.417 -0.802 . . . . 0.0 109.379 179.129 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.82 152.14 51.51 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.324 -0.86 . . . . 0.0 109.384 179.179 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . 0.408 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 25.1 p -97.19 156.89 16.21 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.21 -0.931 . . . . 0.0 110.894 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 12.9 p -77.83 -22.18 13.84 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.509 0 O-C-N 121.337 -0.852 . . . . 0.0 111.872 -179.472 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -50.96 -57.88 7.44 Favored 'General case' 0 N--CA 1.516 2.839 0 O-C-N 120.834 -1.166 . . . . 0.0 109.9 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.505 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 23.8 p -128.78 -163.43 1.29 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.303 -0.873 . . . . 0.0 110.279 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.41 65.22 0.57 Allowed Glycine 0 N--CA 1.493 2.435 0 N-CA-C 108.036 -2.026 . . . . 0.0 108.036 178.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 37.3 t -104.59 147.36 27.71 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.31 -1.111 . . . . 0.0 110.297 -178.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 28.7 mtt85 -102.79 42.94 1.11 Allowed 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.327 -0.858 . . . . 0.0 109.482 179.237 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 77.06 96.72 0.19 Allowed Glycine 0 N--CA 1.487 2.08 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 22.7 p -111.53 128.42 56.02 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.23 -1.159 . . . . 0.0 110.554 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . 0.661 ' HB1' ' HD3' ' A' ' 125' ' ' PRO . . . -154.83 145.86 22.68 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.162 -0.962 . . . . 0.0 110.474 -179.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -119.21 -57.61 1.99 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.199 -0.938 . . . . 0.0 110.349 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -151.24 39.25 0.66 Allowed 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.195 -0.941 . . . . 0.0 110.588 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 . . . . . 0 N--CA 1.494 1.773 0 O-C-N 121.129 -0.982 . . . . 0.0 110.169 -179.958 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.361 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -117.34 75.02 0.28 Allowed Glycine 0 N--CA 1.493 2.494 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.3 p -136.45 94.59 13.51 Favored Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.114 -1.227 . . . . 0.0 110.198 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.32 123.4 9.14 Favored 'Trans proline' 0 C--N 1.317 -1.116 0 O-C-N 123.426 1.224 . . . . 0.0 110.467 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.2 ptt-85 -137.61 64.21 1.53 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.206 -0.934 . . . . 0.0 110.187 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 8.0 tt -132.88 149.32 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.077 -1.014 . . . . 0.0 110.279 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.2 tttt -137.3 151.96 49.23 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.206 -0.934 . . . . 0.0 110.28 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 26.5 m -128.69 135.08 48.76 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.18 -0.95 . . . . 0.0 110.246 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 19.5 mtt85 -120.49 118.3 29.9 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.191 -0.943 . . . . 0.0 110.184 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.06 -60.42 0.68 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.264 -0.898 . . . . 0.0 110.322 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.1 t -164.2 167.23 20.29 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.119 -0.988 . . . . 0.0 110.953 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.74 98.78 24.01 Favored Pre-proline 0 N--CA 1.494 1.774 0 O-C-N 121.182 -0.949 . . . . 0.0 110.077 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -71.55 158.13 54.51 Favored 'Trans proline' 0 C--N 1.316 -1.154 0 O-C-N 123.45 1.237 . . . . 0.0 110.847 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.676 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -65.89 145.78 99.01 Favored Pre-proline 0 N--CA 1.51 2.539 0 O-C-N 121.406 -0.809 . . . . 0.0 109.615 179.742 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.405 ' HG2' HD13 ' A' ' 77' ' ' LEU . 45.2 Cg_endo -70.6 162.26 43.13 Favored 'Trans proline' 0 N--CA 1.487 1.13 0 O-C-N 123.335 1.177 . . . . 0.0 110.772 -179.744 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -48.53 -32.03 7.36 Favored 'General case' 0 N--CA 1.514 2.772 0 O-C-N 121.443 -0.786 . . . . 0.0 111.402 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.12 -34.0 38.74 Favored Glycine 0 N--CA 1.499 2.867 0 O-C-N 120.938 -1.101 . . . . 0.0 110.641 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.434 ' CE2' ' HG2' ' A' ' 20' ' ' LYS . 27.2 t80 -55.19 -32.4 62.17 Favored 'General case' 0 N--CA 1.511 2.585 0 O-C-N 120.882 -1.363 . . . . 0.0 110.795 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -53.15 -37.84 62.21 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 120.975 -1.078 . . . . 0.0 110.276 179.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.5 mmtt -59.56 -36.48 76.27 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.579 -0.848 . . . . 0.0 110.213 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.879 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.2 pt -120.79 35.6 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.175 -0.953 . . . . 0.0 110.602 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.434 ' HG2' ' CE2' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -85.22 -43.11 0.66 Allowed Pre-proline 0 N--CA 1.509 2.522 0 O-C-N 121.052 -1.03 . . . . 0.0 113.561 -178.892 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.1 Cg_endo -75.37 -35.86 2.66 Favored 'Trans proline' 0 N--CA 1.486 1.051 0 O-C-N 122.521 0.748 . . . . 0.0 112.007 -177.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.597 HG21 ' CE2' ' A' ' 62' ' ' TYR . 79.5 m -61.83 -46.38 89.75 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 120.982 -1.074 . . . . 0.0 109.945 -179.717 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.879 HD12 ' O ' ' A' ' 19' ' ' ILE . 5.0 mt -60.8 -37.2 81.13 Favored 'General case' 0 N--CA 1.507 2.397 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.812 179.512 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 72.6 m -57.22 -36.45 70.91 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 121.066 -1.021 . . . . 0.0 110.22 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -57.4 -38.82 74.93 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.06 -1.025 . . . . 0.0 110.081 179.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.641 ' CD2' HD22 ' A' ' 55' ' ' LEU . 15.0 m-85 -58.24 -40.03 80.67 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.094 -1.004 . . . . 0.0 110.131 179.697 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -59.18 -24.45 63.09 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.247 -0.908 . . . . 0.0 111.406 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.489 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.8 mp -77.96 -36.22 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.459 0 O-C-N 120.877 -1.14 . . . . 0.0 109.851 179.826 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.583 ' OE1' HD21 ' A' ' 55' ' ' LEU . 44.1 tt0 -80.73 -37.18 30.99 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.006 -1.058 . . . . 0.0 109.311 178.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.724 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -73.74 -31.84 63.55 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.134 -0.979 . . . . 0.0 110.164 179.023 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.401 ' CD ' ' HA ' ' A' ' 28' ' ' ILE . 6.0 ptm85 -71.3 -36.74 71.75 Favored 'General case' 0 N--CA 1.505 2.302 0 C-N-CA 118.738 -1.185 . . . . 0.0 109.724 179.257 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.42 -41.4 98.71 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.069 -1.052 . . . . 0.0 109.168 179.107 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.606 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -68.62 -43.13 77.04 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.221 -0.925 . . . . 0.0 109.05 179.053 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.84 -38.36 85.22 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.312 -0.868 . . . . 0.0 109.604 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -57.7 -34.49 69.5 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 121.125 -0.984 . . . . 0.0 110.467 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -55.8 -36.88 67.89 Favored 'General case' 0 N--CA 1.511 2.608 0 O-C-N 121.078 -1.014 . . . . 0.0 110.335 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -55.27 -39.29 69.64 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 121.059 -1.025 . . . . 0.0 110.369 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 60.1 p -115.24 39.74 2.85 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.209 -0.932 . . . . 0.0 110.2 179.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.1 p -168.38 106.74 0.48 Allowed 'General case' 0 N--CA 1.502 2.125 0 O-C-N 121.246 -0.909 . . . . 0.0 110.664 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.6 tptp 53.66 94.55 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.022 -1.049 . . . . 0.0 110.305 -179.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -130.69 65.62 1.54 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.193 -0.942 . . . . 0.0 110.407 -179.697 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -112.22 -55.05 2.56 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.063 -1.023 . . . . 0.0 110.106 179.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -122.84 159.43 28.16 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.212 -0.93 . . . . 0.0 110.164 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.2 ttpp 52.87 59.65 4.32 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 121.0 -1.063 . . . . 0.0 110.777 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 68.4 m -113.5 -54.81 2.58 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.192 -0.942 . . . . 0.0 110.392 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -55.54 -37.88 68.54 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.202 -0.936 . . . . 0.0 110.092 179.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -60.32 -39.73 88.07 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.269 -0.894 . . . . 0.0 109.998 179.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.4 tp60 -61.73 -40.9 96.73 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.157 -0.964 . . . . 0.0 109.819 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.477 HD23 HD12 ' A' ' 52' ' ' ILE . 16.9 mt -61.12 -37.86 84.31 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.243 -0.911 . . . . 0.0 110.146 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 49.3 m0 -58.8 -37.75 77.05 Favored 'General case' 0 N--CA 1.511 2.596 0 O-C-N 121.146 -0.971 . . . . 0.0 110.086 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -61.81 -31.02 71.22 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.038 -1.039 . . . . 0.0 109.83 178.614 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.724 HG23 ' CG ' ' A' ' 30' ' ' LEU . 79.3 mt -71.81 -59.25 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.272 0 O-C-N 121.078 -1.014 . . . . 0.0 109.047 179.238 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -60.86 -29.45 69.54 Favored 'General case' 0 N--CA 1.509 2.523 0 C-N-CA 118.626 -1.23 . . . . 0.0 109.948 178.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -70.15 -37.82 75.33 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 120.808 -1.182 . . . . 0.0 109.136 178.277 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.641 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.7 mt -54.35 -33.02 58.16 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.146 -0.971 . . . . 0.0 110.296 179.109 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.454 ' NE2' ' N ' ' A' ' 88' ' ' ASP . 5.5 t60 -55.67 -37.33 68.14 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 120.993 -1.067 . . . . 0.0 110.205 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.446 ' NE2' HD21 ' A' ' 91' ' ' LEU . 6.0 m170 -61.48 -49.81 75.28 Favored 'General case' 0 N--CA 1.507 2.412 0 C-N-CA 119.254 -0.978 . . . . 0.0 109.332 179.231 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -60.33 -38.51 83.97 Favored 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 119.346 -0.942 . . . . 0.0 109.074 178.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.449 ' CD ' ' CD2' ' A' ' 26' ' ' PHE . 9.3 mtp180 -64.42 -51.49 62.89 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.256 -0.902 . . . . 0.0 109.315 178.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.0 p -60.75 -37.5 82.02 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.198 -0.939 . . . . 0.0 109.61 179.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -64.78 -39.76 94.14 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.058 -1.026 . . . . 0.0 109.442 179.17 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.597 ' CE2' HG21 ' A' ' 22' ' ' THR . 26.6 t80 -61.58 -49.19 77.66 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.124 -0.985 . . . . 0.0 109.487 179.491 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.453 ' CG2' ' CD1' ' A' ' 78' ' ' TYR . 74.3 mt -73.34 -41.64 57.34 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.381 0 O-C-N 121.232 -0.918 . . . . 0.0 109.0 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.4 ' O ' ' HB2' ' A' ' 68' ' ' TYR . 66.3 t80 -62.64 -40.44 97.0 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.309 -0.869 . . . . 0.0 109.386 179.303 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 86.7 m -66.53 -40.83 89.32 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.997 -1.064 . . . . 0.0 110.477 -179.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.553 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.2 -32.76 26.37 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 120.922 -1.111 . . . . 0.0 112.643 -178.76 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.491 ' N ' HD12 ' A' ' 66' ' ' LEU . 35.3 t80 -86.28 -32.45 21.08 Favored 'General case' 0 N--CA 1.513 2.697 0 O-C-N 120.635 -1.291 . . . . 0.0 111.953 -178.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.4 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 10.3 m-85 -97.98 -18.19 18.76 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.632 -1.293 . . . . 0.0 112.674 -178.694 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.1 mttm -118.64 -58.92 1.92 Allowed 'General case' 0 N--CA 1.503 2.187 0 O-C-N 120.574 -1.329 . . . . 0.0 110.676 179.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.404 ' HB3' ' HA ' ' A' ' 66' ' ' LEU . 1.1 tpt180 -67.63 -29.25 68.51 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.204 -0.935 . . . . 0.0 110.984 -179.578 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.7 mttt 56.45 42.92 26.83 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 120.858 -1.151 . . . . 0.0 109.971 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.45 34.68 3.8 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.482 -0.761 . . . . 0.0 109.851 179.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.673 HG13 HD23 ' A' ' 77' ' ' LEU . 13.8 tt -152.52 162.6 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.197 -0.94 . . . . 0.0 109.753 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.0 m -108.36 144.81 35.41 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.106 -0.996 . . . . 0.0 110.434 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.4 tttp -45.9 -32.28 2.59 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.302 -0.874 . . . . 0.0 111.636 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.63 -49.67 75.65 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 120.861 -1.149 . . . . 0.0 109.312 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.673 HD23 HG13 ' A' ' 73' ' ' ILE . 37.0 tp -68.24 -44.54 75.45 Favored 'General case' 0 N--CA 1.506 2.348 0 C-N-CA 119.148 -1.021 . . . . 0.0 108.294 178.737 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.453 ' CD1' ' CG2' ' A' ' 63' ' ' ILE . 13.4 t80 -59.78 -37.51 79.28 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.369 -0.832 . . . . 0.0 109.471 179.091 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -71.33 -41.58 69.64 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 120.981 -1.074 . . . . 0.0 108.919 178.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.676 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 63.3 t90 -57.11 -39.59 75.38 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.172 -0.955 . . . . 0.0 109.512 179.095 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.49 HD23 ' CD2' ' A' ' 86' ' ' TYR . 3.7 mp -65.92 -50.85 62.96 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.222 -0.924 . . . . 0.0 109.183 179.127 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.9 mm -56.42 -34.62 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.658 0 O-C-N 121.121 -0.987 . . . . 0.0 110.02 179.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.7 mmtt -89.44 -5.8 57.06 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 120.947 -1.095 . . . . 0.0 112.526 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.436 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 45.9 mm-40 -114.99 24.16 11.95 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 120.447 -1.408 . . . . 0.0 112.05 -179.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.5 tttt 75.45 71.18 0.09 Allowed 'General case' 0 N--CA 1.512 2.657 0 O-C-N 121.159 -0.963 . . . . 0.0 111.724 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.586 ' HE2' HD13 ' A' ' 23' ' ' LEU . 27.2 m-85 -131.56 -62.48 0.87 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.468 -0.77 . . . . 0.0 109.255 179.29 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.443 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -136.49 175.92 9.17 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.49 -0.756 . . . . 0.0 109.528 179.438 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.454 ' N ' ' NE2' ' A' ' 56' ' ' HIS . 13.4 t0 -114.79 108.85 17.31 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.186 -0.946 . . . . 0.0 110.417 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 11.2 mtpp -59.02 -40.32 84.64 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.153 -0.967 . . . . 0.0 109.732 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.731 HD23 HD13 ' A' ' 106' ' ' LEU . 16.0 tp -60.08 -37.84 81.1 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.202 -0.936 . . . . 0.0 109.946 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.446 HD21 ' NE2' ' A' ' 57' ' ' HIS . 64.5 tp -68.82 -50.02 53.61 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.013 -1.054 . . . . 0.0 108.808 179.336 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 50.0 mt -57.85 -36.62 56.29 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.511 0 O-C-N 121.179 -0.951 . . . . 0.0 108.803 178.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.31 -39.7 89.47 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.178 -0.951 . . . . 0.0 109.244 178.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.453 ' HD2' ' CE2' ' A' ' 100' ' ' TYR . 7.0 mmtt -57.8 -46.1 85.13 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.088 -1.008 . . . . 0.0 109.395 179.313 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.1 m0 -58.24 -25.67 61.99 Favored 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 119.186 -1.006 . . . . 0.0 110.484 179.375 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.7 24.46 12.88 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 120.927 -1.108 . . . . 0.0 111.461 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.6 mmtt -92.52 -83.44 0.3 Allowed 'General case' 0 N--CA 1.505 2.284 0 O-C-N 120.694 -1.254 . . . . 0.0 109.897 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.439 HG23 ' O ' ' A' ' 98' ' ' THR . 5.9 t -177.52 128.88 0.15 Allowed 'General case' 0 N--CA 1.506 2.358 0 O-C-N 120.843 -1.161 . . . . 0.0 110.764 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.21 11.81 79.48 Favored Glycine 0 N--CA 1.492 2.376 0 C-N-CA 120.131 -1.033 . . . . 0.0 111.551 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.453 ' CE2' ' HD2' ' A' ' 94' ' ' LYS . 20.0 m-85 -100.5 46.88 0.94 Allowed 'General case' 0 N--CA 1.504 2.261 0 CA-C-N 119.746 1.773 . . . . 0.0 110.239 179.389 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -62.93 -39.96 96.19 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.163 -0.961 . . . . 0.0 109.539 179.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.421 ' HB2' ' OG ' ' A' ' 155' ' ' SER . 1.0 OUTLIER -111.94 100.45 8.9 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.215 -0.928 . . . . 0.0 109.684 179.358 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.925 HD13 HD13 ' A' ' 109' ' ' ILE . 9.6 tp -137.41 132.63 33.73 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.226 -0.921 . . . . 0.0 109.925 -179.385 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.442 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.0 p -109.5 -37.53 5.69 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.286 -0.883 . . . . 0.0 112.197 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.801 ' O ' HD11 ' A' ' 103' ' ' LEU . 7.4 m -140.57 -168.03 2.48 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 120.355 -1.466 . . . . 0.0 110.001 179.018 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.731 HD13 HD23 ' A' ' 90' ' ' LEU . 12.5 mt -97.41 -38.38 9.64 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.007 -1.058 . . . . 0.0 110.489 179.277 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 26.8 ttt85 -102.21 31.64 3.88 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 120.995 -1.066 . . . . 0.0 109.614 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.66 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.305 1.7 t -126.94 15.47 7.4 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.193 -0.942 . . . . 0.0 109.003 -179.279 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.925 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -158.59 36.87 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.361 0 O-C-N 120.799 -1.188 . . . . 0.0 110.844 -178.646 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.592 ' O ' HG23 ' A' ' 119' ' ' THR . 89.3 mt-30 -122.26 137.44 54.84 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 120.735 -1.228 . . . . 0.0 111.563 -178.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.536 ' HA ' ' HG1' ' A' ' 119' ' ' THR . 15.7 ptpt -130.24 154.81 47.2 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.166 -0.959 . . . . 0.0 110.392 179.494 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -158.59 -56.54 0.07 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.209 -0.932 . . . . 0.0 110.801 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -131.23 -165.47 1.57 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.231 -0.918 . . . . 0.0 110.159 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.58 53.48 1.99 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.133 -0.979 . . . . 0.0 110.233 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -115.41 -54.92 2.5 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.116 -0.99 . . . . 0.0 110.458 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 15.5 p-10 -125.79 -169.93 2.09 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.104 -0.998 . . . . 0.0 110.339 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -58.69 108.86 1.7 Allowed Glycine 0 N--CA 1.495 2.622 0 N-CA-C 109.915 -1.274 . . . . 0.0 109.915 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 4.0 m -115.38 -55.74 2.42 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.279 -1.13 . . . . 0.0 110.536 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.592 HG23 ' O ' ' A' ' 110' ' ' GLN . 0.7 OUTLIER -111.47 174.23 5.97 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.192 -0.942 . . . . 0.0 110.353 -179.92 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.401 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 44.4 t -105.02 155.26 19.13 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.409 -0.807 . . . . 0.0 109.575 179.394 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.802 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -70.47 -36.28 65.63 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 121.151 -0.968 . . . . 0.0 110.872 -179.374 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.455 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.9 p -54.83 -32.49 60.53 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 120.809 -1.182 . . . . 0.0 110.932 -179.153 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.465 ' HG3' HG22 ' A' ' 109' ' ' ILE . 0.0 OUTLIER -61.26 -34.87 75.87 Favored 'General case' 0 N--CA 1.509 2.525 0 O-C-N 120.986 -1.071 . . . . 0.0 109.415 178.047 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 48.4 t -79.84 126.0 81.0 Favored Pre-proline 0 N--CA 1.504 2.267 0 O-C-N 121.109 -0.994 . . . . 0.0 109.707 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.477 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.7 Cg_endo -65.65 172.3 8.3 Favored 'Trans proline' 0 N--CA 1.489 1.255 0 O-C-N 123.159 1.083 . . . . 0.0 110.795 179.676 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.1 -37.55 61.47 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.287 -0.883 . . . . 0.0 110.548 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.68 -41.0 80.71 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.071 -1.018 . . . . 0.0 110.044 -179.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -69.48 -41.58 75.98 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.175 -0.953 . . . . 0.0 109.187 179.248 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.531 ' CD1' HD11 ' A' ' 121' ' ' ILE . 1.9 mt -65.86 -39.26 90.56 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.258 -0.901 . . . . 0.0 109.455 179.088 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -60.93 -39.69 90.42 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.199 -0.938 . . . . 0.0 109.829 179.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -59.62 -38.14 80.51 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.208 -0.933 . . . . 0.0 110.188 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -61.16 -44.61 97.04 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.209 -0.932 . . . . 0.0 109.929 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.27 -41.53 93.49 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.103 -0.998 . . . . 0.0 109.961 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.57 -35.37 72.26 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.187 -0.946 . . . . 0.0 110.322 179.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 21.3 mttm -71.74 -32.55 67.86 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.088 -1.007 . . . . 0.0 110.94 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 33.8 mttm -98.26 19.35 14.41 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.923 -1.111 . . . . 0.0 111.829 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 54.56 43.59 78.28 Favored Glycine 0 N--CA 1.498 2.825 0 O-C-N 120.591 -1.318 . . . . 0.0 110.502 179.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 7.3 t -142.88 -164.78 1.91 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.127 -1.219 . . . . 0.0 110.088 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.5 mp0 -138.25 149.57 45.87 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.193 -0.942 . . . . 0.0 110.407 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.429 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.5 p -131.86 161.49 41.19 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.165 -0.96 . . . . 0.0 109.949 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 29.1 t -165.79 88.88 0.41 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.164 -0.96 . . . . 0.0 111.167 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.766 ' CG ' HD12 ' A' ' 121' ' ' ILE . 47.1 t80 -97.58 159.9 14.65 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.317 -0.864 . . . . 0.0 110.239 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 53.4 m-70 -137.11 -61.6 0.65 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.482 -0.761 . . . . 0.0 109.001 179.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -133.63 151.96 51.79 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.41 -0.806 . . . . 0.0 108.912 178.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 31.2 p -92.92 153.19 18.93 Favored 'General case' 0 N--CA 1.504 2.243 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.179 -179.462 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 27.0 m -71.64 -25.94 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 O-C-N 121.396 -0.815 . . . . 0.0 111.387 -179.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -50.65 -55.42 16.49 Favored 'General case' 0 N--CA 1.515 2.779 0 O-C-N 120.764 -1.21 . . . . 0.0 110.079 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 25.5 p -130.96 -165.64 1.59 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.276 -0.89 . . . . 0.0 110.566 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.77 56.61 0.76 Allowed Glycine 0 N--CA 1.493 2.457 0 N-CA-C 107.961 -2.056 . . . . 0.0 107.961 178.438 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 17.7 t -99.99 142.25 31.72 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.374 -1.074 . . . . 0.0 109.85 -179.225 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 5.2 mtt-85 -95.46 53.69 1.51 Allowed 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.301 -0.874 . . . . 0.0 109.593 179.27 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 64.5 96.68 0.02 OUTLIER Glycine 0 N--CA 1.487 2.087 0 N-CA-C 109.915 -1.274 . . . . 0.0 109.915 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 26.2 p -106.3 124.8 50.15 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.311 -1.111 . . . . 0.0 110.048 179.437 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -134.59 135.31 42.12 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.131 -0.981 . . . . 0.0 110.1 -179.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . 0.561 ' O ' HG23 ' A' ' 156' ' ' THR . 0.7 OUTLIER -104.31 41.43 1.31 Allowed 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.231 -0.918 . . . . 0.0 109.855 179.647 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . 0.561 HG23 ' O ' ' A' ' 155' ' ' SER . 0.8 OUTLIER -156.26 -56.73 0.09 Allowed 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.331 -0.855 . . . . 0.0 110.656 -179.868 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 . . . . . 0 N--CA 1.494 1.732 0 CA-C-O 118.033 -0.984 . . . . 0.0 110.254 179.865 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.333 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 95.1 -131.57 10.75 Favored Glycine 0 N--CA 1.493 2.46 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 -179.996 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.23 90.27 50.96 Favored Pre-proline 0 N--CA 1.493 1.721 0 O-C-N 121.292 -1.122 . . . . 0.0 110.214 -179.981 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.98 123.31 8.8 Favored 'Trans proline' 0 C--N 1.317 -1.109 0 O-C-N 123.493 1.26 . . . . 0.0 110.432 -179.92 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 18.9 mtm180 -120.18 109.72 15.76 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.183 -0.948 . . . . 0.0 110.205 -179.985 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 82.0 mt -127.67 134.61 65.13 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 O-C-N 121.192 -0.942 . . . . 0.0 109.945 -179.901 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 30.7 tptt -143.6 50.2 1.38 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.284 -0.885 . . . . 0.0 110.27 179.983 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -129.09 111.43 12.95 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.221 -0.924 . . . . 0.0 110.232 -179.973 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -122.47 103.9 9.02 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.172 -0.955 . . . . 0.0 110.169 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 48.2 mtm180 -127.62 84.36 2.25 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.16 -0.963 . . . . 0.0 110.225 -179.967 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.8 t -143.2 46.04 1.54 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.191 -0.943 . . . . 0.0 110.325 179.888 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.7 mmtt -127.49 93.07 41.57 Favored Pre-proline 0 N--CA 1.494 1.742 0 O-C-N 121.201 -0.937 . . . . 0.0 110.218 -179.973 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -73.85 158.59 46.34 Favored 'Trans proline' 0 C--N 1.317 -1.09 0 O-C-N 123.399 1.21 . . . . 0.0 110.668 179.948 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.691 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -94.19 146.63 31.94 Favored Pre-proline 0 N--CA 1.502 2.147 0 O-C-N 121.404 -0.81 . . . . 0.0 109.738 179.542 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.31 162.01 43.84 Favored 'Trans proline' 0 C--N 1.317 -1.109 0 O-C-N 123.335 1.176 . . . . 0.0 110.833 -179.421 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -48.79 -31.92 7.82 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.476 -0.765 . . . . 0.0 111.358 -179.828 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.5 -34.95 43.5 Favored Glycine 0 N--CA 1.498 2.825 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 179.776 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -55.95 -33.45 64.76 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 121.057 -1.261 . . . . 0.0 110.656 179.814 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -53.9 -37.94 64.29 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.085 -1.01 . . . . 0.0 110.149 179.693 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 44.1 mmtt -59.55 -37.38 78.26 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.268 -0.895 . . . . 0.0 110.045 179.504 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.738 HG22 ' OH ' ' A' ' 62' ' ' TYR . 2.1 pt -116.37 35.29 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.182 -0.949 . . . . 0.0 110.552 179.814 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.423 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 4.5 tttt -84.38 -42.89 0.73 Allowed Pre-proline 0 N--CA 1.509 2.491 0 O-C-N 121.136 -0.977 . . . . 0.0 113.334 -179.163 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.0 Cg_endo -75.44 -35.17 2.99 Favored 'Trans proline' 0 N--CA 1.486 1.073 0 O-C-N 122.467 0.72 . . . . 0.0 111.805 -178.138 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.547 HG21 ' CE2' ' A' ' 62' ' ' TYR . 85.4 m -61.62 -46.79 88.32 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 120.932 -1.105 . . . . 0.0 109.896 -179.875 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.714 HD13 ' HE2' ' A' ' 86' ' ' TYR . 6.1 mt -62.58 -39.61 94.24 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 119.4 -0.92 . . . . 0.0 109.605 179.446 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.7 m -57.62 -35.69 70.81 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 121.123 -0.985 . . . . 0.0 110.256 179.524 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -57.6 -36.42 71.72 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 121.089 -1.007 . . . . 0.0 110.287 179.756 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.717 ' CD2' HD22 ' A' ' 55' ' ' LEU . 16.7 m-85 -57.42 -39.98 77.34 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.062 -1.024 . . . . 0.0 110.323 179.994 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -60.38 -23.28 64.19 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.224 -0.922 . . . . 0.0 111.514 -179.668 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.538 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.8 mp -81.18 -34.2 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.347 0 O-C-N 120.776 -1.202 . . . . 0.0 109.738 179.655 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.6 tp60 -80.96 -36.32 31.02 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.948 -1.095 . . . . 0.0 109.453 178.752 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.726 ' CD2' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -75.12 -31.83 61.23 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.131 -0.981 . . . . 0.0 109.96 178.913 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -70.17 -36.15 74.48 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 120.865 -1.147 . . . . 0.0 109.745 179.196 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.33 -41.85 93.54 Favored 'General case' 0 N--CA 1.507 2.387 0 C-N-CA 119.145 -1.022 . . . . 0.0 109.329 179.407 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.59 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -69.06 -42.16 76.63 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.301 -0.874 . . . . 0.0 109.53 179.323 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -68.67 -30.89 69.67 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.344 -0.847 . . . . 0.0 110.435 179.575 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.1 mtpt -92.07 -31.46 15.54 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 120.99 -1.068 . . . . 0.0 111.088 -179.971 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -55.53 -37.07 67.46 Favored 'General case' 0 N--CA 1.513 2.692 0 O-C-N 120.838 -1.164 . . . . 0.0 110.309 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.5 ttpt -65.34 -38.38 89.93 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.102 -0.999 . . . . 0.0 110.175 179.938 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.1 t -115.36 52.75 0.86 Allowed 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.075 -1.015 . . . . 0.0 110.418 -179.934 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.5 t -157.45 -56.77 0.08 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.147 -0.97 . . . . 0.0 110.739 179.973 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 31.5 mttp -96.15 -34.37 11.71 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.283 -0.886 . . . . 0.0 110.755 179.967 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 55.83 82.71 0.1 Allowed 'General case' 0 N--CA 1.502 2.131 0 O-C-N 120.82 -1.175 . . . . 0.0 110.419 -179.819 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -137.96 -162.63 1.33 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.274 -0.891 . . . . 0.0 109.94 -179.954 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -85.13 179.29 7.28 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.056 -1.028 . . . . 0.0 109.891 179.614 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 64.3 mttt 53.16 60.5 3.72 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.005 -1.059 . . . . 0.0 110.571 -179.767 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.85 -42.9 6.61 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.069 -1.019 . . . . 0.0 110.693 -179.907 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -58.0 -39.32 77.98 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 121.077 -1.014 . . . . 0.0 110.115 -179.935 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -59.68 -40.02 86.47 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.158 -0.964 . . . . 0.0 110.128 179.943 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 51.3 tp60 -59.5 -39.56 84.2 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.063 -1.023 . . . . 0.0 110.186 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 49' ' ' LEU . 12.5 mt -59.62 -39.66 85.01 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.137 -0.977 . . . . 0.0 110.181 -179.923 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.498 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.3 m0 -59.14 -37.19 76.68 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.186 -0.947 . . . . 0.0 110.164 179.827 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -59.94 -30.95 69.42 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.015 -1.053 . . . . 0.0 110.139 179.119 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.726 HG23 ' CD2' ' A' ' 30' ' ' LEU . 77.6 mt -71.28 -58.4 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.286 0 O-C-N 120.989 -1.069 . . . . 0.0 109.102 179.355 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.1 ptm -62.84 -29.94 71.12 Favored 'General case' 0 N--CA 1.507 2.408 0 C-N-CA 118.646 -1.221 . . . . 0.0 109.883 178.851 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.6 mm100 -69.43 -36.82 77.05 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.867 -1.146 . . . . 0.0 109.157 178.117 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.717 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.4 mt -53.24 -32.16 46.93 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.018 -1.052 . . . . 0.0 110.196 179.032 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.459 ' NE2' ' CB ' ' A' ' 88' ' ' ASP . 41.2 t60 -54.6 -39.76 68.18 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.09 -1.006 . . . . 0.0 110.07 179.859 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.428 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 4.9 m170 -62.41 -49.15 76.63 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.668 179.213 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -59.22 -36.23 75.05 Favored 'General case' 0 N--CA 1.508 2.438 0 C-N-CA 119.355 -0.938 . . . . 0.0 109.523 179.154 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.453 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -68.71 -52.09 34.58 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.085 -1.009 . . . . 0.0 108.761 178.769 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 91.7 p -61.21 -38.57 87.05 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.268 -0.895 . . . . 0.0 109.263 178.862 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 57.6 ttp85 -64.05 -38.49 91.26 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.094 -1.004 . . . . 0.0 109.456 179.028 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.738 ' OH ' HG22 ' A' ' 19' ' ' ILE . 48.1 t80 -60.31 -47.2 87.03 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.083 -1.011 . . . . 0.0 109.617 179.565 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.606 HD12 ' HB2' ' A' ' 87' ' ' ALA . 82.8 mt -77.77 -42.47 28.93 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.365 0 O-C-N 121.242 -0.911 . . . . 0.0 109.098 179.16 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.506 ' CE1' HG23 ' A' ' 92' ' ' ILE . 18.7 t80 -61.35 -23.37 65.7 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.354 -0.841 . . . . 0.0 110.659 179.01 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 97.2 m -91.02 -38.78 12.59 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.643 -1.286 . . . . 0.0 110.198 179.831 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.517 ' C ' HD12 ' A' ' 66' ' ' LEU . 3.5 pp -83.04 -30.28 28.19 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.893 -1.13 . . . . 0.0 111.924 -179.429 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.464 ' HD2' HG23 ' A' ' 73' ' ' ILE . 39.9 t80 -86.25 -35.96 19.68 Favored 'General case' 0 N--CA 1.511 2.591 0 O-C-N 120.573 -1.329 . . . . 0.0 111.467 -179.81 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.419 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 15.1 m-85 -94.08 -29.88 14.96 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.828 -1.17 . . . . 0.0 112.422 -178.158 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.8 mtpp -105.52 -59.46 1.76 Allowed 'General case' 0 N--CA 1.504 2.268 0 O-C-N 120.684 -1.26 . . . . 0.0 110.42 -179.81 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.407 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 29.9 ttt85 -57.13 -33.27 67.21 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 121.109 -0.994 . . . . 0.0 110.366 -179.996 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.6 mttt 57.47 45.84 18.99 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.887 -1.133 . . . . 0.0 110.328 179.965 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -111.11 -57.17 2.28 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.372 -0.83 . . . . 0.0 109.38 179.289 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.786 HG13 HD23 ' A' ' 77' ' ' LEU . 15.1 tt -56.17 162.21 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.574 0 O-C-N 121.443 -0.786 . . . . 0.0 110.121 179.533 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.8 t -111.62 149.76 31.06 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.07 -1.019 . . . . 0.0 109.921 179.106 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.39 -32.71 1.42 Allowed 'General case' 0 N--CA 1.517 2.902 0 O-C-N 121.282 -0.886 . . . . 0.0 111.984 -179.709 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -61.68 -50.94 70.48 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 120.941 -1.099 . . . . 0.0 109.36 179.635 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.786 HD23 HG13 ' A' ' 73' ' ' ILE . 52.1 tp -67.96 -42.88 80.22 Favored 'General case' 0 N--CA 1.506 2.345 0 C-N-CA 119.139 -1.024 . . . . 0.0 108.466 178.727 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.709 ' HA ' HD12 ' A' ' 81' ' ' LEU . 21.8 t80 -60.1 -38.54 83.28 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.324 -0.86 . . . . 0.0 109.479 178.869 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -70.58 -42.67 70.74 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.067 -1.021 . . . . 0.0 108.73 178.745 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.691 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 72.0 t90 -59.03 -38.41 79.24 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.262 -0.899 . . . . 0.0 109.545 178.926 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.709 HD12 ' HA ' ' A' ' 78' ' ' TYR . 11.8 mt -64.86 -51.27 62.95 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.167 -0.958 . . . . 0.0 109.519 179.365 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.4 mm -57.75 -33.13 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.592 0 O-C-N 121.169 -0.957 . . . . 0.0 110.102 179.645 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -89.23 -9.03 52.27 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 120.898 -1.126 . . . . 0.0 112.437 -179.862 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.438 ' HB2' ' CE1' ' A' ' 86' ' ' TYR . 4.3 mm-40 -111.16 22.11 15.6 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 120.449 -1.407 . . . . 0.0 111.974 -179.984 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.4 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 0.0 OUTLIER 74.94 73.58 0.1 Allowed 'General case' 0 N--CA 1.51 2.562 0 O-C-N 121.031 -1.043 . . . . 0.0 111.66 179.451 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.714 ' HE2' HD13 ' A' ' 23' ' ' LEU . 32.6 m-85 -134.2 -62.8 0.74 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.557 -0.715 . . . . 0.0 109.215 179.456 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.606 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -131.16 163.04 28.59 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.478 -0.764 . . . . 0.0 109.248 179.313 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.459 ' CB ' ' NE2' ' A' ' 56' ' ' HIS . 30.7 t0 -111.27 118.27 35.43 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.084 -1.01 . . . . 0.0 110.314 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -57.67 -35.76 71.02 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 121.34 -0.85 . . . . 0.0 110.194 179.72 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.423 HD12 ' HA ' ' A' ' 90' ' ' LEU . 7.9 tp -60.68 -38.51 85.19 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.121 -0.987 . . . . 0.0 109.684 179.481 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.691 HD12 ' CZ3' ' A' ' 95' ' ' TRP . 0.3 OUTLIER -66.56 -56.71 9.5 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.085 -1.009 . . . . 0.0 108.829 179.078 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.506 HG23 ' CE1' ' A' ' 64' ' ' TYR . 38.8 mt -61.0 -33.74 57.03 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.416 0 C-N-CA 119.339 -0.944 . . . . 0.0 109.165 178.851 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.24 -41.1 86.2 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 120.985 -1.072 . . . . 0.0 109.239 178.854 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.474 ' HB3' HD22 ' A' ' 103' ' ' LEU . 10.0 mmtm -57.62 -44.25 85.38 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.177 -0.952 . . . . 0.0 109.49 179.387 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.691 ' CZ3' HD12 ' A' ' 91' ' ' LEU . 2.3 m0 -59.05 -26.37 64.54 Favored 'General case' 0 N--CA 1.508 2.44 0 C-N-CA 119.148 -1.021 . . . . 0.0 110.786 179.165 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.18 -35.51 25.43 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 120.736 -1.227 . . . . 0.0 110.671 179.587 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -51.1 175.79 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.803 0 O-C-N 121.025 -1.047 . . . . 0.0 110.831 179.89 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 60.8 m -103.79 138.83 39.85 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.168 -0.957 . . . . 0.0 109.487 179.219 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 103.47 -29.15 12.87 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.84 -1.304 . . . . 0.0 109.84 -178.881 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -94.43 58.16 2.37 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.867 -1.372 . . . . 0.0 109.898 179.658 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -73.0 -38.76 66.49 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.026 -1.046 . . . . 0.0 109.864 179.717 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.01 73.86 1.05 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.157 -0.964 . . . . 0.0 110.143 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.474 HD22 ' HB3' ' A' ' 94' ' ' LYS . 1.1 pp -110.1 148.77 31.1 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.068 -1.02 . . . . 0.0 110.149 179.941 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.428 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.7 p -110.21 -30.08 7.89 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.238 -0.914 . . . . 0.0 112.997 -179.727 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.625 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 9.3 m -143.56 -168.13 2.75 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 120.256 -1.527 . . . . 0.0 109.884 179.159 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.425 HD23 ' HA ' ' A' ' 106' ' ' LEU . 44.4 mt -96.73 -38.14 10.02 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.088 -1.007 . . . . 0.0 110.066 178.986 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 18.0 ttp180 -102.45 30.56 4.53 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 120.972 -1.08 . . . . 0.0 109.826 178.051 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.625 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.304 1.8 t -128.65 18.43 6.27 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.11 -0.994 . . . . 0.0 108.97 -179.575 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.469 HG23 ' C ' ' A' ' 108' ' ' CYS . 1.7 pt -156.39 36.81 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.158 0 O-C-N 120.78 -1.2 . . . . 0.0 110.493 -178.631 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.503 ' C ' HG23 ' A' ' 119' ' ' THR . 9.5 tt0 -66.09 77.87 0.09 Allowed 'General case' 0 N--CA 1.51 2.554 0 O-C-N 120.995 -1.066 . . . . 0.0 110.788 -178.854 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -148.89 168.77 22.14 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.053 -1.029 . . . . 0.0 110.366 179.473 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -171.5 -61.03 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.181 -0.95 . . . . 0.0 110.804 179.922 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -168.1 44.33 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.223 -0.923 . . . . 0.0 110.968 -179.945 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 14.3 p -140.54 -175.15 4.17 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.27 -0.894 . . . . 0.0 110.227 -179.939 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 31.8 t-20 -128.73 92.36 3.4 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.195 -0.941 . . . . 0.0 110.25 179.997 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -137.79 -173.65 3.56 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.231 -0.918 . . . . 0.0 110.275 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -120.97 48.48 0.95 Allowed Glycine 0 N--CA 1.493 2.465 0 N-CA-C 109.633 -1.387 . . . . 0.0 109.633 -179.923 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 71.3 m -129.35 46.46 2.63 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.108 -1.231 . . . . 0.0 110.134 179.985 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.503 HG23 ' C ' ' A' ' 110' ' ' GLN . 7.1 m -139.88 165.52 27.09 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.233 -0.917 . . . . 0.0 109.996 -179.859 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 41.5 t -82.21 153.93 25.7 Favored 'General case' 0 N--CA 1.501 2.109 0 C-N-CA 119.321 -0.952 . . . . 0.0 108.802 178.766 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.71 HG23 ' CE1' ' A' ' 142' ' ' PHE . 14.1 tt -81.11 -29.33 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 O-C-N 121.047 -1.033 . . . . 0.0 112.448 -178.787 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.489 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 14.4 p -53.97 -35.14 61.47 Favored 'General case' 0 N--CA 1.512 2.647 0 O-C-N 120.707 -1.246 . . . . 0.0 110.658 -178.736 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -58.54 -26.85 63.98 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.118 -0.988 . . . . 0.0 109.836 177.707 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 48.9 t -73.89 118.24 67.74 Favored Pre-proline 0 N--CA 1.509 2.48 0 O-C-N 120.866 -1.146 . . . . 0.0 110.584 179.975 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.473 ' HB3' ' HB1' ' A' ' 154' ' ' ALA . 37.4 Cg_endo -64.79 168.11 14.15 Favored 'Trans proline' 0 N--CA 1.489 1.224 0 O-C-N 123.026 1.013 . . . . 0.0 110.553 178.611 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.18 -38.81 60.67 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.203 -0.935 . . . . 0.0 110.189 179.971 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.28 -40.65 82.48 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.034 -1.041 . . . . 0.0 110.053 -179.811 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 -67.08 -41.1 86.96 Favored 'General case' 0 N--CA 1.507 2.42 0 C-N-CA 119.359 -0.936 . . . . 0.0 109.399 179.46 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.478 ' O ' HG11 ' A' ' 140' ' ' VAL . 5.4 mt -64.27 -40.66 96.43 Favored 'General case' 0 N--CA 1.507 2.389 0 C-N-CA 119.446 -0.902 . . . . 0.0 109.552 179.318 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.68 -39.91 86.1 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.16 -0.962 . . . . 0.0 109.936 179.78 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -60.93 -40.02 91.67 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.148 -0.97 . . . . 0.0 109.964 179.781 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -62.19 -41.92 98.8 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.201 -0.937 . . . . 0.0 109.872 179.797 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.558 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -61.37 -41.6 97.34 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.215 -0.928 . . . . 0.0 109.886 179.955 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 6.9 mmt85 -59.65 -38.55 81.72 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.143 -0.973 . . . . 0.0 109.991 179.658 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 13.9 mttp -61.63 -35.68 78.61 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.18 -0.95 . . . . 0.0 110.567 -179.902 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -105.45 21.68 16.77 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.007 -1.058 . . . . 0.0 111.836 -179.913 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.39 46.06 58.14 Favored Glycine 0 N--CA 1.498 2.812 0 O-C-N 120.641 -1.287 . . . . 0.0 110.773 179.315 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.558 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 9.5 t -138.74 -165.31 1.8 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.113 -1.228 . . . . 0.0 110.189 179.747 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.4 mp0 -133.34 167.72 19.88 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.188 -0.945 . . . . 0.0 110.471 -179.896 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.478 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.6 p -159.82 161.14 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.041 0 O-C-N 121.336 -0.853 . . . . 0.0 110.646 -179.981 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 38.8 t -169.05 113.92 0.57 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.18 -0.95 . . . . 0.0 111.256 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.71 ' CE1' HG23 ' A' ' 121' ' ' ILE . 85.1 t80 -102.97 158.79 16.04 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.234 -0.916 . . . . 0.0 110.156 179.586 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 15.2 m80 -137.17 -61.54 0.65 Allowed 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.822 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -148.01 149.33 31.93 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.576 -0.702 . . . . 0.0 109.247 178.81 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . 0.462 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 26.3 p -93.67 155.24 17.37 Favored 'General case' 0 N--CA 1.505 2.275 0 C-N-CA 119.038 -1.065 . . . . 0.0 110.813 -179.485 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.9 p -71.86 -25.15 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.493 0 O-C-N 121.287 -0.883 . . . . 0.0 111.77 -179.252 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -50.25 -59.78 3.62 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 120.832 -1.168 . . . . 0.0 110.171 -179.898 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.498 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.8 p -126.95 -165.11 1.42 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.213 -0.929 . . . . 0.0 110.491 179.424 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . 0.441 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.51 60.99 0.65 Allowed Glycine 0 N--CA 1.492 2.38 0 N-CA-C 107.945 -2.062 . . . . 0.0 107.945 178.3 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 16.9 t -99.15 138.69 35.9 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.353 -1.087 . . . . 0.0 109.64 -179.182 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.63 49.45 1.03 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.23 -0.919 . . . . 0.0 109.882 179.398 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 75.16 93.58 0.16 Allowed Glycine 0 N--CA 1.488 2.156 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 179.757 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.4 p -104.83 127.25 52.58 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.237 -1.154 . . . . 0.0 109.665 179.107 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . 0.473 ' HB1' ' HB3' ' A' ' 125' ' ' PRO . . . -153.98 149.51 27.31 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.052 -1.03 . . . . 0.0 110.554 -179.057 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -96.5 -39.12 9.71 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.269 -0.895 . . . . 0.0 110.422 179.949 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 6.8 m -56.8 -38.82 73.07 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.024 -1.047 . . . . 0.0 110.383 179.994 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 . . . . . 0 N--CA 1.493 1.69 0 CA-C-O 117.961 -1.018 . . . . 0.0 110.21 179.955 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.306 0 N-CA-C 109.564 -1.415 . . . . 0.0 109.564 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 70.83 42.04 61.68 Favored Glycine 0 N--CA 1.492 2.43 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 -179.972 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.7 t -142.27 70.89 22.35 Favored Pre-proline 0 N--CA 1.494 1.741 0 O-C-N 121.182 -1.187 . . . . 0.0 110.21 -179.97 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -73.05 132.5 18.27 Favored 'Trans proline' 0 C--N 1.317 -1.093 0 O-C-N 123.356 1.187 . . . . 0.0 110.466 -179.95 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -119.68 95.36 4.74 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.204 -0.935 . . . . 0.0 110.157 -179.982 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 38.9 pt -138.13 151.9 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.224 -0.922 . . . . 0.0 110.268 -179.934 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.6 mtmm -143.53 -174.03 4.12 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.273 -0.892 . . . . 0.0 110.268 179.993 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.1 p -116.95 170.81 8.34 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.253 -0.904 . . . . 0.0 110.187 -179.99 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 62.8 mtt-85 -142.87 85.74 1.9 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.203 -0.936 . . . . 0.0 110.292 -179.952 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.84 148.93 41.31 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.194 -0.941 . . . . 0.0 110.21 179.94 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.6 m 52.41 77.03 0.16 Allowed 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.077 -1.014 . . . . 0.0 110.816 -179.985 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.1 tptp -132.12 96.57 19.6 Favored Pre-proline 0 N--CA 1.494 1.748 0 O-C-N 121.198 -0.939 . . . . 0.0 110.224 -179.95 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.474 ' O ' ' HB3' ' A' ' 12' ' ' ALA . 46.8 Cg_endo -72.8 157.46 51.79 Favored 'Trans proline' 0 C--N 1.317 -1.115 0 O-C-N 123.408 1.215 . . . . 0.0 110.678 179.992 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.737 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . 62.2 144.32 0.07 OUTLIER Pre-proline 0 N--CA 1.503 2.212 0 O-C-N 121.367 -0.833 . . . . 0.0 110.62 179.911 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -74.02 161.11 41.79 Favored 'Trans proline' 0 N--CA 1.485 1.0 0 O-C-N 123.192 1.101 . . . . 0.0 110.611 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -49.15 -31.81 8.97 Favored 'General case' 0 N--CA 1.515 2.815 0 O-C-N 121.431 -0.793 . . . . 0.0 111.318 -179.82 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.2 -33.37 45.42 Favored Glycine 0 N--CA 1.499 2.851 0 O-C-N 121.031 -1.043 . . . . 0.0 110.635 179.855 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -54.18 -32.01 54.32 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 120.962 -1.317 . . . . 0.0 110.766 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -54.93 -37.34 66.29 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 121.037 -1.04 . . . . 0.0 110.242 179.868 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.8 mtpp -57.68 -35.39 70.52 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.152 -0.968 . . . . 0.0 110.359 179.588 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.726 HD12 HD11 ' A' ' 23' ' ' LEU . 3.1 pt -116.26 36.73 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.15 -0.969 . . . . 0.0 110.428 179.592 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.441 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -82.53 -43.03 0.95 Allowed Pre-proline 0 N--CA 1.508 2.459 0 O-C-N 121.078 -1.014 . . . . 0.0 113.003 -179.436 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.441 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.2 Cg_endo -76.14 -34.73 2.74 Favored 'Trans proline' 0 N--CA 1.486 1.07 0 O-C-N 122.571 0.774 . . . . 0.0 111.875 -178.366 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.959 HG21 ' CE2' ' A' ' 62' ' ' TYR . 91.4 m -61.3 -47.99 83.41 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.885 -1.135 . . . . 0.0 109.833 -179.762 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.726 HD11 HD12 ' A' ' 19' ' ' ILE . 7.8 mt -62.07 -40.21 95.03 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.465 179.555 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.426 ' O ' HD12 ' A' ' 28' ' ' ILE . 7.7 m -57.56 -35.41 70.31 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.155 -0.966 . . . . 0.0 110.187 179.229 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -56.72 -37.9 71.62 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.041 -1.037 . . . . 0.0 110.128 179.691 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.59 ' CD2' HD22 ' A' ' 55' ' ' LEU . 14.1 m-85 -58.69 -39.05 79.64 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.101 -1.0 . . . . 0.0 110.284 179.965 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -59.81 -40.14 87.38 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.17 -0.956 . . . . 0.0 110.362 -179.512 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.429 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.2 mp -65.65 -42.07 91.94 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.376 0 C-N-CA 119.12 -1.032 . . . . 0.0 108.668 179.48 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.7 tp60 -68.03 -50.99 51.99 Favored 'General case' 0 N--CA 1.506 2.337 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 178.494 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.11 HD11 HG23 ' A' ' 52' ' ' ILE . 5.6 tp -59.09 -36.28 74.84 Favored 'General case' 0 N--CA 1.509 2.516 0 C-N-CA 119.546 -0.861 . . . . 0.0 109.471 178.403 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.6 mtt85 -57.93 -37.79 74.73 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.124 -0.985 . . . . 0.0 110.333 179.675 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -62.74 -50.42 71.14 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.094 -1.003 . . . . 0.0 109.748 -179.636 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.544 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -71.46 -40.0 70.58 Favored 'General case' 0 N--CA 1.503 2.188 0 C-N-CA 118.829 -1.149 . . . . 0.0 108.827 178.796 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -62.1 -32.7 73.28 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.21 -0.931 . . . . 0.0 110.246 179.207 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.3 mtpt -96.42 -35.85 11.02 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 120.934 -1.104 . . . . 0.0 111.065 -179.818 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -56.43 -36.85 69.47 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 120.955 -1.09 . . . . 0.0 110.359 179.975 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.5 ttmt -55.75 -42.7 75.82 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 121.134 -0.979 . . . . 0.0 110.306 -179.928 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.2 m 52.15 54.22 11.15 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.033 -1.042 . . . . 0.0 110.768 -179.975 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.3 t 53.26 -164.55 0.09 Allowed 'General case' 0 N--CA 1.501 2.108 0 O-C-N 120.986 -1.071 . . . . 0.0 110.552 -179.971 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.5 mmtt -78.13 69.47 4.35 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.094 -1.004 . . . . 0.0 109.754 179.703 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.4 tp -146.04 42.12 1.2 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.297 -0.877 . . . . 0.0 110.366 -179.77 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -167.54 -179.55 4.43 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.124 -0.985 . . . . 0.0 111.062 -179.871 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -117.01 175.84 5.4 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.231 -0.918 . . . . 0.0 110.096 179.866 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 21.1 mttt 52.67 57.88 5.94 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.04 -1.037 . . . . 0.0 110.566 -179.951 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 5.6 m -95.31 -38.14 10.66 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.217 -0.927 . . . . 0.0 110.578 179.957 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.417 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 34.7 m120 -60.28 -45.03 94.75 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.126 -0.984 . . . . 0.0 109.828 179.937 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -60.16 -44.89 94.65 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.144 -0.973 . . . . 0.0 109.708 179.867 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.56 -43.78 92.85 Favored 'General case' 0 N--CA 1.506 2.375 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.272 179.29 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 20.6 mt -61.46 -35.65 78.21 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.332 -0.855 . . . . 0.0 110.185 179.818 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.51 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 49.4 m0 -58.7 -39.28 80.31 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 120.962 -1.086 . . . . 0.0 109.742 179.762 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -62.16 -31.25 71.72 Favored 'General case' 0 N--CA 1.504 2.257 0 C-N-CA 119.144 -1.022 . . . . 0.0 109.715 178.409 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 1.11 HG23 HD11 ' A' ' 30' ' ' LEU . 17.8 mt -71.81 -58.19 5.68 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.145 0 O-C-N 120.93 -1.106 . . . . 0.0 109.157 179.298 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.0 ptm -61.48 -29.58 70.06 Favored 'General case' 0 N--CA 1.508 2.458 0 C-N-CA 118.57 -1.252 . . . . 0.0 109.787 178.81 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -69.11 -38.17 78.78 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 120.793 -1.192 . . . . 0.0 109.009 178.078 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.59 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.1 mt -53.34 -32.05 47.33 Favored 'General case' 0 N--CA 1.513 2.681 0 O-C-N 120.951 -1.093 . . . . 0.0 110.163 178.963 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.467 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 67.6 t60 -56.19 -38.9 71.6 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.061 -1.025 . . . . 0.0 110.24 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.405 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 7.4 m170 -60.13 -47.99 83.61 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.103 -0.998 . . . . 0.0 109.449 179.361 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -60.38 -35.88 76.77 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.262 -0.899 . . . . 0.0 109.651 178.974 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.441 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -64.97 -49.11 71.61 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.045 -1.034 . . . . 0.0 109.615 179.385 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.7 p -62.77 -38.56 91.09 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.139 -0.976 . . . . 0.0 109.409 179.329 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 19.5 ttt85 -63.13 -40.31 97.22 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.064 -1.022 . . . . 0.0 109.342 179.281 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.959 ' CE2' HG21 ' A' ' 22' ' ' THR . 43.0 t80 -62.35 -50.87 69.86 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.181 -0.949 . . . . 0.0 109.379 179.506 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.748 HD12 ' HB2' ' A' ' 87' ' ' ALA . 86.9 mt -69.5 -39.53 78.67 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.345 0 C-N-CA 119.271 -0.972 . . . . 0.0 109.126 179.351 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 9.5 t80 -64.48 -42.39 95.92 Favored 'General case' 0 N--CA 1.503 2.216 0 C-N-CA 119.409 -0.917 . . . . 0.0 109.055 179.022 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.417 ' HA ' ' CD ' ' A' ' 69' ' ' LYS . 87.4 m -60.89 -42.01 97.14 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.055 -1.028 . . . . 0.0 110.5 -179.575 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.581 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.29 -33.16 26.03 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 118.923 -1.111 . . . . 0.0 112.759 -178.766 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.498 ' N ' HD12 ' A' ' 66' ' ' LEU . 51.0 t80 -86.32 -32.43 21.04 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 120.599 -1.313 . . . . 0.0 111.734 -179.363 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -98.38 -16.75 19.17 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 120.827 -1.171 . . . . 0.0 112.713 -178.872 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.417 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 4.8 mttt -124.15 -59.31 1.5 Allowed 'General case' 0 N--CA 1.501 2.114 0 O-C-N 120.46 -1.4 . . . . 0.0 111.008 179.79 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.413 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 4.8 tpt180 -61.87 -30.21 70.71 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.147 -0.971 . . . . 0.0 110.825 -179.649 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.2 tttp 57.87 42.05 23.75 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 120.754 -1.216 . . . . 0.0 110.093 -179.592 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.38 35.72 3.88 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.369 -0.832 . . . . 0.0 109.952 179.303 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.825 HG13 HD23 ' A' ' 77' ' ' LEU . 14.0 tt -154.64 162.37 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 O-C-N 121.214 -0.929 . . . . 0.0 109.905 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.8 m -110.02 147.82 32.83 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.172 -0.955 . . . . 0.0 110.18 179.791 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.9 ttmt -45.42 -32.27 2.06 Favored 'General case' 0 N--CA 1.516 2.835 0 O-C-N 121.401 -0.812 . . . . 0.0 111.656 -179.971 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -62.25 -50.99 69.54 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 120.938 -1.101 . . . . 0.0 109.3 179.559 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.825 HD23 HG13 ' A' ' 73' ' ' ILE . 50.1 tp -65.63 -46.03 80.82 Favored 'General case' 0 N--CA 1.505 2.306 0 C-N-CA 119.106 -1.038 . . . . 0.0 108.481 178.959 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.434 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 18.8 t80 -59.8 -38.98 83.47 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.276 -0.89 . . . . 0.0 109.545 179.224 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -72.73 -42.14 64.41 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.112 -0.993 . . . . 0.0 108.971 178.933 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.737 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 83.0 t90 -57.48 -37.27 72.64 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.218 -0.927 . . . . 0.0 109.717 179.091 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.777 HD22 ' CD2' ' A' ' 86' ' ' TYR . 62.9 mt -68.5 -48.12 65.22 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.19 -0.944 . . . . 0.0 108.981 179.149 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.456 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 34.4 mm -56.01 -33.36 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.56 0 O-C-N 121.206 -0.934 . . . . 0.0 109.941 179.374 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 24.7 tttt -89.29 -16.23 31.65 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.004 -1.06 . . . . 0.0 112.082 179.929 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.451 ' HB2' ' CE1' ' A' ' 86' ' ' TYR . 8.4 mm-40 -102.88 21.61 15.29 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.547 -1.345 . . . . 0.0 112.05 -179.829 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 17.1 tttp 75.54 72.04 0.09 Allowed 'General case' 0 N--CA 1.511 2.599 0 O-C-N 121.201 -0.937 . . . . 0.0 111.735 179.443 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.777 ' CD2' HD22 ' A' ' 81' ' ' LEU . 33.9 m-85 -134.2 -62.89 0.74 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.519 -0.738 . . . . 0.0 109.119 179.267 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.748 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -129.09 160.15 33.72 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.507 -0.745 . . . . 0.0 109.4 179.243 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.467 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 8.2 t70 -107.61 115.25 29.82 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.035 -1.041 . . . . 0.0 110.346 -179.866 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -58.64 -37.22 75.47 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.255 -0.903 . . . . 0.0 110.03 179.668 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.482 HD23 HD22 ' A' ' 106' ' ' LEU . 7.1 tp -60.79 -38.79 86.5 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.124 -0.985 . . . . 0.0 109.601 179.504 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.598 HD12 ' CZ3' ' A' ' 95' ' ' TRP . 0.3 OUTLIER -65.13 -55.54 18.1 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.094 -1.004 . . . . 0.0 108.856 179.155 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 57.7 mt -61.67 -36.97 76.75 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.41 0 C-N-CA 119.401 -0.919 . . . . 0.0 109.038 178.974 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.74 -39.3 90.99 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.164 -0.96 . . . . 0.0 109.428 178.891 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.43 ' HD2' ' CE1' ' A' ' 100' ' ' TYR . 12.8 mmtm -59.36 -43.94 92.78 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.115 -0.99 . . . . 0.0 109.635 179.543 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.598 ' CZ3' HD12 ' A' ' 91' ' ' LEU . 2.9 m0 -63.86 -33.86 76.65 Favored 'General case' 0 N--CA 1.51 2.526 0 C-N-CA 119.311 -0.956 . . . . 0.0 110.343 179.461 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.54 -30.49 29.69 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.043 -1.036 . . . . 0.0 110.993 179.722 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -54.15 -176.57 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.68 0 O-C-N 120.912 -1.118 . . . . 0.0 110.601 179.87 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -104.16 136.54 43.59 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.16 -0.962 . . . . 0.0 109.874 179.296 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 94.09 13.17 55.28 Favored Glycine 0 N--CA 1.494 2.501 0 C-N-CA 120.295 -0.955 . . . . 0.0 110.938 -179.418 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.584 ' HB3' HD23 ' A' ' 103' ' ' LEU . 49.6 m-85 -120.14 71.34 0.9 Allowed 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 119.322 1.561 . . . . 0.0 110.003 179.748 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -92.84 -36.66 12.71 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.08 -1.012 . . . . 0.0 110.474 179.89 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.28 76.94 1.52 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.051 -1.031 . . . . 0.0 110.698 -179.854 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.584 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.2 pp -122.58 147.34 46.52 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.06 -1.025 . . . . 0.0 109.957 179.536 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.405 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.6 p -111.58 -32.06 6.8 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 119.491 -0.884 . . . . 0.0 112.988 -179.447 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.617 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.1 m -142.22 -168.15 2.65 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 120.26 -1.525 . . . . 0.0 110.156 179.246 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.482 HD22 HD23 ' A' ' 90' ' ' LEU . 44.2 mt -95.97 -38.26 10.31 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.153 -0.967 . . . . 0.0 110.021 179.018 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 18.0 ttt85 -102.46 30.83 4.37 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.958 -1.089 . . . . 0.0 109.721 178.109 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.617 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.311 1.8 t -130.51 20.07 5.19 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.168 -0.958 . . . . 0.0 108.746 -179.429 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.492 HG22 ' HD3' ' A' ' 123' ' ' ARG . 2.1 pt -156.63 38.17 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 O-C-N 120.938 -1.101 . . . . 0.0 110.107 -178.574 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.784 ' C ' HG23 ' A' ' 119' ' ' THR . 31.0 mt-30 -88.19 97.23 10.89 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 120.953 -1.092 . . . . 0.0 110.869 -178.639 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.411 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 7.6 tttm -104.57 -49.57 3.51 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.3 -0.875 . . . . 0.0 110.278 179.586 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -115.79 -173.17 2.3 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.183 -0.948 . . . . 0.0 110.251 179.814 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 52.71 50.45 18.09 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.111 -0.993 . . . . 0.0 110.8 179.951 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -145.8 154.74 42.35 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.086 -1.009 . . . . 0.0 110.373 -179.994 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -116.05 -57.06 2.26 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.215 -0.928 . . . . 0.0 110.07 179.886 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 52.8 m-20 -116.4 110.13 18.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.268 -0.895 . . . . 0.0 110.05 179.814 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 143.15 -168.37 26.12 Favored Glycine 0 N--CA 1.493 2.497 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 -179.87 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 12.3 m -145.86 -164.54 1.98 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.194 -1.18 . . . . 0.0 110.358 -179.777 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.784 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.6 m -107.51 158.24 17.37 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.179 -0.951 . . . . 0.0 109.934 179.814 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.439 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 43.0 t -70.27 153.23 43.3 Favored 'General case' 0 N--CA 1.501 2.087 0 C-N-CA 118.895 -1.122 . . . . 0.0 108.244 178.527 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.941 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -70.41 -31.74 47.78 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.391 0 O-C-N 121.072 -1.017 . . . . 0.0 111.523 -178.667 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.5 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.4 p -60.95 -35.98 78.18 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 120.701 -1.249 . . . . 0.0 110.28 -179.8 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.492 ' HD3' HG22 ' A' ' 109' ' ' ILE . 23.5 tpt85 -57.31 -36.93 71.71 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 120.905 -1.122 . . . . 0.0 109.603 178.539 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 49.1 t -75.13 119.5 77.23 Favored Pre-proline 0 N--CA 1.505 2.302 0 O-C-N 121.204 -0.935 . . . . 0.0 109.85 179.718 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -64.43 178.9 1.43 Allowed 'Trans proline' 0 N--CA 1.488 1.188 0 O-C-N 123.133 1.07 . . . . 0.0 110.768 179.584 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.7 mmm-85 -74.99 -37.53 61.85 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.193 -0.942 . . . . 0.0 110.596 -179.784 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.46 -40.61 83.14 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.071 -1.018 . . . . 0.0 109.968 -179.867 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -69.92 -41.49 74.56 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 119.382 -0.927 . . . . 0.0 109.266 179.246 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.501 HD11 HD11 ' A' ' 121' ' ' ILE . 11.1 mt -65.34 -38.69 90.87 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.272 -0.893 . . . . 0.0 109.576 179.188 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -60.98 -38.75 87.07 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.179 -0.951 . . . . 0.0 109.924 179.653 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.26 -36.21 72.91 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.148 -0.97 . . . . 0.0 110.416 179.845 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -63.77 -49.42 73.02 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.182 -0.949 . . . . 0.0 109.807 179.973 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.496 ' HB1' ' CA ' ' A' ' 139' ' ' GLN . . . -61.25 -38.25 86.01 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.122 -0.986 . . . . 0.0 109.84 179.733 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 15.6 mtp85 -61.69 -36.24 80.32 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.114 -0.991 . . . . 0.0 110.12 179.562 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 6.7 mttm -87.13 -34.96 18.9 Favored 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.029 -1.044 . . . . 0.0 110.747 179.798 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -82.48 -35.99 26.92 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 120.987 -1.07 . . . . 0.0 110.667 179.776 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.87 34.78 8.09 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.804 -1.319 . . . . 0.0 109.804 -179.861 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.9 t -131.17 23.14 4.85 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.992 -1.299 . . . . 0.0 111.531 179.702 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . 0.496 ' CA ' ' HB1' ' A' ' 133' ' ' ALA . 5.2 mt-30 48.62 -179.06 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.862 -1.149 . . . . 0.0 111.928 179.462 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.7 p -174.07 159.28 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.307 0 O-C-N 121.051 -1.031 . . . . 0.0 110.698 -179.841 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 41.5 t -171.98 92.5 0.13 Allowed 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.219 -0.926 . . . . 0.0 110.939 179.787 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.941 ' CD1' HD12 ' A' ' 121' ' ' ILE . 80.8 t80 -99.79 158.9 15.46 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.24 -0.912 . . . . 0.0 110.724 -179.881 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -139.46 -61.33 0.55 Allowed 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 178.615 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 1.6 pm0 -137.67 150.81 47.65 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.49 -0.756 . . . . 0.0 108.972 178.621 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . 0.411 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.4 p -91.99 153.88 19.16 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.973 -1.08 . . . . 0.0 111.034 -179.735 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.3 p -72.4 -23.4 21.21 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.416 0 C-N-CA 119.733 -0.787 . . . . 0.0 111.51 -179.76 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -51.55 -60.6 2.96 Favored 'General case' 0 N--CA 1.514 2.746 0 O-C-N 120.711 -1.243 . . . . 0.0 110.044 179.921 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.51 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 21.6 p -125.8 -164.11 1.28 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.265 -0.897 . . . . 0.0 110.395 179.327 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -101.64 61.53 0.55 Allowed Glycine 0 N--CA 1.492 2.384 0 N-CA-C 107.958 -2.057 . . . . 0.0 107.958 178.202 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 18.9 t -100.32 146.38 27.02 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.293 -1.122 . . . . 0.0 109.866 -179.13 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 6.7 ttm-85 -100.42 45.65 0.97 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.254 -0.904 . . . . 0.0 109.566 179.349 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 74.08 97.03 0.1 OUTLIER Glycine 0 N--CA 1.486 2.015 0 N-CA-C 109.806 -1.318 . . . . 0.0 109.806 179.993 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 26.3 p -109.47 125.74 52.77 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.275 -1.132 . . . . 0.0 110.133 179.606 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -144.79 144.93 31.41 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.088 -1.008 . . . . 0.0 110.181 -179.414 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.73 -35.28 10.6 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.235 -0.916 . . . . 0.0 111.025 -179.824 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 41.7 p -77.63 -40.33 42.28 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 120.888 -1.132 . . . . 0.0 110.217 179.978 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 . . . . . 0 N--CA 1.496 1.837 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.45 179.881 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.3 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 66.78 90.14 0.05 OUTLIER Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.633 -1.387 . . . . 0.0 109.633 -179.972 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 60.2 p -121.11 84.84 40.39 Favored Pre-proline 0 N--CA 1.494 1.769 0 O-C-N 121.242 -1.152 . . . . 0.0 110.212 -179.99 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.89 117.75 5.26 Favored 'Trans proline' 0 C--N 1.316 -1.132 0 O-C-N 123.413 1.217 . . . . 0.0 110.38 -179.973 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.9 ttm-85 -120.51 58.51 0.93 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.198 -0.939 . . . . 0.0 110.157 179.964 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.6 mm -116.62 141.3 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.144 -0.973 . . . . 0.0 110.016 -179.994 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.6 mttp -120.08 158.86 25.98 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.174 -0.954 . . . . 0.0 110.219 -179.984 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 12.8 p -118.84 54.58 0.95 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.235 -0.915 . . . . 0.0 110.155 -179.994 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.92 84.56 2.17 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.134 -0.979 . . . . 0.0 110.178 -179.981 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.8 ttm-85 -117.55 -57.56 2.12 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.247 -0.908 . . . . 0.0 110.093 179.892 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.4 t -128.79 98.51 5.0 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.177 -0.952 . . . . 0.0 110.13 179.977 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.3 tptt -127.9 95.77 33.68 Favored Pre-proline 0 N--CA 1.494 1.753 0 O-C-N 121.251 -0.906 . . . . 0.0 110.227 -179.908 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.52 158.59 50.76 Favored 'Trans proline' 0 C--N 1.316 -1.161 0 O-C-N 123.414 1.218 . . . . 0.0 110.508 179.858 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.655 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -55.26 148.61 30.53 Favored Pre-proline 0 N--CA 1.514 2.728 0 O-C-N 121.312 -0.868 . . . . 0.0 110.079 -179.982 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -70.97 160.43 49.38 Favored 'Trans proline' 0 C--N 1.316 -1.152 0 O-C-N 123.314 1.165 . . . . 0.0 110.831 -179.538 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -48.72 -32.06 7.87 Favored 'General case' 0 N--CA 1.515 2.816 0 O-C-N 121.384 -0.822 . . . . 0.0 111.403 -179.718 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.63 -33.27 41.12 Favored Glycine 0 N--CA 1.498 2.773 0 O-C-N 121.011 -1.055 . . . . 0.0 110.653 179.751 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.445 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 16.6 t80 -55.3 -34.23 63.96 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 120.939 -1.33 . . . . 0.0 110.701 179.888 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -55.17 -37.22 66.74 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 121.05 -1.031 . . . . 0.0 110.239 179.727 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.3 mtpt -57.65 -35.51 70.62 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.237 -0.915 . . . . 0.0 110.319 179.604 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.894 HD12 HD11 ' A' ' 23' ' ' LEU . 3.2 pt -115.25 36.33 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 O-C-N 121.186 -0.947 . . . . 0.0 110.328 179.548 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.445 ' HD2' ' CE2' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -84.98 -42.93 0.67 Allowed Pre-proline 0 N--CA 1.511 2.59 0 O-C-N 121.149 -0.969 . . . . 0.0 113.509 -179.143 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.8 Cg_endo -75.06 -37.23 2.09 Favored 'Trans proline' 0 N--CA 1.488 1.188 0 O-C-N 122.63 0.805 . . . . 0.0 111.921 -177.828 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.756 HG21 ' CE2' ' A' ' 62' ' ' TYR . 70.6 m -61.32 -43.38 98.96 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.019 -1.051 . . . . 0.0 110.139 -179.569 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.894 HD11 HD12 ' A' ' 19' ' ' ILE . 34.1 mt -65.07 -40.18 94.32 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.219 -0.926 . . . . 0.0 109.58 179.746 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -34.17 69.2 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.107 -0.995 . . . . 0.0 110.276 179.337 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -56.72 -36.36 69.62 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.004 -1.06 . . . . 0.0 110.288 179.628 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.742 ' CD1' HD22 ' A' ' 55' ' ' LEU . 26.2 m-85 -57.2 -39.89 76.33 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.098 -1.001 . . . . 0.0 110.325 179.866 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -60.06 -23.63 63.92 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.316 -0.865 . . . . 0.0 111.483 -179.461 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.568 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.7 mp -81.19 -34.72 13.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.426 0 O-C-N 120.767 -1.208 . . . . 0.0 109.727 179.623 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.429 ' OE1' HD21 ' A' ' 55' ' ' LEU . 25.3 tt0 -82.53 -36.21 26.56 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 120.951 -1.093 . . . . 0.0 109.179 178.543 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.726 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -74.18 -31.65 62.75 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.134 -0.979 . . . . 0.0 110.054 178.864 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -69.56 -36.71 76.57 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 120.808 -1.183 . . . . 0.0 109.911 179.419 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -64.19 -42.09 96.82 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.104 -1.038 . . . . 0.0 109.168 179.277 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.589 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -68.43 -41.95 79.59 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.272 -0.893 . . . . 0.0 109.096 178.964 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -59.41 -35.13 73.4 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.226 -0.922 . . . . 0.0 110.218 179.579 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -82.79 -39.73 21.39 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.009 -1.057 . . . . 0.0 110.147 179.818 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -59.98 -39.76 86.82 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.214 -0.929 . . . . 0.0 109.959 179.681 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.67 -38.05 74.47 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.148 -0.97 . . . . 0.0 110.374 179.937 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 6.4 t -109.82 59.71 0.6 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.047 -1.033 . . . . 0.0 110.077 179.847 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.3 t -146.95 -58.59 0.28 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.206 -0.934 . . . . 0.0 110.506 -179.962 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 42.2 mttt -103.63 -48.09 4.06 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.215 -0.928 . . . . 0.0 110.311 179.907 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.428 HD22 ' HA ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER 54.07 53.84 10.53 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 120.932 -1.105 . . . . 0.0 110.615 -179.88 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -142.94 -59.64 0.43 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.167 -0.958 . . . . 0.0 110.28 179.87 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -136.16 157.61 46.4 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.27 -0.894 . . . . 0.0 110.178 179.868 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.2 tttm 52.92 49.28 20.56 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.04 -1.038 . . . . 0.0 110.759 179.986 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.0 m -112.7 -54.15 2.65 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.123 -0.985 . . . . 0.0 110.501 179.983 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -56.25 -38.36 71.02 Favored 'General case' 0 N--CA 1.511 2.599 0 O-C-N 121.138 -0.976 . . . . 0.0 110.06 179.884 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -62.01 -40.84 97.05 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.211 -0.931 . . . . 0.0 109.804 179.773 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 48.9 tp60 -62.21 -40.49 96.26 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.183 -0.948 . . . . 0.0 109.782 179.805 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.442 HD23 ' HA ' ' A' ' 49' ' ' LEU . 12.6 mt -59.32 -39.28 82.61 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.142 -0.974 . . . . 0.0 110.092 179.87 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.482 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.8 m0 -61.17 -36.22 79.24 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.114 -0.991 . . . . 0.0 110.149 179.86 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.96 -31.21 68.52 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.988 -1.07 . . . . 0.0 110.107 178.871 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.726 HG23 ' CG ' ' A' ' 30' ' ' LEU . 79.6 mt -72.08 -60.29 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.286 0 O-C-N 120.921 -1.112 . . . . 0.0 108.816 179.148 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 5.6 ptm -61.67 -29.32 70.0 Favored 'General case' 0 N--CA 1.508 2.443 0 C-N-CA 118.771 -1.171 . . . . 0.0 109.685 178.568 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -70.39 -38.32 74.65 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.832 -1.168 . . . . 0.0 109.001 178.307 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.742 HD22 ' CD1' ' A' ' 26' ' ' PHE . 11.7 mt -53.72 -33.39 55.42 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.057 -1.027 . . . . 0.0 110.067 178.959 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.471 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 38.4 t60 -54.63 -38.79 67.28 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 120.961 -1.087 . . . . 0.0 109.943 179.816 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.427 ' CD2' HD21 ' A' ' 91' ' ' LEU . 5.2 m170 -59.15 -46.14 89.14 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.152 -0.967 . . . . 0.0 109.321 179.354 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 -61.64 -37.36 83.71 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.406 -0.917 . . . . 0.0 109.272 178.93 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.442 ' HG2' ' CE1' ' A' ' 26' ' ' PHE . 3.5 mmm-85 -64.51 -50.46 67.29 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.125 -0.984 . . . . 0.0 109.216 178.999 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 89.4 p -62.82 -40.11 96.39 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.197 -0.939 . . . . 0.0 109.193 179.455 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 12.5 ttm-85 -64.72 -38.25 90.34 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.127 -0.983 . . . . 0.0 109.399 178.995 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.756 ' CE2' HG21 ' A' ' 22' ' ' THR . 37.7 t80 -60.61 -48.69 80.66 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.094 -1.004 . . . . 0.0 109.583 179.542 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.728 HD12 ' HB2' ' A' ' 87' ' ' ALA . 84.7 mt -76.51 -42.25 35.32 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.338 0 O-C-N 121.222 -0.924 . . . . 0.0 108.875 179.119 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.463 ' CE1' HG23 ' A' ' 92' ' ' ILE . 44.4 t80 -61.44 -22.74 65.31 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.402 -0.811 . . . . 0.0 110.507 178.824 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 86.9 m -90.73 -36.0 14.56 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.609 -1.307 . . . . 0.0 110.503 179.955 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.548 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.6 pp -82.9 -32.3 27.37 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.898 -1.126 . . . . 0.0 112.343 -179.179 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.491 ' N ' HD12 ' A' ' 66' ' ' LEU . 34.3 t80 -86.21 -37.87 18.21 Favored 'General case' 0 N--CA 1.512 2.648 0 O-C-N 120.738 -1.226 . . . . 0.0 111.299 -179.375 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.408 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 12.9 m-85 -89.68 -21.63 22.64 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.977 -1.077 . . . . 0.0 112.548 -178.647 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.6 mttm -119.87 -60.71 1.68 Allowed 'General case' 0 N--CA 1.501 2.104 0 O-C-N 120.489 -1.382 . . . . 0.0 111.153 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.41 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 31.8 ttt85 -60.38 -30.33 69.51 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.079 -1.013 . . . . 0.0 110.92 -179.464 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.1 tttt 57.5 42.04 25.03 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.859 -1.15 . . . . 0.0 110.025 -179.462 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -111.93 35.31 3.76 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.342 -0.849 . . . . 0.0 109.87 179.219 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.781 HG13 HD23 ' A' ' 77' ' ' LEU . 13.6 tt -156.14 162.1 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.214 -0.929 . . . . 0.0 109.913 -179.956 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 40.5 m -108.78 149.56 28.88 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.117 -0.989 . . . . 0.0 110.211 179.967 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.0 tttt -46.83 -32.08 3.48 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.307 -0.871 . . . . 0.0 111.462 -179.972 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.19 -50.6 71.14 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 120.893 -1.129 . . . . 0.0 109.39 179.521 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.781 HD23 HG13 ' A' ' 73' ' ' ILE . 38.0 tp -66.9 -44.3 81.17 Favored 'General case' 0 N--CA 1.505 2.301 0 C-N-CA 119.108 -1.037 . . . . 0.0 108.488 178.856 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.653 ' HA ' HD12 ' A' ' 81' ' ' LEU . 17.5 t80 -60.24 -38.64 84.05 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.305 -0.872 . . . . 0.0 109.425 178.933 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -72.75 -42.7 63.78 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.04 -1.037 . . . . 0.0 108.656 178.495 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.655 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 75.0 t90 -57.68 -37.13 72.91 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.271 -0.893 . . . . 0.0 109.576 178.825 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.653 HD12 ' HA ' ' A' ' 78' ' ' TYR . 12.7 mt -67.6 -51.44 50.27 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.18 -0.95 . . . . 0.0 109.113 179.178 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 36.3 mm -57.34 -31.64 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.507 0 O-C-N 121.246 -0.909 . . . . 0.0 110.228 179.559 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -89.26 -13.13 38.81 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 120.907 -1.12 . . . . 0.0 112.222 -179.804 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.441 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 76.4 mm-40 -108.84 23.12 15.0 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 120.535 -1.353 . . . . 0.0 111.977 -179.879 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.65 74.18 0.11 Allowed 'General case' 0 N--CA 1.512 2.671 0 O-C-N 121.188 -0.945 . . . . 0.0 111.71 179.227 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.496 ' HE2' HD13 ' A' ' 23' ' ' LEU . 32.0 m-85 -134.05 -62.94 0.75 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.512 -0.743 . . . . 0.0 109.22 179.433 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.728 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -131.2 163.06 28.56 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.472 -0.768 . . . . 0.0 109.418 179.315 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.471 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 8.3 t0 -107.93 108.65 19.89 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.091 -1.006 . . . . 0.0 110.417 -179.911 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -58.7 -37.54 76.32 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.249 -0.907 . . . . 0.0 110.19 179.742 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.626 HD23 HD13 ' A' ' 106' ' ' LEU . 18.4 tp -59.03 -39.01 80.63 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.102 -0.999 . . . . 0.0 110.19 -179.973 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.587 ' HA ' HD21 ' A' ' 106' ' ' LEU . 58.4 tp -71.02 -45.5 63.8 Favored 'General case' 0 N--CA 1.505 2.29 0 C-N-CA 119.123 -1.031 . . . . 0.0 108.884 179.318 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.463 HG23 ' CE1' ' A' ' 64' ' ' TYR . 20.6 mt -60.91 -39.09 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.384 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 178.358 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.77 -39.88 95.57 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.116 -0.99 . . . . 0.0 109.355 178.741 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.552 ' HB3' HD22 ' A' ' 103' ' ' LEU . 13.5 mmtm -59.54 -47.73 84.4 Favored 'General case' 0 N--CA 1.51 2.575 0 O-C-N 121.137 -0.977 . . . . 0.0 109.287 179.455 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.6 m0 -59.68 -35.18 73.96 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.364 -0.835 . . . . 0.0 110.244 179.549 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.429 ' HD2' ' OH ' ' A' ' 64' ' ' TYR . 8.9 mtp85 -81.94 -33.02 30.53 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.112 -0.992 . . . . 0.0 110.757 179.76 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 7.9 mmtt -51.82 178.01 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.782 0 O-C-N 121.007 -1.058 . . . . 0.0 110.851 -179.855 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 28.5 m -105.38 140.43 38.5 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.252 -0.905 . . . . 0.0 109.395 179.188 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.88 -22.85 37.84 Favored Glycine 0 N--CA 1.494 2.534 0 C-N-CA 119.709 -1.234 . . . . 0.0 110.465 -179.26 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.649 ' HB3' HD23 ' A' ' 103' ' ' LEU . 70.0 m-85 -91.22 58.43 3.68 Favored 'General case' 0 N--CA 1.505 2.277 0 CA-C-N 119.181 1.49 . . . . 0.0 110.056 179.831 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -66.6 -36.08 81.75 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.076 -1.015 . . . . 0.0 110.272 179.891 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.1 mmmt -127.95 97.36 4.77 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.054 -1.029 . . . . 0.0 110.819 -179.708 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.649 HD23 ' HB3' ' A' ' 100' ' ' TYR . 2.2 pp -134.64 136.62 42.98 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.111 -0.993 . . . . 0.0 109.983 179.24 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.427 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 27.9 p -103.9 -28.42 11.6 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.193 -0.942 . . . . 0.0 112.337 -179.787 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.705 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 14.3 m -145.46 -166.63 2.48 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.301 -1.499 . . . . 0.0 109.547 178.955 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.626 HD13 HD23 ' A' ' 90' ' ' LEU . 25.6 mt -99.0 -45.84 5.81 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.111 -0.993 . . . . 0.0 109.63 178.613 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 61.8 ttt-85 -93.42 -1.67 55.5 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 120.977 -1.077 . . . . 0.0 111.498 178.911 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.705 ' HB2' ' HB2' ' A' ' 105' ' ' CYS . 1.6 t -83.04 -48.13 10.94 Favored 'General case' 0 N--CA 1.512 2.635 0 N-CA-C 105.331 -2.1 . . . . 0.0 105.331 178.61 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.787 ' O ' HG21 ' A' ' 119' ' ' THR . 14.4 pt -76.13 -25.21 16.69 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.553 0 O-C-N 121.208 -0.933 . . . . 0.0 110.83 177.568 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.469 ' C ' HG23 ' A' ' 119' ' ' THR . 7.1 mt-30 -120.61 -174.68 2.86 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.004 -1.06 . . . . 0.0 110.127 -179.767 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.81 -167.74 1.74 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.202 -0.936 . . . . 0.0 110.412 179.9 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -146.01 -58.32 0.31 Allowed 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.212 -0.93 . . . . 0.0 110.73 -179.748 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -125.49 50.51 1.8 Allowed 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.174 -0.954 . . . . 0.0 110.49 -179.97 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.52 -163.63 1.19 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.282 -0.886 . . . . 0.0 109.735 179.768 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 12.8 t30 -106.45 179.78 4.17 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.068 -1.02 . . . . 0.0 110.151 179.954 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 50.9 m-20 -60.44 141.65 56.11 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.146 -0.971 . . . . 0.0 110.037 -179.827 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 68.78 46.96 58.54 Favored Glycine 0 N--CA 1.491 2.367 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.992 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 64.4 m -139.17 61.02 1.57 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.199 -1.177 . . . . 0.0 110.219 179.975 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.787 HG21 ' O ' ' A' ' 109' ' ' ILE . 0.3 OUTLIER -115.56 179.35 3.99 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.112 -0.993 . . . . 0.0 109.952 179.72 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.408 ' HB3' ' O ' ' A' ' 108' ' ' CYS . 34.3 t -58.72 153.91 15.76 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.172 -0.955 . . . . 0.0 109.87 179.802 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.799 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -72.87 -34.53 46.78 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.394 0 O-C-N 121.126 -0.984 . . . . 0.0 111.217 -179.207 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.493 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 12.3 p -55.64 -33.82 64.39 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 120.817 -1.177 . . . . 0.0 111.165 -178.788 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 6.6 ttp85 -59.56 -35.15 73.7 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 120.882 -1.136 . . . . 0.0 109.55 178.382 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 58.7 t -79.95 125.19 82.43 Favored Pre-proline 0 N--CA 1.503 2.18 0 O-C-N 121.121 -0.987 . . . . 0.0 109.653 179.468 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.595 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.3 Cg_endo -65.12 177.12 2.66 Favored 'Trans proline' 0 N--CA 1.488 1.155 0 O-C-N 123.104 1.055 . . . . 0.0 110.814 179.734 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 3.8 tpp85 -75.01 -38.12 61.64 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.257 -0.902 . . . . 0.0 110.529 -179.818 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.18 -40.67 82.08 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.066 -1.021 . . . . 0.0 110.031 -179.946 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 14.8 tm0? -69.94 -42.28 73.46 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.21 -0.931 . . . . 0.0 109.17 179.25 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.595 HD12 ' O ' ' A' ' 125' ' ' PRO . 8.2 mt -65.5 -38.44 89.72 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 119.526 -0.869 . . . . 0.0 109.464 179.08 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -59.81 -38.53 82.22 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.113 -0.992 . . . . 0.0 110.013 179.563 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -58.44 -37.29 75.11 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.133 -0.98 . . . . 0.0 110.379 179.895 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -60.19 -43.38 95.96 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.091 -1.006 . . . . 0.0 110.041 -179.969 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.682 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -61.91 -45.79 92.16 Favored 'General case' 0 N--CA 1.509 2.487 0 C-N-CA 119.305 -0.958 . . . . 0.0 109.726 179.875 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 3.3 mmt85 -58.19 -34.28 70.18 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.207 -0.933 . . . . 0.0 110.373 179.618 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -76.73 -31.42 57.13 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.116 -0.99 . . . . 0.0 110.914 179.919 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 42.0 mttt -98.73 23.93 8.16 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 120.812 -1.18 . . . . 0.0 111.642 -179.9 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.71 47.02 53.68 Favored Glycine 0 N--CA 1.5 2.905 0 O-C-N 120.696 -1.252 . . . . 0.0 110.717 179.212 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.682 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.7 t -153.47 -171.06 3.78 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.087 -1.243 . . . . 0.0 110.726 179.822 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -123.65 176.77 6.03 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.232 -0.917 . . . . 0.0 110.241 -179.831 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.2 p -158.89 161.17 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.193 -0.942 . . . . 0.0 110.765 -179.953 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 31.6 t -166.3 97.62 0.6 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.325 -0.859 . . . . 0.0 110.971 -179.999 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.728 ' CG ' HD12 ' A' ' 121' ' ' ILE . 59.4 t80 -101.08 158.65 15.85 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.295 -0.878 . . . . 0.0 110.483 -179.87 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 21.0 m170 -137.59 -60.51 0.65 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.437 -0.789 . . . . 0.0 109.102 179.04 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -138.0 149.13 45.82 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.374 -0.829 . . . . 0.0 109.139 178.793 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . 0.425 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.3 p -88.88 154.98 19.81 Favored 'General case' 0 N--CA 1.507 2.397 0 C-N-CA 119.112 -1.035 . . . . 0.0 111.033 -179.553 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.1 p -74.89 -23.78 17.71 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.327 0 O-C-N 121.318 -0.864 . . . . 0.0 111.678 -179.382 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -52.01 -61.5 2.22 Favored 'General case' 0 N--CA 1.515 2.791 0 O-C-N 120.659 -1.276 . . . . 0.0 110.115 -179.933 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.482 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.9 p -125.61 -167.12 1.65 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.224 -0.923 . . . . 0.0 110.404 179.711 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -97.79 66.93 0.8 Allowed Glycine 0 N--CA 1.493 2.47 0 N-CA-C 108.076 -2.009 . . . . 0.0 108.076 178.54 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 36.7 t -102.97 144.18 31.58 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.305 -1.115 . . . . 0.0 110.111 -179.165 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 32.5 mtp85 -99.29 48.39 0.95 Allowed 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.156 -0.965 . . . . 0.0 109.38 178.993 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.17 96.39 0.05 OUTLIER Glycine 0 N--CA 1.486 1.994 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 -179.814 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 22.8 p -109.17 127.88 54.57 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.151 -1.205 . . . . 0.0 110.339 179.72 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -141.96 141.99 32.96 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.115 -0.991 . . . . 0.0 109.863 -179.734 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -106.75 -49.74 3.25 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.252 -0.905 . . . . 0.0 110.563 -179.801 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 27.9 p -54.09 -38.28 65.18 Favored 'General case' 0 N--CA 1.513 2.683 0 O-C-N 121.012 -1.055 . . . . 0.0 110.614 -179.79 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 117.987 -1.006 . . . . 0.0 110.326 179.923 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.337 0 N-CA-C 109.584 -1.407 . . . . 0.0 109.584 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -93.66 -169.17 38.5 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.981 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.434 ' OG ' ' HD2' ' A' ' 2' ' ' PRO . 0.3 OUTLIER -120.51 162.98 31.52 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.194 -1.18 . . . . 0.0 110.164 -179.978 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.434 ' HD2' ' OG ' ' A' ' 1' ' ' SER . 46.4 Cg_endo -72.75 132.43 18.62 Favored 'Trans proline' 0 C--N 1.317 -1.111 0 O-C-N 123.419 1.221 . . . . 0.0 110.367 -179.993 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.432 ' C ' HG23 ' A' ' 4' ' ' ILE . 0.1 OUTLIER -116.97 74.62 0.92 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.188 -0.945 . . . . 0.0 110.201 -179.969 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.432 HG23 ' C ' ' A' ' 3' ' ' ARG . 1.7 pp -148.36 127.37 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.129 -0.982 . . . . 0.0 110.455 179.75 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.7 tttp -134.98 103.14 5.46 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.301 -0.875 . . . . 0.0 110.157 -179.943 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 74.8 p -117.37 172.0 7.61 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.273 -0.892 . . . . 0.0 110.246 -179.972 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.3 mmm-85 -136.01 177.5 7.79 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.197 -0.939 . . . . 0.0 110.245 179.982 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 75.9 mtt180 -125.34 47.59 2.16 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.148 -0.97 . . . . 0.0 110.246 179.991 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.4 t -139.33 41.21 2.07 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.225 -0.922 . . . . 0.0 110.234 -179.966 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 39.1 mttp -130.31 72.28 81.96 Favored Pre-proline 0 N--CA 1.493 1.696 0 O-C-N 121.126 -0.984 . . . . 0.0 110.082 179.996 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -74.23 158.5 45.01 Favored 'Trans proline' 0 C--N 1.317 -1.121 0 O-C-N 123.345 1.182 . . . . 0.0 110.758 -179.963 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.655 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -103.74 143.47 26.7 Favored Pre-proline 0 N--CA 1.5 2.071 0 O-C-N 121.482 -0.761 . . . . 0.0 109.654 179.566 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -68.36 164.24 33.35 Favored 'Trans proline' 0 C--N 1.317 -1.131 0 O-C-N 123.282 1.148 . . . . 0.0 110.94 -179.772 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -48.11 -31.65 5.85 Favored 'General case' 0 N--CA 1.516 2.825 0 O-C-N 121.484 -0.76 . . . . 0.0 111.544 -179.739 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.76 -36.15 40.3 Favored Glycine 0 N--CA 1.498 2.8 0 O-C-N 120.898 -1.126 . . . . 0.0 110.548 179.887 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.601 ' HB2' HD11 ' A' ' 77' ' ' LEU . 23.0 t80 -57.48 -34.18 68.76 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.983 -1.304 . . . . 0.0 110.504 179.76 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -52.58 -36.64 56.47 Favored 'General case' 0 N--CA 1.513 2.697 0 O-C-N 120.912 -1.117 . . . . 0.0 110.212 179.743 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.9 mtmt -58.56 -36.09 73.37 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.216 -0.927 . . . . 0.0 110.259 179.534 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.865 HD12 HD11 ' A' ' 23' ' ' LEU . 1.7 pt -120.7 35.01 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 O-C-N 121.109 -0.995 . . . . 0.0 110.77 179.881 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.436 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.7 OUTLIER -83.7 -43.33 0.8 Allowed Pre-proline 0 N--CA 1.51 2.557 0 O-C-N 121.031 -1.043 . . . . 0.0 113.313 -179.085 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.436 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.5 Cg_endo -75.37 -35.24 3.0 Favored 'Trans proline' 0 N--CA 1.486 1.044 0 O-C-N 122.6 0.789 . . . . 0.0 111.903 -178.094 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.732 HG21 ' CE2' ' A' ' 62' ' ' TYR . 88.6 m -60.16 -43.26 95.94 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 120.95 -1.094 . . . . 0.0 110.1 -179.738 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.865 HD11 HD12 ' A' ' 19' ' ' ILE . 5.9 mt -65.95 -41.16 91.61 Favored 'General case' 0 N--CA 1.507 2.418 0 C-N-CA 119.472 -0.891 . . . . 0.0 109.355 179.512 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.17 -34.63 72.34 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.259 -0.9 . . . . 0.0 110.077 179.277 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -58.49 -36.72 74.19 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.145 -0.972 . . . . 0.0 110.349 179.869 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.693 ' CD2' HD22 ' A' ' 55' ' ' LEU . 11.6 m-85 -55.78 -41.47 74.11 Favored 'General case' 0 N--CA 1.512 2.634 0 O-C-N 120.905 -1.122 . . . . 0.0 109.869 179.56 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -58.24 -25.98 62.35 Favored 'General case' 0 N--CA 1.506 2.352 0 C-N-CA 119.302 -0.959 . . . . 0.0 110.501 179.05 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 15.2 mm -68.41 -52.23 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.342 0 O-C-N 120.923 -1.111 . . . . 0.0 109.162 179.488 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -66.89 -42.47 85.45 Favored 'General case' 0 N--CA 1.508 2.451 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.018 179.31 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.686 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -64.69 -35.53 81.35 Favored 'General case' 0 N--CA 1.506 2.358 0 C-N-CA 119.44 -0.904 . . . . 0.0 109.106 178.744 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.71 -40.38 83.54 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.082 -1.011 . . . . 0.0 109.997 179.582 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -62.55 -47.74 82.57 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.202 -0.937 . . . . 0.0 109.717 -179.957 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.652 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -69.05 -40.24 78.65 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.164 -0.96 . . . . 0.0 109.278 179.213 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 41.4 mm-40 -67.57 -31.69 71.93 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.248 -0.907 . . . . 0.0 110.398 179.465 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.2 mmmt -92.89 -34.66 13.72 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 120.861 -1.149 . . . . 0.0 110.736 179.965 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -57.54 -36.07 71.14 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.017 -1.052 . . . . 0.0 110.153 179.836 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.688 ' HA ' HD22 ' A' ' 41' ' ' LEU . 9.2 mtmt -54.39 -37.2 64.75 Favored 'General case' 0 N--CA 1.512 2.627 0 O-C-N 121.064 -1.022 . . . . 0.0 110.461 179.879 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.3 p -106.2 39.19 1.85 Allowed 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.092 -1.005 . . . . 0.0 110.194 179.657 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.1 m -154.94 89.54 1.23 Allowed 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.151 -0.968 . . . . 0.0 110.496 -179.995 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt 53.48 86.98 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.06 -1.025 . . . . 0.0 110.664 -179.852 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.688 HD22 ' HA ' ' A' ' 37' ' ' LYS . 4.4 tp -154.36 87.58 1.19 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.194 -0.941 . . . . 0.0 110.648 -179.986 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.21 -39.08 10.27 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.214 -0.929 . . . . 0.0 110.275 179.801 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -115.56 170.11 8.67 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.027 -1.045 . . . . 0.0 110.226 179.94 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 17.1 mttt 53.24 77.27 0.18 Allowed 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.017 -1.052 . . . . 0.0 110.752 179.952 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.9 t -115.31 -55.16 2.48 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.178 -0.951 . . . . 0.0 110.508 179.958 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 32.7 m-20 -55.12 -38.29 68.0 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.094 -1.004 . . . . 0.0 110.036 179.763 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -59.8 -38.31 81.58 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.274 -0.891 . . . . 0.0 110.144 179.708 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -64.47 -40.71 96.22 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.113 -0.992 . . . . 0.0 109.925 179.947 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.548 HD21 ' HE2' ' A' ' 37' ' ' LYS . 24.8 mt -67.85 -35.78 79.17 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.223 -0.923 . . . . 0.0 110.344 179.899 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 47.1 m0 -58.79 -37.82 77.16 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.003 -1.06 . . . . 0.0 110.019 179.879 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -62.96 -32.17 73.44 Favored 'General case' 0 N--CA 1.504 2.235 0 C-N-CA 119.074 -1.05 . . . . 0.0 109.494 178.425 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.686 HG23 ' CG ' ' A' ' 30' ' ' LEU . 68.6 mt -71.83 -59.04 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.232 0 O-C-N 120.91 -1.119 . . . . 0.0 108.999 179.216 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -60.69 -29.11 69.12 Favored 'General case' 0 N--CA 1.511 2.605 0 C-N-CA 118.483 -1.287 . . . . 0.0 109.918 178.9 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.4 mm-40 -68.75 -37.9 79.72 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 120.846 -1.159 . . . . 0.0 109.138 178.215 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.693 HD22 ' CD2' ' A' ' 26' ' ' PHE . 10.9 mt -53.74 -32.18 51.22 Favored 'General case' 0 N--CA 1.511 2.6 0 O-C-N 120.92 -1.112 . . . . 0.0 110.375 179.026 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.444 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 17.6 t60 -56.62 -37.0 70.09 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.004 -1.06 . . . . 0.0 110.302 179.91 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.495 ' NE2' HD21 ' A' ' 91' ' ' LEU . 5.5 m170 -61.41 -51.13 70.04 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.141 -0.974 . . . . 0.0 109.458 179.407 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -57.98 -35.92 71.88 Favored 'General case' 0 N--CA 1.509 2.478 0 C-N-CA 119.377 -0.929 . . . . 0.0 109.715 179.206 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.435 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -65.48 -50.27 65.95 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.102 -0.999 . . . . 0.0 109.353 179.272 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 60.7 p -62.24 -39.12 91.77 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.097 -1.002 . . . . 0.0 109.209 179.24 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -63.78 -37.39 87.2 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.292 -0.963 . . . . 0.0 109.416 179.001 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.732 ' CE2' HG21 ' A' ' 22' ' ' THR . 36.0 t80 -61.0 -50.6 72.71 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.154 -0.966 . . . . 0.0 109.344 179.504 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.64 HD12 ' HB2' ' A' ' 87' ' ' ALA . 92.0 mt -74.5 -41.91 49.23 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 C-N-CA 119.329 -0.949 . . . . 0.0 108.872 179.193 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.435 ' OH ' ' NH1' ' A' ' 96' ' ' ARG . 58.6 t80 -59.77 -36.21 76.21 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.3 -0.875 . . . . 0.0 109.821 179.032 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 76.2 m -75.04 -38.77 61.34 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.943 -1.098 . . . . 0.0 110.356 180.0 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.529 ' C ' HD12 ' A' ' 66' ' ' LEU . 3.5 pp -83.23 -31.47 26.99 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.85 -1.156 . . . . 0.0 112.142 -179.275 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.472 ' HD2' HG23 ' A' ' 73' ' ' ILE . 40.8 t80 -86.4 -41.47 14.44 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 120.658 -1.277 . . . . 0.0 111.874 -179.575 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -90.39 -26.36 19.94 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 120.89 -1.131 . . . . 0.0 112.818 -177.723 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.42 ' HE2' ' CD2' ' A' ' 64' ' ' TYR . 0.7 OUTLIER -109.11 -58.2 2.06 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.673 -1.267 . . . . 0.0 110.668 -179.988 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.418 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 8.1 tpt180 -58.32 -33.58 69.66 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.015 -1.053 . . . . 0.0 110.364 179.721 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.7 tttp 59.26 47.21 11.8 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 120.896 -1.128 . . . . 0.0 110.37 179.903 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.8 -58.1 2.2 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.378 -0.826 . . . . 0.0 109.507 179.339 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.705 HG13 HD23 ' A' ' 77' ' ' LEU . 14.8 tt -54.91 162.39 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.601 0 O-C-N 121.366 -0.834 . . . . 0.0 110.224 179.55 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.0 t -110.53 147.36 34.32 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.188 -0.945 . . . . 0.0 109.805 178.975 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -43.15 -33.83 0.98 Allowed 'General case' 0 N--CA 1.52 3.04 0 O-C-N 121.376 -0.828 . . . . 0.0 111.986 -179.594 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.6 -48.04 83.52 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 120.956 -1.09 . . . . 0.0 109.474 179.556 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.705 HD23 HG13 ' A' ' 73' ' ' ILE . 23.9 tp -70.52 -41.79 72.12 Favored 'General case' 0 N--CA 1.504 2.233 0 C-N-CA 119.236 -0.986 . . . . 0.0 108.705 178.611 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.54 ' HA ' HD12 ' A' ' 81' ' ' LEU . 26.2 t80 -61.71 -36.56 81.29 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.27 -0.894 . . . . 0.0 109.478 178.821 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -71.96 -43.77 64.63 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.024 -1.048 . . . . 0.0 108.905 179.047 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.655 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 72.8 t90 -59.42 -37.97 79.42 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.227 -0.921 . . . . 0.0 109.428 178.979 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.54 HD12 ' HA ' ' A' ' 78' ' ' TYR . 18.8 mt -65.74 -49.77 67.21 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.247 -0.908 . . . . 0.0 109.55 179.531 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.527 HD12 ' HG3' ' A' ' 89' ' ' LYS . 39.7 mm -59.6 -33.16 50.92 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.515 0 O-C-N 121.258 -0.901 . . . . 0.0 110.164 179.68 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.13 -6.3 57.11 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 120.909 -1.119 . . . . 0.0 112.379 -179.802 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.42 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 7.6 mm-40 -114.46 21.81 14.24 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.537 -1.352 . . . . 0.0 111.899 -179.941 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.01 77.74 0.12 Allowed 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.014 -1.054 . . . . 0.0 111.433 179.371 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.578 ' HE2' HD13 ' A' ' 23' ' ' LEU . 33.0 m-85 -136.7 -63.46 0.62 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.499 -0.75 . . . . 0.0 109.418 179.653 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.64 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -125.6 -174.26 3.03 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.431 -0.793 . . . . 0.0 109.293 179.342 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.444 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 5.4 t0 -121.67 102.76 8.43 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.098 -1.001 . . . . 0.0 110.343 -179.956 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.527 ' HG3' HD12 ' A' ' 82' ' ' ILE . 19.5 mtpt -60.37 -40.38 90.6 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.143 -0.973 . . . . 0.0 109.874 179.618 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.581 HD23 HD13 ' A' ' 106' ' ' LEU . 30.9 tp -59.97 -42.78 94.88 Favored 'General case' 0 N--CA 1.508 2.425 0 C-N-CA 119.408 -0.917 . . . . 0.0 109.67 179.711 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.746 ' HA ' HD21 ' A' ' 106' ' ' LEU . 37.0 tp -64.97 -50.44 66.34 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.168 -0.957 . . . . 0.0 108.927 179.529 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 55.9 mt -59.25 -36.04 61.19 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.413 0 O-C-N 121.188 -0.945 . . . . 0.0 108.797 178.593 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -64.53 -44.93 89.29 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.135 -0.978 . . . . 0.0 109.341 178.726 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.507 ' HD3' HD23 ' A' ' 106' ' ' LEU . 8.7 mttp -59.66 -44.68 93.46 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.087 -1.008 . . . . 0.0 109.862 179.163 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.5 m0 -59.04 -35.49 73.4 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.158 -0.964 . . . . 0.0 110.105 179.262 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.435 ' NH1' ' OH ' ' A' ' 64' ' ' TYR . 13.2 mtp85 -85.04 -30.4 24.16 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.07 -1.019 . . . . 0.0 110.513 179.269 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.43 -176.93 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.719 0 O-C-N 120.987 -1.07 . . . . 0.0 110.697 179.865 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 12.0 m -102.23 135.11 44.4 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.208 -0.933 . . . . 0.0 109.594 179.012 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 97.04 10.42 54.92 Favored Glycine 0 N--CA 1.494 2.522 0 O-C-N 121.132 -0.98 . . . . 0.0 111.081 -179.345 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.579 ' HB3' HD23 ' A' ' 103' ' ' LEU . 48.5 m-85 -118.35 71.87 0.85 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 119.339 1.57 . . . . 0.0 109.641 179.576 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -94.62 -33.75 12.88 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.158 -0.964 . . . . 0.0 110.871 -179.804 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.68 77.08 1.77 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.99 -1.069 . . . . 0.0 110.997 -179.49 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.579 HD23 ' HB3' ' A' ' 100' ' ' TYR . 2.3 pp -125.44 159.36 32.1 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.031 -1.043 . . . . 0.0 109.83 179.042 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.441 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.6 p -120.3 -33.06 3.98 Favored 'General case' 0 N--CA 1.501 2.101 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -178.709 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.636 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.3 m -140.27 -168.04 2.45 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 120.056 -1.653 . . . . 0.0 110.254 179.573 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.746 HD21 ' HA ' ' A' ' 91' ' ' LEU . 46.1 mt -95.65 -39.45 9.9 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.166 -0.959 . . . . 0.0 110.069 179.134 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.86 28.26 5.36 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 120.934 -1.104 . . . . 0.0 110.042 178.006 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.636 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.302 1.8 t -126.32 15.55 7.75 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.093 -1.004 . . . . 0.0 108.855 -179.669 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.497 HG22 ' HG3' ' A' ' 123' ' ' ARG . 1.2 pt -157.81 36.86 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.292 0 O-C-N 120.803 -1.185 . . . . 0.0 110.55 -178.776 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.599 ' O ' HG23 ' A' ' 119' ' ' THR . 3.5 tt0 -117.58 134.05 55.3 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 120.73 -1.231 . . . . 0.0 111.824 -178.071 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.519 ' HA ' ' HG1' ' A' ' 119' ' ' THR . 9.5 ptpp? -130.86 -170.05 2.28 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.249 -0.907 . . . . 0.0 110.097 179.406 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 60.31 -74.64 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.514 -0.741 . . . . 0.0 111.38 -179.899 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.412 ' N ' ' O ' ' A' ' 111' ' ' LYS . 13.7 mm-40 -112.6 123.83 51.17 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.868 -1.145 . . . . 0.0 110.237 -179.955 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 17.3 p -137.02 -179.82 5.94 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.177 -0.952 . . . . 0.0 110.185 -179.971 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -118.82 -57.05 2.07 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.243 -0.911 . . . . 0.0 110.285 179.995 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -123.42 103.42 8.46 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.128 -0.982 . . . . 0.0 110.205 -179.955 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 98.18 -143.71 16.83 Favored Glycine 0 N--CA 1.493 2.469 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.981 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 14.9 m -145.81 -167.84 2.82 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.234 -1.156 . . . . 0.0 110.359 179.999 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.599 HG23 ' O ' ' A' ' 110' ' ' GLN . 1.5 m -60.6 169.06 1.92 Allowed 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.228 -0.92 . . . . 0.0 109.978 179.908 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 49.3 t -95.2 154.13 17.33 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 119.555 -0.858 . . . . 0.0 109.186 178.913 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.803 HD12 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -71.56 -37.18 62.85 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.441 0 O-C-N 121.115 -0.99 . . . . 0.0 110.987 -179.053 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.455 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 10.8 p -53.97 -34.35 59.49 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 120.932 -1.105 . . . . 0.0 111.127 -178.703 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.497 ' HG3' HG22 ' A' ' 109' ' ' ILE . 10.9 ttp85 -59.53 -34.88 73.18 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 120.966 -1.084 . . . . 0.0 109.542 178.38 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 49.5 t -79.9 124.75 83.07 Favored Pre-proline 0 N--CA 1.505 2.29 0 O-C-N 121.14 -0.975 . . . . 0.0 109.925 179.614 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.628 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.0 Cg_endo -65.13 178.7 1.81 Allowed 'Trans proline' 0 N--CA 1.488 1.205 0 O-C-N 123.113 1.06 . . . . 0.0 110.804 179.517 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.2 mmt85 -75.05 -37.73 61.61 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.233 -0.917 . . . . 0.0 110.489 -179.803 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.64 -42.81 89.18 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.043 -1.035 . . . . 0.0 109.971 -179.752 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -68.79 -41.65 78.44 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.281 -0.968 . . . . 0.0 109.128 179.256 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.628 HD12 ' O ' ' A' ' 125' ' ' PRO . 5.6 mt -64.17 -38.57 91.54 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.172 -0.955 . . . . 0.0 109.701 179.166 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -60.61 -40.15 90.81 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.095 -1.003 . . . . 0.0 109.853 179.765 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -59.62 -37.07 77.64 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.12 -0.987 . . . . 0.0 110.16 179.739 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -60.67 -45.15 95.23 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.114 -0.991 . . . . 0.0 109.843 179.859 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.458 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -62.13 -46.41 89.12 Favored 'General case' 0 N--CA 1.507 2.389 0 C-N-CA 119.337 -0.945 . . . . 0.0 109.687 179.759 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.79 -35.2 74.16 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.192 -0.943 . . . . 0.0 110.11 179.559 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -73.89 -32.64 63.69 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.101 -1.0 . . . . 0.0 110.773 179.887 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 1.4 ttmt -98.87 23.32 9.0 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.944 -1.098 . . . . 0.0 111.685 179.996 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.92 46.73 55.06 Favored Glycine 0 N--CA 1.499 2.873 0 O-C-N 120.69 -1.256 . . . . 0.0 110.702 179.288 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.458 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.8 t -148.79 -165.15 2.2 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.154 -1.204 . . . . 0.0 110.468 179.848 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -131.62 153.52 49.84 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.214 -0.929 . . . . 0.0 110.186 -179.874 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.447 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.1 p -131.55 160.66 42.2 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 O-C-N 121.193 -0.942 . . . . 0.0 110.349 179.964 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 47.7 t -168.57 86.68 0.19 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.232 -0.917 . . . . 0.0 110.744 179.99 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.803 ' CG ' HD12 ' A' ' 121' ' ' ILE . 57.8 t80 -102.47 161.72 13.49 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.181 -0.949 . . . . 0.0 110.821 -179.483 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 3.3 m170 -139.5 -60.96 0.55 Allowed 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 178.995 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -134.86 150.17 50.42 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.339 -0.85 . . . . 0.0 108.774 178.47 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 28.3 p -92.65 154.09 18.58 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.096 -1.042 . . . . 0.0 111.117 -179.42 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.9 p -73.31 -25.19 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 O-C-N 121.39 -0.819 . . . . 0.0 111.475 -179.603 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -49.73 -55.79 12.61 Favored 'General case' 0 N--CA 1.516 2.835 0 O-C-N 120.828 -1.17 . . . . 0.0 110.231 -179.875 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 23.1 p -131.55 -163.41 1.32 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.218 -0.926 . . . . 0.0 110.226 179.651 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -102.23 63.47 0.48 Allowed Glycine 0 N--CA 1.492 2.394 0 N-CA-C 108.015 -2.034 . . . . 0.0 108.015 178.4 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 31.6 t -104.01 141.48 36.11 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.362 -1.081 . . . . 0.0 110.162 -178.993 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 6.0 ttt-85 -96.33 53.26 1.31 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.303 -0.873 . . . . 0.0 109.423 178.995 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.23 96.87 0.03 OUTLIER Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.714 -1.355 . . . . 0.0 109.714 -179.857 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.2 p -107.24 127.21 53.33 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.165 -1.197 . . . . 0.0 110.34 179.608 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -152.99 148.82 27.53 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.167 -0.958 . . . . 0.0 110.355 -179.546 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -104.14 -45.89 4.59 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.191 -0.943 . . . . 0.0 110.759 -179.727 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 3.0 m -52.89 -38.57 61.87 Favored 'General case' 0 N--CA 1.513 2.682 0 O-C-N 120.935 -1.103 . . . . 0.0 110.722 -179.742 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 . . . . . 0 N--CA 1.495 1.802 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.223 179.893 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.291 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -74.36 168.82 54.34 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 179.986 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 60.1 p -131.57 93.88 27.44 Favored Pre-proline 0 N--CA 1.495 1.793 0 O-C-N 121.207 -1.173 . . . . 0.0 110.228 179.999 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.59 173.47 13.25 Favored 'Trans proline' 0 C--N 1.317 -1.124 0 O-C-N 123.402 1.211 . . . . 0.0 110.437 179.958 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.7 tpp85 -116.99 130.0 56.4 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.198 -0.939 . . . . 0.0 110.159 -179.991 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 85.1 mt -119.73 92.64 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 O-C-N 121.257 -0.902 . . . . 0.0 110.021 -179.999 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.4 tttt -119.03 98.72 6.32 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.195 -0.941 . . . . 0.0 110.159 179.965 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.6 m -134.46 61.19 1.68 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.183 -0.948 . . . . 0.0 110.19 -179.974 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 80.2 mtt-85 -119.91 40.17 3.48 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.15 -0.969 . . . . 0.0 110.238 179.998 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.2 179.42 4.7 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.181 -0.95 . . . . 0.0 110.057 -179.948 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.0 p -124.59 -167.89 1.73 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.234 -0.916 . . . . 0.0 110.168 -180.0 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 24.7 mmtt -137.7 160.32 65.42 Favored Pre-proline 0 N--CA 1.494 1.739 0 O-C-N 121.25 -0.906 . . . . 0.0 110.35 -179.945 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -73.22 158.28 49.06 Favored 'Trans proline' 0 C--N 1.318 -1.059 0 O-C-N 123.362 1.19 . . . . 0.0 110.543 -179.935 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.663 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -60.41 144.2 88.56 Favored Pre-proline 0 N--CA 1.51 2.566 0 C-N-CA 119.566 -0.854 . . . . 0.0 109.65 179.995 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -72.45 160.41 46.85 Favored 'Trans proline' 0 C--N 1.317 -1.116 0 O-C-N 123.346 1.182 . . . . 0.0 110.722 -179.823 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -49.37 -31.55 9.67 Favored 'General case' 0 N--CA 1.515 2.789 0 O-C-N 121.394 -0.816 . . . . 0.0 111.361 -179.869 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.55 -33.4 40.76 Favored Glycine 0 N--CA 1.498 2.798 0 O-C-N 120.941 -1.099 . . . . 0.0 110.686 179.888 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -55.21 -33.08 62.75 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 120.938 -1.331 . . . . 0.0 110.665 179.939 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -54.16 -37.71 64.73 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 120.981 -1.074 . . . . 0.0 110.325 179.776 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.3 mtpp -59.74 -36.94 77.64 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.227 -0.921 . . . . 0.0 110.201 179.545 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.846 ' O ' HD12 ' A' ' 23' ' ' LEU . 1.6 pt -114.96 33.85 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 O-C-N 121.129 -0.982 . . . . 0.0 110.702 179.759 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.427 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 1.1 ttpt -83.81 -43.21 0.79 Allowed Pre-proline 0 N--CA 1.508 2.469 0 O-C-N 121.005 -1.059 . . . . 0.0 113.102 -179.356 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.3 Cg_endo -75.7 -35.14 2.82 Favored 'Trans proline' 0 N--CA 1.487 1.103 0 O-C-N 122.592 0.785 . . . . 0.0 111.563 -178.448 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.778 HG21 ' CE2' ' A' ' 62' ' ' TYR . 90.5 m -58.48 -41.86 86.21 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 120.948 -1.095 . . . . 0.0 110.05 -179.926 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.846 HD12 ' O ' ' A' ' 19' ' ' ILE . 5.0 mt -68.18 -41.3 81.64 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.514 -0.874 . . . . 0.0 109.297 179.398 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.3 m -60.42 -33.95 73.26 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.168 -0.958 . . . . 0.0 109.845 178.926 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -55.57 -34.96 65.24 Favored 'General case' 0 N--CA 1.511 2.579 0 O-C-N 121.01 -1.056 . . . . 0.0 110.198 179.465 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.714 ' CD2' HD22 ' A' ' 55' ' ' LEU . 15.7 m-85 -55.32 -35.79 65.52 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.103 -0.998 . . . . 0.0 110.516 179.704 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -57.16 -38.19 73.2 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.095 -1.003 . . . . 0.0 110.647 -179.628 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.427 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.2 mp -66.36 -40.81 87.66 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 C-N-CA 119.316 -0.954 . . . . 0.0 109.158 179.725 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -70.32 -46.87 63.35 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.125 -0.985 . . . . 0.0 108.784 178.97 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.141 HD11 HG23 ' A' ' 52' ' ' ILE . 2.2 tp -62.07 -35.54 78.94 Favored 'General case' 0 N--CA 1.507 2.419 0 C-N-CA 119.377 -0.929 . . . . 0.0 109.305 178.555 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.92 -36.08 69.78 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.106 -0.996 . . . . 0.0 110.391 179.699 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -62.88 -52.4 63.23 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.054 -1.029 . . . . 0.0 109.458 -179.883 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.535 ' HB1' ' HG2' ' A' ' 48' ' ' GLN . . . -68.91 -41.96 77.48 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 119.042 -1.063 . . . . 0.0 108.589 178.809 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -60.45 -32.42 71.36 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.22 -0.925 . . . . 0.0 110.187 179.309 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 41.8 mtpt -93.6 -30.16 15.1 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 120.939 -1.1 . . . . 0.0 111.037 179.952 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -54.54 -35.78 63.59 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 120.861 -1.15 . . . . 0.0 110.407 -179.947 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.2 ttpt -55.79 -48.55 75.16 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.007 -1.058 . . . . 0.0 110.316 -179.965 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 53.04 -179.95 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.073 -1.017 . . . . 0.0 110.912 179.959 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.0 t -117.61 161.26 19.93 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.105 -0.997 . . . . 0.0 110.092 179.994 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 31.2 mtpt 52.11 38.52 24.43 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.091 -1.006 . . . . 0.0 110.803 -179.826 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.4 tp -128.15 -57.0 1.24 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.234 -0.916 . . . . 0.0 110.475 -179.753 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 53.96 95.62 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.043 -1.036 . . . . 0.0 110.865 -179.735 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -173.48 103.92 0.12 Allowed 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.289 -0.882 . . . . 0.0 110.604 179.85 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 30.2 mtmt 51.81 60.98 3.46 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.037 -1.039 . . . . 0.0 110.496 -179.719 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.5 m -96.14 -39.32 9.76 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.235 -0.915 . . . . 0.0 110.616 -179.819 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -61.34 -40.88 95.89 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.112 -0.992 . . . . 0.0 109.66 179.99 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -61.03 -39.45 89.81 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.217 -0.927 . . . . 0.0 109.788 179.455 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.535 ' HG2' ' HB1' ' A' ' 33' ' ' ALA . 0.3 OUTLIER -59.44 -44.59 92.9 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.187 -0.946 . . . . 0.0 109.53 179.694 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.466 HD23 ' HA ' ' A' ' 49' ' ' LEU . 20.8 mt -59.41 -35.97 74.97 Favored 'General case' 0 N--CA 1.508 2.449 0 C-N-CA 119.318 -0.953 . . . . 0.0 110.296 -179.736 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.536 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.1 m0 -54.0 -38.62 65.28 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 120.885 -1.135 . . . . 0.0 109.52 179.195 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -67.83 -37.27 81.71 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.328 -0.857 . . . . 0.0 109.553 178.817 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 1.141 HG23 HD11 ' A' ' 30' ' ' LEU . 16.6 mt -66.97 -42.84 89.27 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.329 0 O-C-N 121.038 -1.039 . . . . 0.0 109.42 179.604 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.457 ' CE ' ' HB3' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -68.68 -29.44 67.9 Favored 'General case' 0 N--CA 1.502 2.166 0 C-N-CA 118.66 -1.216 . . . . 0.0 109.864 179.285 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.427 ' N ' ' HG3' ' A' ' 53' ' ' MET . 23.4 mt-30 -66.24 -37.69 86.12 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.997 -1.065 . . . . 0.0 109.282 178.896 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.714 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.6 mt -52.77 -32.83 45.68 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.013 -1.054 . . . . 0.0 109.959 179.187 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.435 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 8.4 t60 -56.93 -37.27 71.25 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.058 -1.026 . . . . 0.0 109.966 179.247 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.44 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 5.5 m170 -59.42 -49.35 78.15 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.097 -1.002 . . . . 0.0 109.103 179.215 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -58.78 -35.99 73.69 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.305 -0.872 . . . . 0.0 109.43 178.856 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.459 ' HD3' ' CD1' ' A' ' 26' ' ' PHE . 32.6 mmm-85 -62.81 -51.98 64.97 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.159 -0.963 . . . . 0.0 109.078 178.978 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.443 ' HA ' ' HB1' ' A' ' 87' ' ' ALA . 92.9 p -63.7 -39.23 93.79 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.237 -0.914 . . . . 0.0 109.127 179.262 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 58.7 ttt-85 -64.48 -37.88 89.06 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 121.094 -1.004 . . . . 0.0 109.634 179.195 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.778 ' CE2' HG21 ' A' ' 22' ' ' THR . 48.3 t80 -62.3 -49.54 75.22 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.075 -1.016 . . . . 0.0 109.485 179.528 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.905 HD12 ' HB2' ' A' ' 87' ' ' ALA . 86.9 mt -75.43 -40.62 42.25 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.328 0 O-C-N 121.168 -0.957 . . . . 0.0 109.313 179.382 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.481 ' CE1' HG23 ' A' ' 92' ' ' ILE . 38.6 t80 -63.03 -22.06 66.59 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.202 -0.937 . . . . 0.0 110.551 178.758 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 87.4 m -90.78 -35.51 14.81 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 120.665 -1.272 . . . . 0.0 110.39 179.751 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.531 ' C ' HD12 ' A' ' 66' ' ' LEU . 3.7 pp -82.87 -31.95 27.67 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.917 -1.114 . . . . 0.0 112.207 -179.246 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.467 ' N ' HD12 ' A' ' 66' ' ' LEU . 40.3 t80 -86.13 -38.01 18.18 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 120.657 -1.277 . . . . 0.0 111.271 -179.477 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.403 ' CD2' ' CD1' ' A' ' 64' ' ' TYR . 17.2 m-85 -89.65 -21.93 22.53 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.896 -1.128 . . . . 0.0 112.614 -178.663 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.7 mttm -119.58 -61.07 1.66 Allowed 'General case' 0 N--CA 1.501 2.093 0 O-C-N 120.466 -1.396 . . . . 0.0 111.211 -179.671 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.408 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 0.2 OUTLIER -58.81 -30.65 67.78 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.113 -0.992 . . . . 0.0 110.808 -179.502 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.0 ttmm 57.28 41.59 26.48 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 120.852 -1.155 . . . . 0.0 110.023 -179.498 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.14 35.64 3.87 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.425 -0.797 . . . . 0.0 109.871 179.288 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.81 HG13 HD23 ' A' ' 77' ' ' LEU . 14.1 tt -155.29 162.14 1.89 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.197 -0.939 . . . . 0.0 109.918 -179.975 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.1 148.92 30.09 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.105 -0.997 . . . . 0.0 110.245 179.966 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -46.38 -32.29 3.12 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 121.35 -0.843 . . . . 0.0 111.553 179.97 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -62.02 -50.55 71.57 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 120.843 -1.16 . . . . 0.0 109.349 179.427 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.81 HD23 HG13 ' A' ' 73' ' ' ILE . 54.4 tp -66.37 -45.4 80.25 Favored 'General case' 0 N--CA 1.506 2.336 0 C-N-CA 119.141 -1.024 . . . . 0.0 108.465 178.818 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.588 ' HA ' HD12 ' A' ' 81' ' ' LEU . 18.4 t80 -59.78 -38.26 81.36 Favored 'General case' 0 N--CA 1.506 2.331 0 C-N-CA 119.694 -0.802 . . . . 0.0 109.551 179.112 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -73.75 -42.43 61.11 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.102 -0.999 . . . . 0.0 108.764 178.726 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.663 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 72.1 t90 -57.88 -36.12 71.93 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.228 -0.92 . . . . 0.0 109.772 178.943 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.588 HD12 ' HA ' ' A' ' 78' ' ' TYR . 11.9 mt -69.56 -50.28 46.29 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.119 -0.988 . . . . 0.0 108.84 179.213 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.448 HG21 ' HG3' ' A' ' 89' ' ' LYS . 35.5 mm -57.16 -30.88 35.88 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.639 0 O-C-N 121.205 -0.934 . . . . 0.0 110.117 179.362 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -89.18 -20.87 23.68 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 120.886 -1.134 . . . . 0.0 112.159 -179.549 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.45 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 77.9 mm-40 -101.63 22.19 13.17 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 120.659 -1.276 . . . . 0.0 112.08 -179.767 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 73.46 77.75 0.13 Allowed 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.05 -1.031 . . . . 0.0 111.659 179.079 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.516 ' HE2' HD13 ' A' ' 23' ' ' LEU . 29.0 m-85 -134.64 -64.71 0.66 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.553 -0.717 . . . . 0.0 109.468 179.721 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.905 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -120.63 -174.06 2.72 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.378 -0.826 . . . . 0.0 109.513 179.336 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.435 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 5.9 t0 -124.7 102.86 7.8 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.165 -0.96 . . . . 0.0 110.348 -179.878 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.448 ' HG3' HG21 ' A' ' 82' ' ' ILE . 4.2 mmmt -60.22 -40.28 89.6 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.226 -0.921 . . . . 0.0 109.806 179.646 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.2 tp -60.33 -37.85 81.89 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 121.204 -0.935 . . . . 0.0 110.045 179.829 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.689 HD21 ' CH2' ' A' ' 95' ' ' TRP . 45.2 tp -70.63 -49.3 49.01 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.078 -1.014 . . . . 0.0 108.813 179.179 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.481 HG23 ' CE1' ' A' ' 64' ' ' TYR . 34.5 mt -59.0 -34.03 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 121.255 -0.903 . . . . 0.0 109.098 178.556 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.12 -46.64 76.84 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.089 -1.007 . . . . 0.0 109.356 178.933 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.512 ' HD3' HD23 ' A' ' 106' ' ' LEU . 10.9 mttp -60.5 -44.36 96.06 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.129 -0.982 . . . . 0.0 109.804 179.32 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.689 ' CH2' HD21 ' A' ' 91' ' ' LEU . 3.3 m0 -58.66 -28.66 65.92 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.086 -1.009 . . . . 0.0 109.966 178.926 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.405 ' CD ' ' OH ' ' A' ' 64' ' ' TYR . 0.0 OUTLIER -99.69 22.53 10.81 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 120.939 -1.101 . . . . 0.0 110.886 178.676 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -109.41 -174.28 2.47 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.732 -1.23 . . . . 0.0 109.851 179.366 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 29.2 m -104.6 137.8 41.9 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.214 -0.929 . . . . 0.0 109.441 179.149 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 102.2 -25.77 26.6 Favored Glycine 0 N--CA 1.493 2.496 0 C-N-CA 119.815 -1.184 . . . . 0.0 110.2 -179.004 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.679 ' HB3' HD23 ' A' ' 103' ' ' LEU . 73.4 m-85 -92.37 58.63 3.25 Favored 'General case' 0 N--CA 1.504 2.258 0 CA-C-N 119.009 1.404 . . . . 0.0 109.994 179.771 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -72.88 -37.64 67.26 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.006 -1.059 . . . . 0.0 110.2 179.909 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.87 82.67 2.1 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.039 -1.038 . . . . 0.0 110.47 179.949 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.679 HD23 ' HB3' ' A' ' 100' ' ' TYR . 0.6 OUTLIER -119.71 148.36 43.48 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.168 -0.958 . . . . 0.0 110.349 179.759 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.44 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.1 p -113.03 -26.66 8.37 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.163 -0.96 . . . . 0.0 113.374 -179.516 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.671 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 11.4 m -143.48 -167.31 2.54 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 120.068 -1.645 . . . . 0.0 109.642 179.065 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.512 HD23 ' HD3' ' A' ' 94' ' ' LYS . 14.4 mt -97.15 -38.28 9.78 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.103 -0.998 . . . . 0.0 110.306 179.224 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 22.7 ttt85 -102.98 31.83 4.02 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 120.893 -1.129 . . . . 0.0 109.678 178.153 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.671 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.308 1.7 t -127.71 16.53 6.93 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.154 -0.966 . . . . 0.0 108.953 -179.257 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.491 HG22 ' HG3' ' A' ' 123' ' ' ARG . 1.1 pt -159.25 38.06 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 120.947 -1.095 . . . . 0.0 110.628 -178.545 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.511 ' C ' HG23 ' A' ' 119' ' ' THR . 1.5 mm-40 -113.52 129.11 56.62 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 120.749 -1.22 . . . . 0.0 111.321 -178.49 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 4.5 ptpt -126.62 161.77 27.28 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.2 -0.937 . . . . 0.0 110.215 179.36 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -149.92 -57.4 0.19 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.161 -0.962 . . . . 0.0 110.713 179.945 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -133.84 -166.82 1.84 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.086 -1.009 . . . . 0.0 110.113 -179.943 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 80.9 p -94.93 -37.29 11.24 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.143 -0.973 . . . . 0.0 110.532 179.825 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -105.69 144.06 32.97 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.012 -1.055 . . . . 0.0 109.975 179.747 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 53.5 49.14 20.18 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 120.996 -1.065 . . . . 0.0 110.613 -179.78 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -92.4 -167.64 39.72 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 -180.0 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 66.1 m -148.2 60.16 1.1 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.202 -1.175 . . . . 0.0 110.506 -179.881 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.511 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.9 OUTLIER -119.65 172.85 7.38 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.078 -1.014 . . . . 0.0 110.26 179.755 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.415 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 48.9 t -106.7 155.02 20.11 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.405 -0.81 . . . . 0.0 109.531 179.231 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.783 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -72.74 -35.72 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.395 0 O-C-N 121.081 -1.012 . . . . 0.0 111.255 -179.172 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.491 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 11.0 p -54.21 -31.86 54.2 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.805 -1.185 . . . . 0.0 111.298 -178.861 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.491 ' HG3' HG22 ' A' ' 109' ' ' ILE . 6.7 ttp85 -58.22 -32.86 68.71 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 120.929 -1.107 . . . . 0.0 109.798 178.375 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 60.8 t -81.87 125.24 78.21 Favored Pre-proline 0 N--CA 1.506 2.328 0 O-C-N 121.124 -0.985 . . . . 0.0 109.923 179.68 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.541 ' HD3' ' HB1' ' A' ' 154' ' ' ALA . 39.0 Cg_endo -66.65 178.99 2.35 Favored 'Trans proline' 0 N--CA 1.488 1.152 0 O-C-N 123.097 1.051 . . . . 0.0 110.551 179.407 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -75.17 -37.77 61.15 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.184 -0.948 . . . . 0.0 110.513 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.06 -41.12 82.64 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.001 -1.062 . . . . 0.0 110.097 -179.732 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -66.91 -41.78 86.5 Favored 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.319 179.494 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.572 HD11 HD11 ' A' ' 121' ' ' ILE . 2.4 mt -63.27 -39.97 96.09 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.226 -0.922 . . . . 0.0 109.693 179.561 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -60.1 -38.31 82.58 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.19 -0.943 . . . . 0.0 109.993 179.782 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -57.79 -36.12 71.75 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.072 -1.018 . . . . 0.0 110.381 179.802 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.36 -49.56 73.39 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.072 -1.017 . . . . 0.0 109.754 179.902 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.704 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -62.11 -38.95 90.85 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.148 -0.97 . . . . 0.0 109.797 179.754 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 43.4 ttp85 -66.78 -35.53 80.31 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.155 -0.966 . . . . 0.0 110.452 179.771 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 25.4 mttm -86.84 -35.04 19.28 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.048 -1.032 . . . . 0.0 110.479 179.86 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 16.8 mttm -80.96 -22.55 39.46 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.086 -1.009 . . . . 0.0 111.472 179.692 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.83 32.91 9.48 Favored Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.673 -1.371 . . . . 0.0 109.673 -179.537 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.704 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.1 t -135.9 -161.22 1.13 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.054 -1.262 . . . . 0.0 109.792 179.946 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -130.85 143.08 50.47 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.07 -1.018 . . . . 0.0 109.959 179.944 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.491 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.1 p -129.85 160.2 41.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.216 -0.927 . . . . 0.0 110.373 -179.981 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 43.6 t -169.94 87.83 0.15 Allowed 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.261 -0.9 . . . . 0.0 111.031 179.96 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.748 ' CG ' HD12 ' A' ' 121' ' ' ILE . 62.3 t80 -99.68 159.81 14.77 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.187 -0.945 . . . . 0.0 110.491 -179.882 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -138.26 -59.76 0.63 Allowed 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 179.015 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -139.47 151.07 45.9 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.341 -0.849 . . . . 0.0 109.05 178.778 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 29.7 p -91.73 154.49 18.93 Favored 'General case' 0 N--CA 1.505 2.282 0 C-N-CA 119.05 -1.06 . . . . 0.0 111.093 -179.502 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.9 p -72.58 -26.26 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 O-C-N 121.379 -0.826 . . . . 0.0 111.57 -179.455 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -51.05 -51.74 50.23 Favored 'General case' 0 N--CA 1.516 2.839 0 O-C-N 120.764 -1.21 . . . . 0.0 110.195 -179.955 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.536 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 31.8 p -135.0 -169.03 2.28 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.237 -0.914 . . . . 0.0 111.121 179.764 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -98.39 60.97 0.9 Allowed Glycine 0 N--CA 1.491 2.329 0 N-CA-C 107.756 -2.138 . . . . 0.0 107.756 178.366 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 20.8 t -100.98 143.24 31.36 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.39 -1.065 . . . . 0.0 109.971 -179.021 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 50.5 mtm-85 -97.16 51.94 1.12 Allowed 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.237 -0.914 . . . . 0.0 109.308 179.046 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.41 96.72 0.03 OUTLIER Glycine 0 N--CA 1.487 2.095 0 N-CA-C 109.746 -1.342 . . . . 0.0 109.746 -179.726 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.0 p -106.65 125.24 50.76 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.19 -1.182 . . . . 0.0 110.258 179.67 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . 0.541 ' HB1' ' HD3' ' A' ' 125' ' ' PRO . . . -149.28 151.3 33.97 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.199 -0.938 . . . . 0.0 110.162 -179.622 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 4.9 m -97.09 -40.68 8.71 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.326 -0.859 . . . . 0.0 110.48 -179.892 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 3.3 m -58.31 -39.43 79.33 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 121.081 -1.012 . . . . 0.0 110.408 -179.961 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 . . . . . 0 N--CA 1.494 1.769 0 CA-C-O 117.962 -1.018 . . . . 0.0 110.147 179.976 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.256 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -110.28 -158.65 16.76 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.944 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.64 154.96 50.98 Favored Pre-proline 0 N--CA 1.493 1.702 0 O-C-N 121.151 -1.205 . . . . 0.0 110.32 179.901 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.71 134.03 21.31 Favored 'Trans proline' 0 C--N 1.318 -1.075 0 O-C-N 123.396 1.208 . . . . 0.0 110.467 179.991 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.4 ttm-85 -120.82 84.47 2.23 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.196 -0.94 . . . . 0.0 110.23 179.995 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 83.8 mt -131.17 139.85 49.95 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.15 -0.969 . . . . 0.0 110.0 -179.925 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.2 tptt -129.46 120.44 25.45 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.287 -0.883 . . . . 0.0 110.216 -179.998 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.7 p -130.43 132.72 45.86 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.227 -0.921 . . . . 0.0 110.265 179.977 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.42 94.28 4.49 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.287 -0.883 . . . . 0.0 110.241 -179.99 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 mmt85 -117.46 140.13 50.0 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.185 -0.947 . . . . 0.0 110.209 179.895 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.6 m -135.85 -175.14 3.86 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.149 -0.969 . . . . 0.0 110.191 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.4 pttt -152.58 61.0 3.66 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.201 -0.937 . . . . 0.0 110.713 -179.941 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -72.14 158.93 51.14 Favored 'Trans proline' 0 C--N 1.317 -1.113 0 O-C-N 123.226 1.119 . . . . 0.0 110.482 179.82 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.66 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -85.53 143.31 38.44 Favored Pre-proline 0 N--CA 1.504 2.273 0 O-C-N 121.284 -0.885 . . . . 0.0 109.781 179.738 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.403 ' HG2' HD13 ' A' ' 77' ' ' LEU . 45.0 Cg_endo -71.49 162.52 42.0 Favored 'Trans proline' 0 C--N 1.317 -1.081 0 O-C-N 123.273 1.144 . . . . 0.0 110.801 -179.611 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -48.96 -31.76 7.95 Favored 'General case' 0 N--CA 1.515 2.803 0 O-C-N 121.433 -0.792 . . . . 0.0 111.318 -179.874 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.0 -35.11 39.96 Favored Glycine 0 N--CA 1.499 2.873 0 O-C-N 120.951 -1.093 . . . . 0.0 110.388 179.801 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -54.88 -32.44 60.86 Favored 'General case' 0 N--CA 1.512 2.664 0 O-C-N 121.013 -1.286 . . . . 0.0 110.617 179.626 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -54.11 -37.86 64.76 Favored 'General case' 0 N--CA 1.512 2.662 0 O-C-N 121.01 -1.056 . . . . 0.0 110.244 179.823 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.6 mmtp -58.86 -37.93 77.61 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.28 -0.887 . . . . 0.0 110.107 179.59 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.887 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.0 pt -114.4 33.51 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 O-C-N 121.237 -0.914 . . . . 0.0 110.544 179.458 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.423 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 5.7 tmtt? -83.6 -43.57 0.81 Allowed Pre-proline 0 N--CA 1.508 2.466 0 O-C-N 121.005 -1.059 . . . . 0.0 113.019 -179.171 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.4 Cg_endo -76.63 -35.6 1.98 Allowed 'Trans proline' 0 N--CA 1.486 1.069 0 O-C-N 122.545 0.76 . . . . 0.0 111.434 -178.485 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.773 HG21 ' CE2' ' A' ' 62' ' ' TYR . 91.5 m -59.22 -42.32 90.71 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 120.98 -1.075 . . . . 0.0 110.042 -179.752 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.887 HD12 ' O ' ' A' ' 19' ' ' ILE . 4.3 mt -65.73 -40.51 92.23 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.225 -0.922 . . . . 0.0 109.574 179.516 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -59.58 -35.87 75.13 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.145 -0.972 . . . . 0.0 110.048 179.287 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -56.49 -36.4 69.1 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 121.019 -1.05 . . . . 0.0 110.315 179.707 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.52 ' CE1' HD12 ' A' ' 55' ' ' LEU . 12.1 m-85 -57.39 -35.76 70.42 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.162 -0.961 . . . . 0.0 110.877 -179.964 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -61.62 -38.56 88.1 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.092 -1.005 . . . . 0.0 111.006 -179.145 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.414 ' H ' HD12 ' A' ' 28' ' ' ILE . 2.9 mp -62.82 -39.36 84.63 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.499 0 C-N-CA 119.038 -1.065 . . . . 0.0 109.35 -179.989 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.5 tp60 -68.82 -54.63 14.69 Favored 'General case' 0 N--CA 1.506 2.366 0 C-N-CA 119.106 -1.037 . . . . 0.0 108.661 178.9 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.833 HD21 HG23 ' A' ' 52' ' ' ILE . 0.1 OUTLIER -58.72 -33.96 70.8 Favored 'General case' 0 N--CA 1.511 2.616 0 O-C-N 121.193 -0.942 . . . . 0.0 109.342 178.407 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -57.8 -41.94 83.17 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.004 -1.06 . . . . 0.0 109.98 179.655 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 -63.18 -49.91 72.41 Favored 'General case' 0 N--CA 1.508 2.453 0 C-N-CA 119.135 -1.026 . . . . 0.0 109.411 -179.982 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.486 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -64.78 -40.22 94.91 Favored 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 119.306 -0.958 . . . . 0.0 109.179 179.051 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -58.38 -34.16 70.41 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.238 -0.914 . . . . 0.0 110.348 179.707 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 17.5 mmtm -93.59 -38.68 11.24 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.048 -1.032 . . . . 0.0 110.45 179.879 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -58.23 -34.64 70.64 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.139 -0.976 . . . . 0.0 110.531 179.992 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.8 ttpp -83.01 -37.13 24.38 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 120.959 -1.088 . . . . 0.0 110.457 179.992 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.8 p -74.53 -37.93 62.91 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.092 -1.005 . . . . 0.0 110.23 179.819 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 43.8 m -71.42 -38.87 71.37 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.104 -0.997 . . . . 0.0 110.042 179.743 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -113.75 128.28 56.36 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.145 -0.972 . . . . 0.0 110.157 179.814 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.6 tp -129.81 58.26 1.65 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.206 -0.934 . . . . 0.0 110.231 -179.9 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -138.8 -65.27 0.5 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.122 -0.987 . . . . 0.0 110.232 179.954 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -126.48 169.73 12.72 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.246 -0.909 . . . . 0.0 110.238 179.996 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.1 ttpt 52.71 55.58 8.82 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.082 -1.012 . . . . 0.0 110.758 179.97 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 43.1 m -111.31 -53.94 2.65 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.244 -0.91 . . . . 0.0 110.364 179.958 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.402 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 85.8 m-20 -56.82 -39.79 74.82 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.169 -0.957 . . . . 0.0 109.951 179.739 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -60.15 -39.29 85.83 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.243 -0.911 . . . . 0.0 109.98 179.633 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 35.5 tp60 -63.76 -46.56 84.74 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.146 -0.971 . . . . 0.0 109.788 179.858 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.522 HD23 HD12 ' A' ' 52' ' ' ILE . 51.0 mt -60.88 -35.08 75.69 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.188 -0.945 . . . . 0.0 110.339 179.94 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.441 ' CE3' ' HA2' ' A' ' 149' ' ' GLY . 41.2 m0 -58.31 -39.64 79.93 Favored 'General case' 0 N--CA 1.511 2.579 0 O-C-N 120.973 -1.079 . . . . 0.0 109.675 179.623 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.813 ' O ' HD22 ' A' ' 55' ' ' LEU . 21.6 tt0 -63.62 -33.15 74.98 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 119.165 -1.014 . . . . 0.0 109.334 178.186 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.833 HG23 HD21 ' A' ' 30' ' ' LEU . 66.9 mt -70.6 -58.52 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.247 0 O-C-N 121.054 -1.029 . . . . 0.0 109.301 179.303 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.01 -25.18 63.44 Favored 'General case' 0 N--CA 1.511 2.616 0 C-N-CA 118.309 -1.356 . . . . 0.0 110.15 178.77 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.4 mm-40 -65.6 -38.84 90.62 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.795 -1.191 . . . . 0.0 109.396 178.495 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.813 HD22 ' O ' ' A' ' 51' ' ' GLU . 0.2 OUTLIER -54.86 -32.56 60.86 Favored 'General case' 0 N--CA 1.512 2.675 0 O-C-N 120.952 -1.093 . . . . 0.0 110.084 179.308 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.437 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 13.7 t60 -57.5 -40.83 79.54 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.013 -1.054 . . . . 0.0 110.052 -179.666 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.55 ' NE2' HD21 ' A' ' 91' ' ' LEU . 4.8 m170 -64.23 -53.17 53.3 Favored 'General case' 0 N--CA 1.508 2.444 0 C-N-CA 119.338 -0.945 . . . . 0.0 109.342 179.33 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 5.2 tp60 -57.24 -35.08 69.26 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.265 -0.897 . . . . 0.0 109.878 179.547 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.449 ' HG2' ' CE1' ' A' ' 26' ' ' PHE . 1.1 mmt85 -66.44 -49.25 67.32 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.179 -0.951 . . . . 0.0 109.28 179.157 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 84.0 p -64.26 -40.3 95.72 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.187 -0.945 . . . . 0.0 109.152 179.216 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.42 ' O ' ' OG1' ' A' ' 65' ' ' THR . 11.8 ttt85 -62.4 -39.65 93.94 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.155 -0.966 . . . . 0.0 109.413 179.076 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.773 ' CE2' HG21 ' A' ' 22' ' ' THR . 34.2 t80 -62.14 -51.2 68.81 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.094 -1.003 . . . . 0.0 109.431 179.403 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.992 HD12 ' HB2' ' A' ' 87' ' ' ALA . 79.5 mt -70.3 -36.98 69.56 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.341 0 O-C-N 121.18 -0.95 . . . . 0.0 109.449 179.342 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.441 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 10.2 t80 -67.09 -42.26 84.91 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.03 -1.044 . . . . 0.0 108.933 178.97 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.42 ' OG1' ' O ' ' A' ' 61' ' ' ARG . 89.4 m -60.72 -41.08 94.56 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.177 -0.952 . . . . 0.0 110.181 179.91 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.617 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.8 pp -83.1 -36.72 24.61 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.997 -1.064 . . . . 0.0 112.407 -179.081 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.608 ' N ' HD12 ' A' ' 66' ' ' LEU . 51.6 t80 -86.7 -35.06 19.5 Favored 'General case' 0 N--CA 1.512 2.641 0 O-C-N 120.519 -1.363 . . . . 0.0 111.817 -179.508 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.441 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 6.9 m-85 -98.3 -3.51 37.07 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 120.851 -1.155 . . . . 0.0 113.2 -178.474 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.91 -58.98 0.61 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.326 -1.484 . . . . 0.0 110.762 179.502 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.412 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 9.5 ttt85 -62.89 -29.54 70.84 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.048 -1.032 . . . . 0.0 110.722 179.987 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.7 mttt 60.16 43.71 13.77 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.801 -1.187 . . . . 0.0 109.966 -179.569 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.16 37.47 3.67 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.322 -0.861 . . . . 0.0 109.806 179.322 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.769 HG13 HD23 ' A' ' 77' ' ' LEU . 14.4 tt -156.95 162.64 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.165 -0.959 . . . . 0.0 110.221 -179.821 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -110.82 147.97 33.38 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.19 -0.944 . . . . 0.0 110.09 179.554 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -45.17 -32.68 1.95 Allowed 'General case' 0 N--CA 1.517 2.878 0 O-C-N 121.361 -0.837 . . . . 0.0 111.7 -179.779 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -62.14 -49.82 74.34 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 120.978 -1.076 . . . . 0.0 109.494 179.685 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.769 HD23 HG13 ' A' ' 73' ' ' ILE . 31.3 tp -66.54 -46.44 76.1 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.14 -1.024 . . . . 0.0 108.688 179.052 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.443 ' HB2' ' CD2' ' A' ' 67' ' ' TYR . 18.9 t80 -60.65 -37.26 80.94 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.3 -0.875 . . . . 0.0 109.535 179.143 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -72.78 -42.76 63.62 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.06 -1.025 . . . . 0.0 108.936 178.986 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.66 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 79.8 t90 -58.48 -36.43 73.72 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.312 -0.867 . . . . 0.0 109.757 179.094 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.678 HD22 ' CD2' ' A' ' 86' ' ' TYR . 30.7 mt -69.28 -47.45 64.56 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.079 -1.013 . . . . 0.0 109.037 179.45 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.2 mm -57.68 -32.91 43.67 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.588 0 O-C-N 121.18 -0.95 . . . . 0.0 110.151 179.231 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.33 -22.33 28.54 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 120.951 -1.093 . . . . 0.0 111.747 -179.886 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.439 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 10.5 mm-40 -100.35 20.29 15.08 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 120.752 -1.217 . . . . 0.0 112.046 179.956 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 71.3 tttt 72.7 83.06 0.13 Allowed 'General case' 0 N--CA 1.51 2.536 0 O-C-N 120.974 -1.079 . . . . 0.0 111.29 179.393 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.678 ' CD2' HD22 ' A' ' 81' ' ' LEU . 28.0 m-85 -139.32 -63.69 0.51 Allowed 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.509 -0.745 . . . . 0.0 110.117 -179.385 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.992 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -114.68 -171.77 1.99 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.395 -0.815 . . . . 0.0 110.147 179.877 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.437 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 21.2 t0 -123.17 102.88 8.21 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.158 -0.964 . . . . 0.0 110.263 -179.839 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.11 -40.41 74.92 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.159 -0.963 . . . . 0.0 109.892 179.753 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.695 HD23 HD13 ' A' ' 106' ' ' LEU . 20.7 tp -62.52 -46.6 87.67 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.156 -0.965 . . . . 0.0 109.611 179.71 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.581 ' HA ' HD21 ' A' ' 106' ' ' LEU . 65.9 tp -65.81 -44.88 84.33 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.261 -0.975 . . . . 0.0 108.947 179.216 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 54.1 mt -58.28 -36.5 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.508 0 O-C-N 121.149 -0.969 . . . . 0.0 108.74 178.654 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.65 -40.21 96.29 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.086 -1.009 . . . . 0.0 109.269 178.733 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.441 ' HD2' ' CZ ' ' A' ' 100' ' ' TYR . 5.2 mmtm -59.15 -47.97 83.34 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.085 -1.009 . . . . 0.0 109.393 179.295 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.9 m0 -59.13 -33.19 70.59 Favored 'General case' 0 N--CA 1.508 2.466 0 C-N-CA 119.542 -0.863 . . . . 0.0 110.301 179.591 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.36 -30.68 30.17 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.053 -1.03 . . . . 0.0 110.851 179.547 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.1 mmtt -53.69 -176.95 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.738 0 O-C-N 120.959 -1.088 . . . . 0.0 110.674 -179.972 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -103.36 134.71 46.28 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.126 -0.984 . . . . 0.0 109.699 179.207 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 95.77 11.19 55.64 Favored Glycine 0 N--CA 1.493 2.475 0 C-N-CA 120.172 -1.013 . . . . 0.0 111.094 -179.465 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.603 ' HB3' HD23 ' A' ' 103' ' ' LEU . 47.8 m-85 -117.82 71.22 0.81 Allowed 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 119.405 1.602 . . . . 0.0 109.876 179.738 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -95.21 -36.16 11.56 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.129 -0.982 . . . . 0.0 110.666 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.65 72.88 1.09 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.025 -1.047 . . . . 0.0 110.736 -179.577 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.603 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.0 OUTLIER -122.24 154.73 37.13 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.032 -1.043 . . . . 0.0 109.945 179.449 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.435 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.7 p -116.11 -31.45 5.68 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -179.15 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.614 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 8.6 m -141.71 -167.87 2.53 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 120.119 -1.613 . . . . 0.0 109.961 179.257 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.695 HD13 HD23 ' A' ' 90' ' ' LEU . 20.1 mt -95.92 -38.99 10.02 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.12 -0.987 . . . . 0.0 109.929 179.139 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -101.86 28.48 5.66 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 120.969 -1.082 . . . . 0.0 109.999 178.055 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.614 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.297 1.8 t -126.96 15.02 7.4 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.086 -1.009 . . . . 0.0 109.351 -179.631 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.474 HG23 ' O ' ' A' ' 108' ' ' CYS . 1.0 OUTLIER -159.48 37.54 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.375 0 O-C-N 120.832 -1.167 . . . . 0.0 111.018 -178.71 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.564 ' O ' HG23 ' A' ' 119' ' ' THR . 0.8 OUTLIER -130.05 142.42 50.62 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.643 -1.285 . . . . 0.0 111.652 -178.987 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.522 ' HA ' ' HG1' ' A' ' 119' ' ' THR . 18.0 ptpt -137.54 -172.26 3.18 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.198 -0.939 . . . . 0.0 110.081 179.811 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -147.97 -58.88 0.25 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.172 -0.955 . . . . 0.0 110.442 179.975 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -141.61 -162.84 1.45 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.203 -0.936 . . . . 0.0 109.918 -179.83 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 12.9 p -84.11 -38.05 21.23 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.044 -1.035 . . . . 0.0 110.14 179.79 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -111.37 155.72 22.68 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.181 -0.95 . . . . 0.0 110.037 179.789 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 53.22 49.65 19.43 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.17 -0.956 . . . . 0.0 110.684 -179.89 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -107.97 177.56 21.1 Favored Glycine 0 N--CA 1.493 2.479 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 -179.964 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 19.3 m -145.58 80.48 1.59 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.193 -1.181 . . . . 0.0 110.475 -179.961 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.564 HG23 ' O ' ' A' ' 110' ' ' GLN . 2.4 m -130.11 170.03 14.55 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.187 -0.946 . . . . 0.0 110.042 179.912 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.438 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 49.5 t -100.67 155.09 18.08 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.2 -0.937 . . . . 0.0 109.526 179.262 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.804 HD12 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -71.4 -37.07 63.47 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.37 0 O-C-N 121.102 -0.999 . . . . 0.0 110.877 -179.444 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.46 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 11.2 p -53.57 -33.36 54.52 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 120.89 -1.131 . . . . 0.0 111.22 -178.824 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.438 ' HG2' HG22 ' A' ' 109' ' ' ILE . 0.0 OUTLIER -60.61 -34.4 74.19 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.051 -1.031 . . . . 0.0 109.539 178.35 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 47.2 t -80.64 125.34 80.78 Favored Pre-proline 0 N--CA 1.504 2.271 0 O-C-N 121.131 -0.98 . . . . 0.0 109.824 179.629 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.507 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.4 Cg_endo -65.41 175.13 4.42 Favored 'Trans proline' 0 N--CA 1.489 1.229 0 O-C-N 123.181 1.095 . . . . 0.0 110.803 179.516 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.12 -36.39 61.64 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.275 -0.891 . . . . 0.0 110.791 -179.721 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.56 -40.69 79.5 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 120.992 -1.067 . . . . 0.0 110.16 -179.657 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -70.07 -41.35 74.24 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.222 179.233 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.579 ' O ' HG11 ' A' ' 140' ' ' VAL . 2.9 mt -65.7 -38.78 90.16 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.579 179.148 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -61.23 -39.35 89.95 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.175 -0.953 . . . . 0.0 109.838 179.645 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -59.75 -38.57 82.11 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.131 -0.981 . . . . 0.0 110.143 179.825 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -60.8 -44.31 97.03 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.127 -0.983 . . . . 0.0 109.917 179.996 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.454 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -61.47 -44.42 97.13 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.168 -0.957 . . . . 0.0 109.833 179.854 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.93 -34.27 71.54 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.258 -0.901 . . . . 0.0 110.288 179.663 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 24.4 mttt -75.9 -31.96 59.42 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.045 -1.035 . . . . 0.0 110.934 179.997 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.14 23.77 8.7 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 120.926 -1.108 . . . . 0.0 111.681 -179.934 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 51.59 46.62 53.36 Favored Glycine 0 N--CA 1.5 2.945 0 O-C-N 120.663 -1.273 . . . . 0.0 110.722 179.257 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.454 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.9 t -147.61 -164.92 2.12 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.092 -1.24 . . . . 0.0 110.371 179.842 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.6 mp0 -136.27 150.83 49.11 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.227 -0.921 . . . . 0.0 110.285 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.579 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.0 p -130.72 160.93 41.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 121.203 -0.935 . . . . 0.0 110.034 179.79 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 31.9 t -167.98 81.18 0.18 Allowed 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.126 -0.984 . . . . 0.0 111.233 -179.964 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.804 ' CG ' HD12 ' A' ' 121' ' ' ILE . 42.7 t80 -93.86 161.39 14.33 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.197 -0.94 . . . . 0.0 110.099 179.761 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 4.5 m80 -139.47 -60.55 0.56 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.605 -0.684 . . . . 0.0 109.175 179.065 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -132.77 152.21 51.82 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.44 -0.787 . . . . 0.0 109.198 178.967 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . 0.401 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 25.7 p -97.08 156.56 16.32 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.13 -0.981 . . . . 0.0 110.803 -179.84 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 21.3 m -76.48 -24.4 15.88 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 O-C-N 121.315 -0.866 . . . . 0.0 111.859 -179.384 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -49.83 -53.69 23.9 Favored 'General case' 0 N--CA 1.515 2.822 0 O-C-N 120.728 -1.232 . . . . 0.0 110.42 -179.733 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 25.2 p -133.88 -163.05 1.31 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.308 -0.87 . . . . 0.0 110.387 179.851 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . 0.441 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.19 63.46 0.63 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 108.209 -1.956 . . . . 0.0 108.209 178.549 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 38.4 t -104.49 144.77 31.22 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.301 -1.117 . . . . 0.0 110.068 -179.175 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 19.0 mtt85 -101.59 44.63 1.0 Allowed 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.398 -0.813 . . . . 0.0 109.509 179.275 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 76.61 95.93 0.18 Allowed Glycine 0 N--CA 1.488 2.123 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 -179.823 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.3 p -109.02 126.26 52.94 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.093 -1.239 . . . . 0.0 110.435 179.842 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -148.68 150.37 33.09 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.16 -0.962 . . . . 0.0 110.27 -179.543 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -110.97 -52.01 2.82 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.27 -0.894 . . . . 0.0 110.665 -179.747 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 15.5 m -52.74 -39.6 62.3 Favored 'General case' 0 N--CA 1.513 2.694 0 O-C-N 120.972 -1.08 . . . . 0.0 110.722 -179.655 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 N--CA 1.496 1.866 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.492 179.845 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -110.05 156.31 15.65 Favored Glycine 0 N--CA 1.493 2.456 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 179.956 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -126.43 149.31 67.18 Favored Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.123 -1.221 . . . . 0.0 110.221 -179.969 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.64 141.38 34.23 Favored 'Trans proline' 0 C--N 1.316 -1.141 0 O-C-N 123.48 1.253 . . . . 0.0 110.387 179.999 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -116.89 101.67 8.73 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.241 -0.912 . . . . 0.0 110.196 -179.956 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.515 HG23 ' O ' ' A' ' 4' ' ' ILE . 1.2 tp -143.11 64.36 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.175 -0.953 . . . . 0.0 110.14 179.952 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -143.7 65.48 1.31 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.183 -0.948 . . . . 0.0 110.262 -179.915 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 15.6 m -127.87 106.97 9.47 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.142 -0.974 . . . . 0.0 110.207 179.95 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 39.3 mtm-85 -130.67 53.05 1.99 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.138 -0.976 . . . . 0.0 110.231 179.995 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -116.52 73.31 0.85 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.136 -0.978 . . . . 0.0 110.21 179.89 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.91 -58.09 1.84 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.103 -0.998 . . . . 0.0 110.19 179.996 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.414 ' O ' ' CD1' ' A' ' 80' ' ' TRP . 0.2 OUTLIER -121.19 91.77 48.23 Favored Pre-proline 0 N--CA 1.492 1.671 0 O-C-N 121.183 -0.948 . . . . 0.0 110.233 -179.989 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -75.43 160.25 38.95 Favored 'Trans proline' 0 C--N 1.317 -1.094 0 O-C-N 123.379 1.199 . . . . 0.0 110.65 179.982 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.627 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -79.86 138.4 53.79 Favored Pre-proline 0 N--CA 1.507 2.424 0 C-N-CA 119.655 -0.818 . . . . 0.0 109.414 179.395 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -71.8 166.84 28.29 Favored 'Trans proline' 0 C--N 1.317 -1.083 0 O-C-N 123.174 1.091 . . . . 0.0 110.696 -179.617 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -47.53 -32.61 5.48 Favored 'General case' 0 N--CA 1.516 2.838 0 O-C-N 121.549 -0.719 . . . . 0.0 111.404 -179.814 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.07 -32.31 42.35 Favored Glycine 0 N--CA 1.498 2.822 0 O-C-N 121.047 -1.033 . . . . 0.0 110.571 179.636 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.554 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 26.8 t80 -52.01 -33.2 37.3 Favored 'General case' 0 N--CA 1.514 2.741 0 O-C-N 120.935 -1.332 . . . . 0.0 110.44 179.758 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -53.55 -34.99 60.26 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.108 -0.995 . . . . 0.0 110.208 179.457 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.13 -39.77 83.36 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.264 -0.897 . . . . 0.0 110.034 179.574 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.809 HD12 HD11 ' A' ' 23' ' ' LEU . 2.1 pt -113.51 34.61 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.21 -0.931 . . . . 0.0 110.497 179.658 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.426 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 7.4 tmtt? -85.02 -43.31 0.67 Allowed Pre-proline 0 N--CA 1.51 2.539 0 O-C-N 121.07 -1.019 . . . . 0.0 113.441 -178.993 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.426 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.4 Cg_endo -75.73 -36.74 1.99 Allowed 'Trans proline' 0 N--CA 1.486 1.074 0 O-C-N 122.591 0.785 . . . . 0.0 111.699 -178.134 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.606 HG21 ' CE2' ' A' ' 62' ' ' TYR . 89.4 m -60.61 -42.83 97.59 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 120.942 -1.099 . . . . 0.0 109.934 -179.737 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.809 HD11 HD12 ' A' ' 19' ' ' ILE . 84.8 mt -65.35 -39.66 92.63 Favored 'General case' 0 N--CA 1.507 2.401 0 C-N-CA 119.477 -0.889 . . . . 0.0 109.554 179.51 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -58.39 -35.85 72.65 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.138 -0.976 . . . . 0.0 110.127 179.355 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -56.63 -36.0 68.97 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.058 -1.026 . . . . 0.0 110.368 179.647 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.761 ' CD2' HD22 ' A' ' 55' ' ' LEU . 22.2 m-85 -57.72 -38.78 75.89 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.04 -1.037 . . . . 0.0 110.479 -179.965 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -63.07 -23.35 67.4 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.214 -0.929 . . . . 0.0 111.82 -179.483 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.573 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.6 mp -81.21 -33.59 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.412 0 O-C-N 120.759 -1.213 . . . . 0.0 109.827 179.659 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -82.37 -36.31 26.92 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 120.997 -1.064 . . . . 0.0 109.28 178.557 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.772 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -74.29 -31.88 62.67 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.118 -0.989 . . . . 0.0 110.102 178.843 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -68.75 -35.73 77.47 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 120.842 -1.161 . . . . 0.0 110.01 179.479 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -65.87 -41.8 91.14 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.012 -1.055 . . . . 0.0 109.428 179.583 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.612 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -67.37 -41.94 84.22 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.215 -0.928 . . . . 0.0 109.223 179.142 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.0 mm100 -58.72 -34.39 71.29 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.352 -0.843 . . . . 0.0 110.365 179.812 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.2 mtmm -92.91 -38.88 11.47 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.029 -1.045 . . . . 0.0 110.372 179.887 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.6 -39.43 84.17 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.204 -0.935 . . . . 0.0 110.011 179.847 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.631 ' HD2' HD11 ' A' ' 49' ' ' LEU . 18.5 ttpt -57.88 -38.59 76.06 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.201 -0.937 . . . . 0.0 110.284 -179.997 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.7 m -111.53 47.83 1.0 Allowed 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.153 -0.967 . . . . 0.0 110.128 -179.978 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.1 p -96.7 95.64 8.06 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.224 -0.923 . . . . 0.0 109.15 179.147 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.6 ttpt 53.33 29.31 8.46 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.018 -1.051 . . . . 0.0 110.826 -179.002 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 34.5 tp 50.28 87.05 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.868 -1.145 . . . . 0.0 110.985 179.879 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -114.24 -163.71 0.88 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.309 -0.869 . . . . 0.0 109.983 179.956 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -102.6 177.6 4.81 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.054 -1.029 . . . . 0.0 110.0 179.822 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.1 mttp 52.94 50.87 17.03 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 120.977 -1.077 . . . . 0.0 110.607 -179.75 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -98.38 -40.01 8.51 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.221 -0.924 . . . . 0.0 110.747 -179.857 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -58.71 -39.36 80.6 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.181 -0.949 . . . . 0.0 110.132 -179.889 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -60.39 -39.67 88.12 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.15 -0.969 . . . . 0.0 110.086 179.898 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 39.3 tp60 -60.85 -42.23 97.41 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.098 -1.001 . . . . 0.0 110.02 -179.948 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.661 HD23 HD12 ' A' ' 52' ' ' ILE . 12.4 mt -60.08 -38.1 81.9 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.162 -0.961 . . . . 0.0 110.436 179.988 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.51 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 52.6 m0 -57.05 -40.47 76.88 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.094 -1.003 . . . . 0.0 109.574 179.794 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -60.88 -35.47 76.7 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.321 -0.862 . . . . 0.0 109.799 179.007 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.772 HG23 ' CG ' ' A' ' 30' ' ' LEU . 73.8 mt -65.23 -51.45 65.08 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 121.109 -0.994 . . . . 0.0 109.394 179.585 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.443 ' HG3' ' N ' ' A' ' 54' ' ' GLN . 0.0 OUTLIER -64.8 -30.78 71.79 Favored 'General case' 0 N--CA 1.501 2.123 0 C-N-CA 118.65 -1.22 . . . . 0.0 109.692 179.307 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.443 ' N ' ' HG3' ' A' ' 53' ' ' MET . 5.0 mm100 -64.95 -36.79 85.52 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.089 -1.007 . . . . 0.0 109.358 178.733 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.761 HD22 ' CD2' ' A' ' 26' ' ' PHE . 13.9 mt -52.78 -33.71 50.0 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.081 -1.012 . . . . 0.0 109.928 179.217 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.43 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 19.6 t60 -56.71 -38.02 71.73 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.086 -1.009 . . . . 0.0 109.771 179.235 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.553 ' CD2' HD21 ' A' ' 91' ' ' LEU . 5.9 m170 -60.0 -49.64 76.88 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.027 -1.046 . . . . 0.0 109.048 178.999 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 26.2 tp60 -59.69 -38.17 80.82 Favored 'General case' 0 N--CA 1.505 2.31 0 C-N-CA 119.634 -0.826 . . . . 0.0 109.427 179.134 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.441 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -63.86 -48.83 75.16 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.233 -0.987 . . . . 0.0 108.879 179.03 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.454 ' HA ' ' HB1' ' A' ' 87' ' ' ALA . 92.1 p -64.58 -42.14 95.81 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.148 -0.97 . . . . 0.0 108.763 178.834 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 46.8 ttt85 -62.54 -39.83 94.86 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.185 -0.947 . . . . 0.0 109.303 178.803 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.606 ' CE2' HG21 ' A' ' 22' ' ' THR . 44.2 t80 -61.96 -49.55 75.66 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.261 -0.9 . . . . 0.0 109.386 179.494 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.83 HD12 ' HB2' ' A' ' 87' ' ' ALA . 90.2 mt -71.76 -39.16 68.14 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.36 0 O-C-N 121.26 -0.9 . . . . 0.0 109.022 179.153 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.507 ' CE1' HG23 ' A' ' 92' ' ' ILE . 40.3 t80 -62.77 -41.17 99.11 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.136 -0.977 . . . . 0.0 109.005 178.901 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 51.8 m -67.1 -38.19 85.25 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.202 -0.936 . . . . 0.0 110.793 -179.825 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.661 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.17 -36.35 24.78 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 120.949 -1.094 . . . . 0.0 112.489 -178.875 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.611 ' N ' HD12 ' A' ' 66' ' ' LEU . 66.1 t80 -86.55 -35.4 19.53 Favored 'General case' 0 N--CA 1.512 2.652 0 O-C-N 120.54 -1.35 . . . . 0.0 111.907 -179.299 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.401 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 17.2 m-85 -98.35 -3.39 37.16 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 120.873 -1.142 . . . . 0.0 113.077 -178.649 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -139.25 -60.27 0.57 Allowed 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.383 -1.448 . . . . 0.0 111.04 179.698 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.423 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 6.9 tpt85 -59.66 -29.59 68.16 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.081 -1.012 . . . . 0.0 110.754 -179.749 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.8 tttt 59.68 43.44 15.58 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.866 -1.146 . . . . 0.0 109.947 -179.609 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -117.99 37.34 4.0 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.425 -0.797 . . . . 0.0 109.925 179.401 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.661 HG21 ' CD1' ' A' ' 66' ' ' LEU . 14.2 tt -157.19 162.27 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.19 -0.944 . . . . 0.0 110.345 -179.88 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.5 t -110.7 149.46 30.45 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.184 -0.948 . . . . 0.0 109.788 179.356 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.0 ttmt -45.31 -33.11 2.28 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.273 -0.892 . . . . 0.0 111.587 -179.78 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -62.36 -49.31 76.06 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 120.928 -1.108 . . . . 0.0 109.479 179.379 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.18 -47.62 76.32 Favored 'General case' 0 N--CA 1.507 2.395 0 C-N-CA 119.149 -1.02 . . . . 0.0 108.6 178.917 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.701 ' HA ' HD12 ' A' ' 81' ' ' LEU . 18.1 t80 -60.21 -38.72 84.18 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 119.661 -0.815 . . . . 0.0 109.692 179.436 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -69.59 -42.05 74.97 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.065 -1.022 . . . . 0.0 108.825 178.766 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.627 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 67.9 t90 -58.27 -38.88 77.83 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.243 -0.911 . . . . 0.0 109.595 179.116 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.701 HD12 ' HA ' ' A' ' 78' ' ' TYR . 9.5 mt -65.65 -52.11 54.28 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.234 -0.916 . . . . 0.0 109.282 179.425 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.401 HG21 ' HG3' ' A' ' 89' ' ' LYS . 35.6 mm -59.12 -32.73 48.58 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.521 0 O-C-N 121.23 -0.919 . . . . 0.0 110.098 179.466 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 20.0 tttp -85.84 -14.3 45.43 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 120.938 -1.101 . . . . 0.0 112.032 -179.913 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.433 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 22.3 mm-40 -108.53 21.39 17.35 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 120.554 -1.341 . . . . 0.0 112.076 -179.97 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 73.25 78.4 0.14 Allowed 'General case' 0 N--CA 1.511 2.576 0 O-C-N 120.981 -1.074 . . . . 0.0 111.418 179.278 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.671 ' HE2' HD13 ' A' ' 23' ' ' LEU . 25.9 m-85 -134.04 -65.0 0.68 Allowed 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.493 -0.755 . . . . 0.0 109.808 -179.869 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.83 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -121.16 -175.61 3.1 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.304 -0.873 . . . . 0.0 109.937 179.68 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.43 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 7.9 t0 -117.3 122.08 42.92 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.145 -0.972 . . . . 0.0 110.134 179.906 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.401 ' HG3' HG21 ' A' ' 82' ' ' ILE . 12.3 mtmt -74.71 -40.57 61.25 Favored 'General case' 0 N--CA 1.506 2.37 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.725 179.742 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.578 HD12 ' CD2' ' A' ' 106' ' ' LEU . 0.1 OUTLIER -62.16 -42.96 99.76 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.157 -0.964 . . . . 0.0 109.341 179.514 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.553 HD21 ' CD2' ' A' ' 57' ' ' HIS . 22.1 tp -63.73 -48.4 77.2 Favored 'General case' 0 N--CA 1.507 2.381 0 C-N-CA 119.289 -0.964 . . . . 0.0 109.14 179.737 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.507 HG23 ' CE1' ' A' ' 64' ' ' TYR . 49.0 mt -60.95 -37.14 76.37 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.447 0 O-C-N 121.081 -1.012 . . . . 0.0 108.336 178.198 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.79 -39.55 76.53 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.125 -0.984 . . . . 0.0 108.694 177.907 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.439 ' HD2' ' CZ ' ' A' ' 100' ' ' TYR . 5.7 mmtm -58.72 -45.32 89.86 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.175 -0.953 . . . . 0.0 109.295 178.933 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.0 m0 -64.12 -35.37 80.55 Favored 'General case' 0 N--CA 1.506 2.346 0 C-N-CA 119.485 -0.886 . . . . 0.0 110.079 179.356 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.23 -29.66 34.41 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.064 -1.023 . . . . 0.0 110.71 179.369 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.8 mmtt -53.72 -176.85 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.681 0 O-C-N 121.0 -1.062 . . . . 0.0 110.607 179.802 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 36.8 m -103.66 131.83 50.46 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.137 -0.977 . . . . 0.0 109.687 179.175 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.27 9.55 50.82 Favored Glycine 0 N--CA 1.493 2.47 0 C-N-CA 120.242 -0.98 . . . . 0.0 111.053 -179.458 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.598 ' HB3' HD23 ' A' ' 103' ' ' LEU . 51.4 m-85 -118.22 71.13 0.82 Allowed 'General case' 0 N--CA 1.493 1.724 0 CA-C-N 119.459 1.629 . . . . 0.0 109.921 179.697 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -95.17 -32.41 13.07 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.087 -1.008 . . . . 0.0 110.872 179.979 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -126.55 68.42 1.23 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.923 -1.11 . . . . 0.0 110.883 -179.516 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.598 HD23 ' HB3' ' A' ' 100' ' ' TYR . 0.9 OUTLIER -116.53 155.12 29.22 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.907 -1.121 . . . . 0.0 109.85 179.225 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.432 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.8 p -115.96 -34.8 4.63 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.156 -0.965 . . . . 0.0 113.473 -178.852 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.64 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 7.0 m -139.59 -167.6 2.3 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 120.18 -1.575 . . . . 0.0 110.088 179.501 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.578 ' CD2' HD12 ' A' ' 90' ' ' LEU . 14.8 mt -96.65 -39.51 9.46 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.204 -0.935 . . . . 0.0 110.048 179.338 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -100.86 28.03 5.53 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 120.967 -1.083 . . . . 0.0 109.98 177.903 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.64 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.301 1.8 t -125.68 14.81 8.12 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.107 -0.995 . . . . 0.0 109.017 -179.707 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.472 HG22 ' HG3' ' A' ' 123' ' ' ARG . 1.1 pt -158.11 36.06 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.263 0 O-C-N 120.832 -1.168 . . . . 0.0 110.955 -178.492 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.579 ' O ' HG23 ' A' ' 119' ' ' THR . 60.7 tp60 -130.81 151.47 51.21 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 120.707 -1.246 . . . . 0.0 111.45 -178.671 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.431 ' CB ' ' OG1' ' A' ' 119' ' ' THR . 0.0 OUTLIER -133.93 156.61 47.81 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.235 -0.915 . . . . 0.0 110.377 179.634 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -131.09 162.31 30.14 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.265 -0.897 . . . . 0.0 110.328 -179.849 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -122.08 39.69 3.83 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.284 -0.885 . . . . 0.0 110.122 179.711 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -149.55 41.24 0.86 Allowed 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.208 -0.932 . . . . 0.0 110.403 -179.912 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 10.6 m120 53.8 178.02 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.151 -0.968 . . . . 0.0 110.725 -179.956 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 57.3 m-80 52.55 75.67 0.22 Allowed 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.016 -1.052 . . . . 0.0 110.821 -179.962 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 133.91 137.22 3.79 Favored Glycine 0 N--CA 1.493 2.451 0 N-CA-C 109.584 -1.407 . . . . 0.0 109.584 179.968 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 44.1 m -143.57 -173.85 4.07 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.244 -1.15 . . . . 0.0 110.316 179.958 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.579 HG23 ' O ' ' A' ' 110' ' ' GLN . 6.6 m -115.93 166.12 12.33 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.22 -0.925 . . . . 0.0 110.114 -179.982 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.427 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 37.5 t -86.19 154.7 21.13 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.273 -0.892 . . . . 0.0 109.73 179.482 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.949 HD12 ' CD1' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -76.68 -29.85 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.383 0 O-C-N 121.139 -0.976 . . . . 0.0 111.593 -179.201 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.444 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.7 p -58.01 -35.38 71.17 Favored 'General case' 0 N--CA 1.511 2.607 0 O-C-N 120.655 -1.278 . . . . 0.0 110.659 -179.163 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.472 ' HG3' HG22 ' A' ' 109' ' ' ILE . 1.2 ttt-85 -55.84 -32.92 64.04 Favored 'General case' 0 N--CA 1.513 2.686 0 O-C-N 121.023 -1.048 . . . . 0.0 110.071 178.904 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.629 HG13 ' CD ' ' A' ' 128' ' ' GLN . 60.8 t -79.44 124.6 83.93 Favored Pre-proline 0 N--CA 1.504 2.243 0 O-C-N 121.119 -0.988 . . . . 0.0 109.936 179.729 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.21 178.76 2.3 Favored 'Trans proline' 0 N--CA 1.488 1.203 0 O-C-N 123.11 1.058 . . . . 0.0 110.81 179.71 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -75.21 -36.93 61.33 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.255 -0.903 . . . . 0.0 110.574 179.979 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.17 -40.54 77.52 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 120.981 -1.074 . . . . 0.0 110.066 -179.761 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . 0.629 ' CD ' HG13 ' A' ' 124' ' ' VAL . 53.6 tt0 -69.48 -42.32 74.98 Favored 'General case' 0 N--CA 1.505 2.301 0 C-N-CA 119.402 -0.919 . . . . 0.0 109.075 179.247 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.685 HD11 HD11 ' A' ' 121' ' ' ILE . 2.9 mt -64.41 -38.79 92.25 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.52 -0.872 . . . . 0.0 109.476 179.184 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -60.13 -39.39 86.12 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.16 -0.962 . . . . 0.0 109.929 179.728 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -58.89 -38.55 79.11 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.187 -0.946 . . . . 0.0 110.263 179.903 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -63.48 -39.76 95.3 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.144 -0.973 . . . . 0.0 109.993 179.783 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -63.84 -41.95 97.71 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 121.211 -0.931 . . . . 0.0 109.82 179.891 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -60.21 -38.1 82.33 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.158 -0.964 . . . . 0.0 109.823 179.515 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -58.0 -35.37 71.13 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.132 -0.98 . . . . 0.0 110.555 179.859 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -105.08 16.63 25.51 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 120.963 -1.085 . . . . 0.0 112.061 -179.993 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 58.01 44.44 94.59 Favored Glycine 0 N--CA 1.497 2.731 0 O-C-N 120.635 -1.291 . . . . 0.0 110.174 179.448 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 7.4 t -137.83 -162.7 1.33 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.136 -1.214 . . . . 0.0 110.028 179.957 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -136.97 147.11 46.12 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.104 -0.997 . . . . 0.0 110.29 179.963 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.599 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.5 p -133.67 161.62 40.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.165 -0.959 . . . . 0.0 110.288 -179.858 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 45.6 t -164.06 111.16 1.1 Allowed 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.302 -0.874 . . . . 0.0 110.926 179.948 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.949 ' CD1' HD12 ' A' ' 121' ' ' ILE . 81.7 t80 -104.83 137.24 42.92 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.226 -0.921 . . . . 0.0 110.869 -179.783 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 11.3 m-70 -111.93 -56.76 2.35 Favored 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 178.122 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -151.71 156.03 39.5 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.5 -0.75 . . . . 0.0 109.574 179.115 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . 0.438 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 27.3 p -95.0 155.24 16.81 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.07 -1.019 . . . . 0.0 111.036 -179.553 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.9 p -72.38 -24.09 21.8 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.461 0 O-C-N 121.391 -0.818 . . . . 0.0 111.696 -179.528 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -51.79 -53.08 43.9 Favored 'General case' 0 N--CA 1.513 2.714 0 O-C-N 120.749 -1.219 . . . . 0.0 110.182 -179.918 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.51 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 28.3 p -135.41 -164.94 1.61 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.208 -0.932 . . . . 0.0 111.026 -179.997 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.39 59.42 0.71 Allowed Glycine 0 N--CA 1.491 2.315 0 N-CA-C 107.9 -2.08 . . . . 0.0 107.9 178.539 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 21.0 t -100.59 138.34 37.78 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.401 -1.058 . . . . 0.0 109.809 -179.228 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -96.44 51.58 1.19 Allowed 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.233 -0.917 . . . . 0.0 109.623 179.108 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 72.0 99.37 0.06 OUTLIER Glycine 0 N--CA 1.487 2.071 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 179.761 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 p -110.73 127.16 55.23 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.261 -1.14 . . . . 0.0 110.099 179.38 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -152.03 148.9 28.25 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.061 -1.024 . . . . 0.0 110.479 -179.391 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -112.77 -57.84 2.23 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.135 -0.978 . . . . 0.0 110.261 -179.891 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 7.8 t -165.87 43.21 0.07 Allowed 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.181 -0.949 . . . . 0.0 110.927 -179.876 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 . . . . . 0 N--CA 1.494 1.734 0 CA-C-O 118.001 -1.0 . . . . 0.0 110.21 179.983 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.234 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 75.97 78.19 0.69 Allowed Glycine 0 N--CA 1.493 2.453 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.931 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 70.9 p -135.56 55.59 13.2 Favored Pre-proline 0 N--CA 1.494 1.746 0 O-C-N 121.15 -1.206 . . . . 0.0 110.176 179.987 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.37 143.98 40.13 Favored 'Trans proline' 0 C--N 1.317 -1.115 0 O-C-N 123.323 1.17 . . . . 0.0 110.377 179.973 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.8 ptt85 -144.38 50.15 1.31 Allowed 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.237 -0.914 . . . . 0.0 110.259 -179.952 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 82.4 mt -117.58 -58.1 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.277 -0.89 . . . . 0.0 109.945 179.968 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -119.57 154.55 33.73 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.285 -0.884 . . . . 0.0 110.25 179.998 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.3 m -129.45 67.35 1.44 Allowed 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.229 -0.919 . . . . 0.0 110.193 -179.951 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.2 ttt-85 -135.89 128.45 30.62 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.181 -0.949 . . . . 0.0 110.17 179.968 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -121.66 173.98 7.1 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.178 -0.951 . . . . 0.0 110.255 -179.98 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.5 p -142.64 -164.71 1.89 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.17 -0.956 . . . . 0.0 110.263 -179.964 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.6 tmtt? 53.42 68.6 2.79 Favored Pre-proline 0 N--CA 1.501 2.108 0 O-C-N 120.972 -1.08 . . . . 0.0 110.707 -179.952 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.48 157.88 52.11 Favored 'Trans proline' 0 C--N 1.316 -1.154 0 O-C-N 123.389 1.205 . . . . 0.0 110.622 179.998 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.743 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -63.59 148.98 93.26 Favored Pre-proline 0 N--CA 1.509 2.5 0 C-N-CA 119.622 -0.831 . . . . 0.0 109.595 179.776 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -70.91 161.79 44.89 Favored 'Trans proline' 0 C--N 1.316 -1.175 0 O-C-N 123.374 1.197 . . . . 0.0 110.63 -179.928 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -48.51 -31.93 7.16 Favored 'General case' 0 N--CA 1.515 2.799 0 O-C-N 121.366 -0.833 . . . . 0.0 111.441 -179.761 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.21 -34.13 46.92 Favored Glycine 0 N--CA 1.499 2.845 0 O-C-N 120.95 -1.094 . . . . 0.0 110.588 179.939 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -54.57 -31.03 55.96 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 120.913 -1.346 . . . . 0.0 110.879 179.818 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -54.09 -37.61 64.45 Favored 'General case' 0 N--CA 1.512 2.664 0 O-C-N 120.984 -1.073 . . . . 0.0 110.169 179.756 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.2 mptt -59.11 -36.4 75.12 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.154 -0.966 . . . . 0.0 110.224 179.492 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.666 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.7 pt -116.9 36.04 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.973 0 O-C-N 121.089 -1.007 . . . . 0.0 110.527 179.705 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.434 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.6 OUTLIER -83.97 -42.71 0.77 Allowed Pre-proline 0 N--CA 1.509 2.499 0 O-C-N 121.095 -1.003 . . . . 0.0 113.264 -179.092 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.434 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.7 Cg_endo -75.95 -38.57 1.17 Allowed 'Trans proline' 0 N--CA 1.487 1.126 0 O-C-N 122.596 0.787 . . . . 0.0 111.631 -178.292 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.735 HG21 ' CE2' ' A' ' 62' ' ' TYR . 68.2 m -60.27 -43.86 95.81 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 120.991 -1.068 . . . . 0.0 109.99 -179.768 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.666 HD12 ' O ' ' A' ' 19' ' ' ILE . 2.2 mt -62.88 -37.92 88.8 Favored 'General case' 0 N--CA 1.507 2.387 0 C-N-CA 119.331 -0.947 . . . . 0.0 109.689 179.435 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 4.1 m -57.5 -37.51 73.1 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.101 -0.999 . . . . 0.0 110.24 179.627 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -58.01 -38.64 76.55 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.075 -1.015 . . . . 0.0 109.997 179.699 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.763 ' CD2' HD22 ' A' ' 55' ' ' LEU . 13.9 m-85 -57.76 -39.32 77.14 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.178 -0.951 . . . . 0.0 110.26 179.821 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.64 -22.53 65.35 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.199 -0.938 . . . . 0.0 111.668 -179.554 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.54 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.7 mp -80.22 -34.12 14.69 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.469 0 O-C-N 120.842 -1.161 . . . . 0.0 109.978 179.931 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 40.4 tt0 -81.29 -34.11 32.19 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.908 -1.12 . . . . 0.0 109.514 178.786 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.748 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -76.64 -32.7 58.17 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.062 -1.024 . . . . 0.0 109.841 178.769 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -68.76 -34.94 76.44 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 120.969 -1.082 . . . . 0.0 109.878 179.307 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.74 -41.07 79.47 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.047 -1.033 . . . . 0.0 109.647 179.564 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.468 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -65.57 -40.98 93.37 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.181 -0.95 . . . . 0.0 109.499 179.342 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 -58.33 -34.64 70.84 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.212 -0.93 . . . . 0.0 110.507 -179.996 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.37 -39.17 10.16 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 120.939 -1.101 . . . . 0.0 110.678 -179.904 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -59.44 -40.1 85.7 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 121.128 -0.982 . . . . 0.0 110.139 -179.963 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.417 ' HE2' HD11 ' A' ' 49' ' ' LEU . 0.4 OUTLIER -58.86 -40.59 84.75 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.068 -1.02 . . . . 0.0 110.085 -179.929 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 51.42 -171.48 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.046 -1.034 . . . . 0.0 110.943 179.774 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.3 m -118.09 -57.66 2.07 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.237 -0.914 . . . . 0.0 110.269 -179.898 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.3 mttt -120.02 78.73 1.37 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.182 -0.948 . . . . 0.0 110.224 -179.956 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.5 tt -116.2 -57.85 2.16 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.047 -1.033 . . . . 0.0 110.213 179.848 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -169.2 -66.75 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.114 -0.991 . . . . 0.0 111.044 179.902 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -168.6 -165.45 0.58 Allowed 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.105 -0.997 . . . . 0.0 110.99 -179.905 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.2 tttt 53.49 67.47 1.0 Allowed 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.041 -1.037 . . . . 0.0 110.805 179.909 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 67.1 m -111.97 -53.95 2.66 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.171 -0.955 . . . . 0.0 110.393 179.808 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -55.1 -36.87 66.15 Favored 'General case' 0 N--CA 1.512 2.652 0 O-C-N 121.19 -0.944 . . . . 0.0 110.069 179.628 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -58.98 -39.99 83.46 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.124 -0.985 . . . . 0.0 109.985 179.651 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.2 tp60 -61.49 -40.27 93.97 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.121 -0.987 . . . . 0.0 109.82 179.695 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.43 HD23 HD12 ' A' ' 52' ' ' ILE . 94.3 mt -66.51 -34.63 78.35 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.213 -0.929 . . . . 0.0 110.371 179.783 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.488 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 37.3 m0 -58.52 -36.83 74.45 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.037 -1.039 . . . . 0.0 109.449 179.703 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -66.66 -33.7 76.23 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.757 -1.214 . . . . 0.0 109.227 177.96 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.748 HG23 ' CG ' ' A' ' 30' ' ' LEU . 75.5 mt -70.33 -54.61 17.77 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 O-C-N 120.986 -1.071 . . . . 0.0 109.323 179.285 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.501 ' CE ' ' HB2' ' A' ' 148' ' ' CYS . 0.0 OUTLIER -60.71 -32.64 71.87 Favored 'General case' 0 N--CA 1.508 2.465 0 C-N-CA 118.61 -1.236 . . . . 0.0 109.54 178.868 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.38 -39.59 87.82 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 120.875 -1.14 . . . . 0.0 109.398 179.022 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.763 HD22 ' CD2' ' A' ' 26' ' ' PHE . 21.2 mt -54.59 -34.31 61.77 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.097 -1.002 . . . . 0.0 110.012 179.242 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.453 ' CE1' ' HB2' ' A' ' 88' ' ' ASP . 82.2 t60 -56.46 -40.23 74.49 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 120.991 -1.068 . . . . 0.0 109.626 179.184 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.43 ' CD2' HD21 ' A' ' 91' ' ' LEU . 7.5 m170 -61.23 -49.1 78.49 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.206 -0.934 . . . . 0.0 108.991 178.966 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -62.72 -41.01 98.95 Favored 'General case' 0 N--CA 1.504 2.249 0 C-N-CA 119.417 -0.913 . . . . 0.0 108.87 178.747 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.456 ' HD2' ' CD2' ' A' ' 26' ' ' PHE . 2.5 mtp85 -61.18 -45.9 92.7 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.247 -0.908 . . . . 0.0 109.302 179.087 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 93.2 p -65.9 -40.02 91.13 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.231 -0.918 . . . . 0.0 109.194 179.226 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 24.0 ttt85 -65.17 -38.73 91.48 Favored 'General case' 0 N--CA 1.508 2.452 0 C-N-CA 119.212 -0.995 . . . . 0.0 109.453 179.082 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.735 ' CE2' HG21 ' A' ' 22' ' ' THR . 43.0 t80 -61.21 -48.3 82.14 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.124 -0.985 . . . . 0.0 109.52 179.507 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.707 HD12 ' HB2' ' A' ' 87' ' ' ALA . 86.9 mt -76.77 -41.66 33.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.3 0 O-C-N 121.217 -0.927 . . . . 0.0 109.216 179.399 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.443 ' OH ' ' NH1' ' A' ' 96' ' ' ARG . 46.8 t80 -59.54 -31.14 69.13 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.253 -0.904 . . . . 0.0 109.831 178.71 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 59.7 m -80.67 -37.52 30.7 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 120.917 -1.115 . . . . 0.0 110.364 179.837 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.608 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -82.96 -32.44 27.1 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 120.942 -1.099 . . . . 0.0 112.512 -179.061 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.487 ' N ' HD12 ' A' ' 66' ' ' LEU . 62.1 t80 -86.52 -35.31 19.64 Favored 'General case' 0 N--CA 1.512 2.654 0 O-C-N 120.696 -1.253 . . . . 0.0 111.916 -179.207 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -98.37 -23.83 15.44 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.851 -1.156 . . . . 0.0 112.8 -178.29 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.421 ' HE2' ' CD2' ' A' ' 64' ' ' TYR . 0.7 OUTLIER -114.8 -56.45 2.38 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.617 -1.302 . . . . 0.0 111.26 -179.311 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.424 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 6.6 ttt85 -67.67 -30.65 70.24 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.067 -1.02 . . . . 0.0 110.63 -179.906 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 tttm 59.08 44.72 15.67 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 120.829 -1.169 . . . . 0.0 110.164 -179.817 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -114.24 37.05 3.47 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.307 -0.871 . . . . 0.0 109.716 179.181 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.809 HG13 HD23 ' A' ' 77' ' ' LEU . 14.6 tt -157.83 162.65 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.253 -0.904 . . . . 0.0 110.14 -179.694 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -108.74 148.89 29.81 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.098 -1.001 . . . . 0.0 110.226 179.759 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.7 tttm -46.6 -32.26 3.36 Favored 'General case' 0 N--CA 1.516 2.864 0 O-C-N 121.392 -0.818 . . . . 0.0 111.495 -179.859 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.29 -51.76 66.38 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.869 -1.145 . . . . 0.0 109.253 179.478 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.809 HD23 HG13 ' A' ' 73' ' ' ILE . 44.8 tp -65.34 -44.16 88.6 Favored 'General case' 0 N--CA 1.505 2.292 0 C-N-CA 119.19 -1.004 . . . . 0.0 108.504 178.812 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.686 ' HA ' HD12 ' A' ' 81' ' ' LEU . 18.0 t80 -59.57 -40.61 87.91 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.397 -0.814 . . . . 0.0 109.36 178.979 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -72.68 -42.95 63.7 Favored 'General case' 0 N--CA 1.504 2.249 0 C-N-CA 119.369 -0.932 . . . . 0.0 108.687 178.603 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.743 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 85.9 t90 -56.86 -35.76 69.25 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.228 -0.92 . . . . 0.0 109.432 178.462 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.686 HD12 ' HA ' ' A' ' 78' ' ' TYR . 13.9 mt -66.89 -59.43 3.53 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.159 -0.963 . . . . 0.0 108.963 178.898 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.6 mt -56.83 -27.02 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.614 0 O-C-N 120.938 -1.101 . . . . 0.0 109.99 179.577 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 6.3 mmtm -82.53 -18.54 41.12 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.793 -1.192 . . . . 0.0 111.105 178.669 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.444 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 72.4 mm-40 -108.72 23.32 14.7 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.731 -1.23 . . . . 0.0 111.968 179.983 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.413 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 2.6 tptp 76.51 71.2 0.07 Allowed 'General case' 0 N--CA 1.514 2.76 0 O-C-N 121.198 -0.939 . . . . 0.0 111.827 179.326 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.625 ' HE2' HD13 ' A' ' 23' ' ' LEU . 26.4 m-85 -133.13 -62.43 0.8 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.45 -0.781 . . . . 0.0 109.202 179.354 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.707 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -131.09 162.38 29.99 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.495 -0.753 . . . . 0.0 109.738 179.736 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.453 ' HB2' ' CE1' ' A' ' 56' ' ' HIS . 9.8 t70 -115.12 112.93 23.31 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.109 -0.995 . . . . 0.0 110.093 179.7 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 11.2 mttt -58.07 -37.17 73.94 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.212 -0.93 . . . . 0.0 110.286 -179.975 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.621 HD23 HD22 ' A' ' 106' ' ' LEU . 11.2 tp -60.61 -37.12 80.37 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.122 -0.986 . . . . 0.0 110.385 -179.734 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.43 HD21 ' CD2' ' A' ' 57' ' ' HIS . 55.2 tp -71.42 -49.11 45.07 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.998 -1.064 . . . . 0.0 108.835 179.343 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.415 ' CG2' ' CE1' ' A' ' 64' ' ' TYR . 51.7 mt -62.02 -38.93 81.99 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.307 0 O-C-N 121.124 -0.985 . . . . 0.0 108.347 178.245 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.32 -37.74 83.8 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.179 -0.95 . . . . 0.0 109.157 178.333 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.415 ' HB3' ' CD2' ' A' ' 103' ' ' LEU . 7.2 mmtm -57.89 -42.42 84.58 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.062 -1.024 . . . . 0.0 109.754 179.469 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.9 m0 -67.01 -31.65 72.35 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.231 -0.918 . . . . 0.0 110.869 -179.778 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.443 ' NH1' ' OH ' ' A' ' 64' ' ' TYR . 0.0 OUTLIER -77.39 -32.62 54.96 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.926 -1.109 . . . . 0.0 110.426 178.89 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 15.6 mmtt -54.98 -176.57 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.677 0 O-C-N 120.935 -1.103 . . . . 0.0 110.367 179.575 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 68.1 m -106.56 139.71 40.58 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.238 -0.914 . . . . 0.0 109.658 179.37 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.99 -22.05 41.98 Favored Glycine 0 N--CA 1.494 2.507 0 C-N-CA 119.83 -1.176 . . . . 0.0 110.735 -179.365 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -92.35 58.17 3.16 Favored 'General case' 0 N--CA 1.504 2.248 0 CA-C-N 119.254 1.527 . . . . 0.0 110.193 179.909 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -78.39 -38.61 41.31 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.076 -1.015 . . . . 0.0 109.865 179.39 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -113.99 79.66 1.28 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.095 -1.003 . . . . 0.0 109.753 179.664 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.953 HD13 HD13 ' A' ' 109' ' ' ILE . 14.3 tp -115.9 137.1 52.41 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.217 -0.927 . . . . 0.0 109.991 -179.49 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.423 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.9 p -108.39 -38.76 5.63 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.262 -0.899 . . . . 0.0 112.025 179.81 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.859 ' O ' HD11 ' A' ' 103' ' ' LEU . 5.4 m -139.29 -170.31 2.86 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 120.36 -1.463 . . . . 0.0 109.718 178.881 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.621 HD22 HD23 ' A' ' 90' ' ' LEU . 12.4 mt -97.88 -35.58 10.45 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 120.896 -1.128 . . . . 0.0 110.84 179.32 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 -102.49 33.69 3.06 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.819 -1.176 . . . . 0.0 109.264 177.819 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.665 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.313 1.7 t -128.48 16.42 6.52 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.186 -0.946 . . . . 0.0 108.988 -179.017 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.953 HD13 HD13 ' A' ' 103' ' ' LEU . 1.3 pt -157.91 35.94 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 120.68 -1.263 . . . . 0.0 111.114 -178.732 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.728 ' C ' HG23 ' A' ' 119' ' ' THR . 6.1 mt-30 -138.19 132.02 31.22 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 120.637 -1.29 . . . . 0.0 111.558 -178.743 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -96.68 -48.22 5.59 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.146 -0.971 . . . . 0.0 110.437 179.614 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 53.7 -167.72 0.07 Allowed 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.033 -1.042 . . . . 0.0 110.619 -179.968 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -118.04 93.91 4.31 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.213 -0.93 . . . . 0.0 110.248 -179.897 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 5.8 p -147.13 -175.52 4.86 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.142 -0.974 . . . . 0.0 110.404 -179.971 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 15.2 p-10 -130.04 37.97 3.85 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.171 -0.956 . . . . 0.0 110.406 179.805 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -153.16 93.45 1.72 Allowed 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.134 -0.979 . . . . 0.0 110.424 179.886 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 63.26 103.9 0.01 OUTLIER Glycine 0 N--CA 1.494 2.524 0 N-CA-C 109.152 -1.579 . . . . 0.0 109.152 -179.573 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 44.3 m -116.67 125.69 52.1 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.166 -1.197 . . . . 0.0 110.523 -179.581 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.728 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.2 OUTLIER 55.28 173.95 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.24 -0.913 . . . . 0.0 110.938 179.76 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.427 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 46.0 t -113.71 156.53 23.61 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.509 -0.744 . . . . 0.0 109.251 179.466 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.721 HG23 ' CE1' ' A' ' 142' ' ' PHE . 15.4 tt -75.0 -29.88 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.338 0 C-N-CA 119.097 -1.041 . . . . 0.0 111.708 -179.517 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.505 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 12.3 p -55.14 -33.56 63.02 Favored 'General case' 0 N--CA 1.514 2.746 0 O-C-N 120.444 -1.41 . . . . 0.0 109.875 -179.902 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 7.5 tpt180 -59.49 -34.01 72.05 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.042 -1.036 . . . . 0.0 108.698 176.885 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 59.3 t -68.7 116.55 41.9 Favored Pre-proline 0 N--CA 1.507 2.389 0 O-C-N 121.147 -0.971 . . . . 0.0 109.801 179.271 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -66.11 179.48 1.89 Allowed 'Trans proline' 0 N--CA 1.488 1.189 0 O-C-N 123.015 1.008 . . . . 0.0 110.597 179.1 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.9 tpt180 -75.1 -40.26 60.08 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.259 -0.901 . . . . 0.0 110.154 179.979 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.96 -41.4 91.85 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.141 -0.975 . . . . 0.0 109.945 -179.929 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -63.72 -40.82 97.7 Favored 'General case' 0 N--CA 1.507 2.394 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.724 179.761 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.449 HD22 HG21 ' A' ' 140' ' ' VAL . 12.3 mt -62.19 -40.92 97.67 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.174 -0.954 . . . . 0.0 109.696 179.665 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -57.71 -37.52 73.67 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.132 -0.98 . . . . 0.0 110.219 179.853 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -58.21 -37.49 74.92 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.045 -1.034 . . . . 0.0 110.42 179.86 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -68.37 -40.08 81.55 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.204 -0.935 . . . . 0.0 109.848 179.798 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.59 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -68.09 -38.24 82.12 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.112 -0.993 . . . . 0.0 109.968 179.59 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 29.9 mtp85 -68.07 -32.03 72.07 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.107 -0.996 . . . . 0.0 110.586 179.59 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 4.3 mtmp? -79.62 -31.19 41.63 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 120.99 -1.069 . . . . 0.0 110.992 -179.934 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 2.6 mmtt -100.57 22.94 11.04 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 120.884 -1.135 . . . . 0.0 111.761 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.08 46.92 42.03 Favored Glycine 0 N--CA 1.501 2.969 0 O-C-N 120.745 -1.222 . . . . 0.0 110.998 179.201 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.59 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.7 t -146.46 -167.65 2.8 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.095 -1.239 . . . . 0.0 110.5 179.855 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -123.61 171.11 9.79 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.304 -0.872 . . . . 0.0 110.357 -179.913 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.449 HG21 HD22 ' A' ' 129' ' ' LEU . 9.1 p -157.99 161.0 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 O-C-N 121.359 -0.838 . . . . 0.0 110.672 -179.926 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 29.4 t -169.9 100.99 0.3 Allowed 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.137 -0.977 . . . . 0.0 111.074 179.859 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.721 ' CE1' HG23 ' A' ' 121' ' ' ILE . 87.8 t80 -97.85 156.72 16.46 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.231 -0.918 . . . . 0.0 110.203 179.643 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 20.3 m80 -136.23 -61.74 0.69 Allowed 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.782 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -145.84 147.67 32.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.563 -0.711 . . . . 0.0 109.373 178.896 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . 0.436 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 29.5 p -88.33 157.04 18.85 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.074 -1.016 . . . . 0.0 111.152 -179.344 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 13.2 p -74.91 -24.1 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.403 0 O-C-N 121.319 -0.863 . . . . 0.0 111.753 -179.488 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -52.73 -44.89 66.7 Favored 'General case' 0 N--CA 1.516 2.836 0 O-C-N 120.715 -1.241 . . . . 0.0 109.274 179.559 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.501 ' HB2' ' CE ' ' A' ' 53' ' ' MET . 29.4 p -142.66 -178.89 6.0 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 121.451 -0.78 . . . . 0.0 110.564 179.619 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . 0.413 ' CA ' ' CE3' ' A' ' 50' ' ' TRP . . . -92.43 61.71 2.45 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 107.526 -2.23 . . . . 0.0 107.526 178.035 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 15.9 t -100.66 138.49 37.65 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.366 -1.079 . . . . 0.0 109.336 -179.053 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -93.27 56.43 2.48 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.163 -0.961 . . . . 0.0 109.648 179.468 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 63.17 96.71 0.01 OUTLIER Glycine 0 N--CA 1.487 2.041 0 N-CA-C 110.055 -1.218 . . . . 0.0 110.055 179.71 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 28.7 p -104.82 118.55 36.84 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.282 -1.128 . . . . 0.0 110.128 179.291 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -118.97 136.16 54.24 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.758 -1.214 . . . . 0.0 110.099 -179.433 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 1.2 m -117.12 -56.71 2.23 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.269 -0.894 . . . . 0.0 110.285 -179.969 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . 0.561 HG22 ' O ' ' A' ' 156' ' ' THR . 60.1 m -144.61 48.46 1.34 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.158 -0.964 . . . . 0.0 110.358 -179.916 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 . . . . . 0 N--CA 1.494 1.756 0 CA-C-O 117.987 -1.006 . . . . 0.0 110.194 -179.937 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.32 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -112.32 -114.02 3.31 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 -179.97 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.2 m -126.91 93.93 40.84 Favored Pre-proline 0 N--CA 1.494 1.768 0 O-C-N 121.204 -1.174 . . . . 0.0 110.221 179.978 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.67 110.14 2.94 Favored 'Trans proline' 0 C--N 1.317 -1.101 0 O-C-N 123.441 1.232 . . . . 0.0 110.453 179.996 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -116.82 162.69 17.32 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.204 -0.935 . . . . 0.0 110.184 179.986 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 6.5 tt -132.37 155.05 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.189 -0.944 . . . . 0.0 110.158 -179.928 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.47 124.63 27.38 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.253 -0.904 . . . . 0.0 110.169 179.978 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.1 t -142.88 49.32 1.48 Allowed 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.229 -0.919 . . . . 0.0 110.326 179.943 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.2 ttt-85 -141.45 119.04 11.63 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.197 -0.939 . . . . 0.0 110.128 -179.965 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -143.18 133.75 25.0 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.195 -0.941 . . . . 0.0 110.351 -179.962 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.8 p -143.03 -64.21 0.4 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.214 -0.929 . . . . 0.0 110.203 179.93 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.2 mttt -141.28 70.03 27.36 Favored Pre-proline 0 N--CA 1.494 1.744 0 O-C-N 121.209 -0.932 . . . . 0.0 110.06 179.965 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -73.12 158.67 48.88 Favored 'Trans proline' 0 C--N 1.318 -1.055 0 O-C-N 123.307 1.162 . . . . 0.0 110.815 -179.898 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.692 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -101.91 149.68 36.73 Favored Pre-proline 0 N--CA 1.5 2.036 0 O-C-N 121.486 -0.759 . . . . 0.0 109.777 179.583 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.4 ' HG2' HD13 ' A' ' 77' ' ' LEU . 44.5 Cg_endo -69.97 160.0 51.24 Favored 'Trans proline' 0 C--N 1.316 -1.166 0 O-C-N 123.353 1.186 . . . . 0.0 110.95 -179.727 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -48.96 -31.92 8.23 Favored 'General case' 0 N--CA 1.515 2.804 0 O-C-N 121.411 -0.805 . . . . 0.0 111.254 -179.821 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.94 -32.81 35.04 Favored Glycine 0 N--CA 1.498 2.819 0 O-C-N 120.997 -1.064 . . . . 0.0 110.711 179.782 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -55.24 -33.64 63.31 Favored 'General case' 0 N--CA 1.511 2.596 0 O-C-N 120.876 -1.367 . . . . 0.0 110.709 179.861 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -54.09 -37.17 63.97 Favored 'General case' 0 N--CA 1.512 2.639 0 O-C-N 121.048 -1.033 . . . . 0.0 110.313 179.772 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.5 mttt -58.58 -36.44 73.97 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.234 -0.917 . . . . 0.0 110.279 179.592 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.875 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.3 pt -116.5 36.73 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.066 -1.022 . . . . 0.0 110.524 179.747 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.427 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -83.75 -44.3 0.8 Allowed Pre-proline 0 N--CA 1.509 2.507 0 O-C-N 121.119 -0.988 . . . . 0.0 113.161 -179.087 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 47.0 Cg_endo -75.97 -36.36 2.05 Favored 'Trans proline' 0 N--CA 1.486 1.069 0 O-C-N 122.606 0.792 . . . . 0.0 111.872 -178.016 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.809 HG21 ' CE2' ' A' ' 62' ' ' TYR . 89.9 m -59.51 -41.35 89.71 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 120.926 -1.109 . . . . 0.0 110.044 -179.691 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.875 HD12 ' O ' ' A' ' 19' ' ' ILE . 4.9 mt -66.34 -40.85 90.11 Favored 'General case' 0 N--CA 1.508 2.428 0 C-N-CA 119.351 -0.94 . . . . 0.0 109.364 179.318 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.08 -34.9 70.64 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.214 -0.929 . . . . 0.0 110.221 179.4 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -56.84 -36.53 70.12 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 121.069 -1.019 . . . . 0.0 110.327 179.691 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.598 ' CD1' HD22 ' A' ' 55' ' ' LEU . 11.3 m-85 -57.84 -38.35 75.48 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.117 -0.989 . . . . 0.0 110.527 179.882 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -58.54 -34.7 71.3 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.156 -0.965 . . . . 0.0 110.648 -179.875 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.2 mp -70.14 -40.73 78.59 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.117 -0.989 . . . . 0.0 108.823 179.409 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 26.1 tp60 -69.06 -47.14 66.06 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.306 -0.958 . . . . 0.0 108.769 178.794 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.018 HD11 HG23 ' A' ' 52' ' ' ILE . 2.3 tp -60.52 -36.84 79.37 Favored 'General case' 0 N--CA 1.509 2.501 0 C-N-CA 119.401 -0.92 . . . . 0.0 109.525 178.759 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.1 -37.46 71.96 Favored 'General case' 0 N--CA 1.51 2.525 0 O-C-N 121.093 -1.004 . . . . 0.0 110.326 179.788 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -63.36 -50.36 70.23 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.194 -1.002 . . . . 0.0 109.662 -179.777 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.482 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -68.69 -40.36 80.11 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 119.058 -1.057 . . . . 0.0 109.057 178.944 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -60.94 -33.2 72.81 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.285 -0.884 . . . . 0.0 110.223 179.396 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.2 mmmt -93.83 -36.84 12.05 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.063 -1.023 . . . . 0.0 110.709 179.924 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -57.48 -35.43 70.17 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 121.097 -1.002 . . . . 0.0 110.451 -179.945 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.501 ' NZ ' HD11 ' A' ' 49' ' ' LEU . 0.5 OUTLIER -94.2 -38.86 10.84 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.1 -1.0 . . . . 0.0 110.37 179.835 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.9 m -54.32 -36.03 63.31 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 121.007 -1.058 . . . . 0.0 110.672 179.983 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.5 p -94.65 -37.33 11.37 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.124 -0.985 . . . . 0.0 110.426 179.817 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.1 tptt -107.77 106.15 16.32 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.133 -0.979 . . . . 0.0 110.069 179.745 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.405 HD12 ' CE ' ' A' ' 37' ' ' LYS . 4.1 tp -116.16 43.13 2.22 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.224 -0.922 . . . . 0.0 110.277 -179.944 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -124.2 -58.72 1.53 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.274 -0.891 . . . . 0.0 110.267 -179.966 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -117.14 149.76 39.81 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.19 -0.944 . . . . 0.0 110.282 -179.891 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.5 mptt 52.76 61.7 3.06 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.07 -1.019 . . . . 0.0 110.747 179.973 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.2 m -114.31 -57.07 2.32 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.139 -0.976 . . . . 0.0 110.088 179.865 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.3 m-80 -57.6 -40.0 78.11 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.239 -0.913 . . . . 0.0 109.752 179.611 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -60.81 -37.61 82.58 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.273 -0.892 . . . . 0.0 109.906 179.421 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.4 ' CG ' ' HA ' ' A' ' 33' ' ' ALA . 38.0 tp60 -60.15 -44.05 95.27 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 121.137 -0.977 . . . . 0.0 109.912 179.881 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.501 HD11 ' NZ ' ' A' ' 37' ' ' LYS . 83.3 mt -60.19 -38.04 82.07 Favored 'General case' 0 N--CA 1.509 2.505 0 C-N-CA 119.368 -0.933 . . . . 0.0 109.98 179.731 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.505 ' O ' ' HE3' ' A' ' 53' ' ' MET . 39.6 m0 -58.98 -34.03 71.35 Favored 'General case' 0 N--CA 1.509 2.505 0 C-N-CA 119.338 -0.945 . . . . 0.0 109.469 179.548 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -66.6 -33.47 75.73 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 120.628 -1.295 . . . . 0.0 109.443 178.073 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 1.018 HG23 HD11 ' A' ' 30' ' ' LEU . 16.5 mt -70.47 -55.37 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.234 0 O-C-N 120.971 -1.081 . . . . 0.0 109.49 179.336 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.505 ' HE3' ' O ' ' A' ' 50' ' ' TRP . 0.0 OUTLIER -58.97 -32.2 69.43 Favored 'General case' 0 N--CA 1.509 2.475 0 C-N-CA 118.763 -1.175 . . . . 0.0 109.78 179.212 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -61.09 -40.39 93.55 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.886 -1.134 . . . . 0.0 109.267 178.96 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.598 HD22 ' CD1' ' A' ' 26' ' ' PHE . 30.4 mt -55.0 -31.95 61.41 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.206 -0.934 . . . . 0.0 110.117 179.084 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.446 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 23.6 t60 -58.04 -39.64 78.93 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 120.984 -1.073 . . . . 0.0 110.038 179.645 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.442 ' CE1' ' O ' ' A' ' 104' ' ' CYS . 8.7 m170 -59.58 -47.12 86.8 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.066 -1.022 . . . . 0.0 109.224 179.329 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -62.77 -38.54 91.0 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.299 -0.876 . . . . 0.0 109.176 178.789 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.443 ' HG2' ' CE1' ' A' ' 26' ' ' PHE . 0.7 OUTLIER -62.07 -47.07 86.33 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.193 -0.942 . . . . 0.0 109.555 179.441 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 82.9 p -66.64 -40.31 88.65 Favored 'General case' 0 N--CA 1.501 2.125 0 C-N-CA 119.253 -0.979 . . . . 0.0 109.032 179.142 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -63.74 -37.65 88.16 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.261 -0.976 . . . . 0.0 109.427 178.883 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.809 ' CE2' HG21 ' A' ' 22' ' ' THR . 41.6 t80 -62.18 -52.37 64.07 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.093 -1.004 . . . . 0.0 109.372 179.522 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.841 HD12 ' HB2' ' A' ' 87' ' ' ALA . 81.1 mt -72.27 -38.64 62.41 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.38 0 C-N-CA 119.371 -0.932 . . . . 0.0 109.298 179.274 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.497 ' CD1' ' CD2' ' A' ' 68' ' ' TYR . 68.2 t80 -63.94 -37.49 87.6 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.257 -0.902 . . . . 0.0 109.645 179.001 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 80.0 m -72.06 -37.04 69.74 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 120.949 -1.094 . . . . 0.0 110.811 -179.74 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.573 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.6 pp -82.87 -31.03 28.17 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 120.894 -1.128 . . . . 0.0 112.144 -179.109 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.447 ' HD2' HG23 ' A' ' 73' ' ' ILE . 60.5 t80 -85.95 -33.97 21.0 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 120.674 -1.266 . . . . 0.0 111.663 -179.35 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.497 ' CD2' ' CD1' ' A' ' 64' ' ' TYR . 21.7 m-85 -95.97 -27.07 15.31 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.859 -1.151 . . . . 0.0 112.355 -178.77 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.2 mttt -111.92 -61.2 1.75 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.676 -1.265 . . . . 0.0 111.269 -179.626 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.407 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 0.3 OUTLIER -60.11 -31.79 70.38 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 121.037 -1.04 . . . . 0.0 110.708 -179.532 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.5 mttt 56.63 41.6 28.2 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.803 -1.186 . . . . 0.0 110.177 -179.61 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.25 36.12 3.68 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.411 -0.806 . . . . 0.0 109.882 179.123 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.703 HG13 HD23 ' A' ' 77' ' ' LEU . 14.2 tt -153.77 162.74 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.932 0 O-C-N 121.254 -0.904 . . . . 0.0 109.889 -179.825 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 4.3 m -108.15 146.96 31.96 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.064 -1.022 . . . . 0.0 110.273 179.941 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -46.7 -32.37 3.52 Favored 'General case' 0 N--CA 1.515 2.798 0 O-C-N 121.34 -0.85 . . . . 0.0 111.457 -179.938 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -61.69 -50.19 73.45 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.034 -1.041 . . . . 0.0 109.285 179.488 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.703 HD23 HG13 ' A' ' 73' ' ' ILE . 31.7 tp -67.51 -43.64 80.37 Favored 'General case' 0 N--CA 1.504 2.253 0 C-N-CA 119.091 -1.044 . . . . 0.0 108.505 178.774 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.44 ' CE1' HG22 ' A' ' 63' ' ' ILE . 13.3 t80 -60.58 -38.24 83.96 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.3 -0.875 . . . . 0.0 109.501 179.201 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.468 ' O ' HG22 ' A' ' 82' ' ' ILE . 13.6 t0 -76.17 -41.72 48.79 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.08 -1.013 . . . . 0.0 108.829 178.813 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.692 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 84.9 t90 -59.2 -38.99 81.23 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.202 -0.937 . . . . 0.0 109.226 178.795 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.509 HD11 ' HG ' ' A' ' 77' ' ' LEU . 16.5 mt -66.33 -55.56 15.37 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.198 -0.939 . . . . 0.0 109.147 179.04 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.62 HD12 ' HB3' ' A' ' 87' ' ' ALA . 0.9 OUTLIER -56.2 -27.24 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.517 0 O-C-N 121.115 -0.99 . . . . 0.0 110.644 -179.788 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.9 mttt -89.08 -20.33 24.47 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 120.917 -1.115 . . . . 0.0 111.54 179.259 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.452 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 10.5 mm-40 -101.53 23.46 11.1 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 120.764 -1.21 . . . . 0.0 111.928 179.985 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.406 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 7.3 ttmm 76.05 70.79 0.08 Allowed 'General case' 0 N--CA 1.512 2.638 0 O-C-N 121.12 -0.987 . . . . 0.0 111.872 179.347 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.503 ' HE2' HD13 ' A' ' 23' ' ' LEU . 30.3 m-85 -133.33 -62.86 0.78 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.454 -0.779 . . . . 0.0 109.075 179.214 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.841 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -128.98 -177.0 4.03 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.496 -0.752 . . . . 0.0 109.216 179.356 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.446 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 5.5 t0 -130.91 108.61 9.95 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.055 -1.028 . . . . 0.0 110.608 -179.849 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.505 ' N ' HD11 ' A' ' 82' ' ' ILE . 3.6 mtpm? -62.97 -38.09 89.72 Favored 'General case' 0 N--CA 1.508 2.425 0 C-N-CA 119.417 -0.913 . . . . 0.0 109.78 179.506 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.858 HD23 HD22 ' A' ' 106' ' ' LEU . 7.1 tp -58.57 -37.95 76.84 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.106 -0.996 . . . . 0.0 110.131 179.936 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.491 ' HA ' HD21 ' A' ' 106' ' ' LEU . 65.4 tp -71.66 -49.08 43.15 Favored 'General case' 0 N--CA 1.506 2.349 0 C-N-CA 119.148 -1.021 . . . . 0.0 108.651 179.043 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.439 HD13 ' CD1' ' A' ' 64' ' ' TYR . 61.5 mt -60.33 -36.15 67.06 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.435 0 C-N-CA 119.389 -0.924 . . . . 0.0 108.764 178.323 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.12 -38.89 75.71 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.084 -1.01 . . . . 0.0 109.01 178.283 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.427 ' HB3' ' CD2' ' A' ' 103' ' ' LEU . 6.0 mmtt -57.44 -41.75 81.07 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.079 -1.013 . . . . 0.0 109.535 179.272 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.5 m0 -68.63 -32.55 72.49 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.248 -0.907 . . . . 0.0 110.54 179.853 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.457 ' NE ' ' OH ' ' A' ' 64' ' ' TYR . 0.1 OUTLIER -82.62 -30.31 29.54 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.952 -1.092 . . . . 0.0 110.611 179.226 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.7 mmtp -54.16 -176.55 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.613 0 O-C-N 120.991 -1.068 . . . . 0.0 110.552 179.798 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -105.44 134.0 49.26 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.203 -0.935 . . . . 0.0 109.736 179.314 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.12 5.5 56.17 Favored Glycine 0 N--CA 1.493 2.456 0 C-N-CA 120.113 -1.041 . . . . 0.0 111.28 -179.54 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.412 ' CZ ' ' HD2' ' A' ' 94' ' ' LYS . 48.4 m-85 -112.83 49.86 0.91 Allowed 'General case' 0 N--CA 1.497 1.922 0 CA-C-N 119.594 1.697 . . . . 0.0 110.036 179.752 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -65.15 -39.85 93.56 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.062 -1.023 . . . . 0.0 110.027 -179.962 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.56 108.44 15.98 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.172 -0.955 . . . . 0.0 110.131 179.942 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.923 HD13 HD13 ' A' ' 109' ' ' ILE . 14.1 tp -143.65 136.09 27.05 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.187 -0.946 . . . . 0.0 110.037 -179.699 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.442 ' O ' ' CE1' ' A' ' 57' ' ' HIS . 26.6 p -110.53 -38.61 5.15 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.322 -0.861 . . . . 0.0 112.093 179.876 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.853 ' O ' HD11 ' A' ' 103' ' ' LEU . 4.6 m -138.72 -171.6 3.11 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 120.333 -1.479 . . . . 0.0 109.405 178.817 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.858 HD22 HD23 ' A' ' 90' ' ' LEU . 12.5 mt -96.59 -35.51 11.04 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.982 -1.074 . . . . 0.0 110.586 179.401 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 12.0 ttt85 -102.51 33.59 3.1 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 120.899 -1.125 . . . . 0.0 109.19 177.919 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.678 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.303 1.7 t -128.98 17.74 6.15 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.283 -0.886 . . . . 0.0 109.256 -179.109 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.923 HD13 HD13 ' A' ' 103' ' ' LEU . 1.2 pt -158.57 38.39 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 O-C-N 120.897 -1.127 . . . . 0.0 110.369 -178.905 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.632 ' C ' HG23 ' A' ' 119' ' ' THR . 19.9 mt-30 -80.55 66.45 6.06 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 120.835 -1.165 . . . . 0.0 110.718 -179.14 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.53 -44.74 5.76 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.087 -1.008 . . . . 0.0 110.435 179.632 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -56.58 -39.18 73.05 Favored 'General case' 0 N--CA 1.511 2.575 0 O-C-N 121.052 -1.03 . . . . 0.0 110.295 -179.976 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -118.52 142.7 47.34 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.188 -0.945 . . . . 0.0 110.276 179.998 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 9.8 m -136.25 71.28 1.42 Allowed 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.179 -0.951 . . . . 0.0 110.159 179.956 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -117.67 -56.51 2.2 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.127 -0.983 . . . . 0.0 110.396 -179.885 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -113.28 116.36 29.62 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.128 -0.982 . . . . 0.0 110.263 -179.988 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 91.77 -167.69 31.05 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 179.967 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 9.9 m -129.33 -165.03 1.46 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.237 -1.155 . . . . 0.0 110.082 179.99 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.632 HG23 ' C ' ' A' ' 110' ' ' GLN . 2.9 m -112.37 168.14 9.87 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.242 -0.911 . . . . 0.0 110.184 179.881 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.45 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 46.7 t -100.8 155.16 18.08 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.301 -0.875 . . . . 0.0 109.365 179.151 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.798 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -73.03 -36.26 50.5 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.324 0 O-C-N 121.105 -0.997 . . . . 0.0 110.853 -179.539 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.426 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 5.1 p -54.72 -33.03 60.5 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 120.773 -1.204 . . . . 0.0 110.989 -178.928 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -60.13 -36.64 77.93 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 120.858 -1.151 . . . . 0.0 109.414 178.368 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 57.1 t -78.53 124.9 85.28 Favored Pre-proline 0 N--CA 1.504 2.233 0 O-C-N 121.213 -0.929 . . . . 0.0 109.702 179.612 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.515 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.1 Cg_endo -64.98 175.06 4.08 Favored 'Trans proline' 0 N--CA 1.488 1.18 0 O-C-N 123.154 1.081 . . . . 0.0 110.712 179.623 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 11.1 tpp85 -75.07 -37.34 61.65 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.249 -0.907 . . . . 0.0 110.615 -179.679 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.05 -40.97 82.29 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 120.93 -1.106 . . . . 0.0 109.997 -179.704 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -68.79 -41.48 78.66 Favored 'General case' 0 N--CA 1.506 2.368 0 C-N-CA 119.325 -0.95 . . . . 0.0 109.259 179.252 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.596 HD11 HD11 ' A' ' 121' ' ' ILE . 2.8 mt -64.02 -39.18 93.53 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.295 -0.878 . . . . 0.0 109.633 179.233 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -60.98 -40.04 91.93 Favored 'General case' 0 N--CA 1.508 2.454 0 C-N-CA 119.408 -0.917 . . . . 0.0 109.929 179.765 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.93 -38.38 82.21 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.16 -0.962 . . . . 0.0 110.316 179.958 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -63.99 -43.39 95.84 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.123 -0.985 . . . . 0.0 109.981 179.937 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -64.03 -39.17 93.49 Favored 'General case' 0 N--CA 1.508 2.442 0 C-N-CA 119.373 -0.931 . . . . 0.0 109.943 179.846 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 3.8 ttt85 -68.03 -38.87 83.05 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.128 -0.982 . . . . 0.0 109.975 179.648 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 50.1 mmtt -70.9 -35.34 72.25 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.165 -0.959 . . . . 0.0 110.346 179.655 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 8.6 tttt -82.57 -17.2 45.72 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 120.994 -1.066 . . . . 0.0 111.726 179.714 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 91.5 31.22 9.71 Favored Glycine 0 N--CA 1.494 2.526 0 O-C-N 120.702 -1.249 . . . . 0.0 110.121 -179.744 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.6 t -140.94 -161.48 1.22 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.023 -1.28 . . . . 0.0 109.79 179.677 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -133.73 148.72 51.45 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.123 -0.985 . . . . 0.0 110.179 179.993 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.447 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.9 p -132.64 161.37 41.64 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.211 -0.931 . . . . 0.0 110.326 -179.879 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 31.2 t -166.62 87.87 0.33 Allowed 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.227 -0.921 . . . . 0.0 110.904 179.988 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.788 ' CG ' HD12 ' A' ' 121' ' ' ILE . 53.5 t80 -97.29 160.87 14.08 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.299 -0.875 . . . . 0.0 110.499 -179.823 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 4.5 m80 -137.61 -60.47 0.65 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.553 -0.717 . . . . 0.0 109.075 179.061 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -137.27 149.84 47.39 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.359 -0.838 . . . . 0.0 109.324 178.803 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 26.3 p -92.11 155.31 18.14 Favored 'General case' 0 N--CA 1.505 2.276 0 C-N-CA 119.219 -0.992 . . . . 0.0 110.929 -179.581 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.5 p -73.31 -26.01 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 O-C-N 121.368 -0.833 . . . . 0.0 111.539 -179.489 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -51.0 -45.84 61.31 Favored 'General case' 0 N--CA 1.516 2.849 0 O-C-N 120.784 -1.198 . . . . 0.0 109.736 179.895 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.496 ' HB2' ' CE ' ' A' ' 53' ' ' MET . 29.5 p -142.44 -179.52 6.33 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.341 -0.849 . . . . 0.0 110.766 179.733 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . 0.456 ' CA ' ' CE3' ' A' ' 50' ' ' TRP . . . -90.43 63.1 3.05 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 107.836 -2.106 . . . . 0.0 107.836 178.161 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 27.0 t -105.69 139.37 40.38 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.389 -1.065 . . . . 0.0 109.79 -178.986 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 20.4 mmt85 -92.37 56.9 2.87 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 121.165 -0.959 . . . . 0.0 109.556 179.344 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 60.51 95.22 0.01 OUTLIER Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 -179.852 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 p -103.27 126.88 50.67 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.305 -1.114 . . . . 0.0 110.33 179.693 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -142.19 141.67 32.6 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.153 -0.967 . . . . 0.0 109.919 -179.691 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -98.68 -42.17 7.36 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.189 -0.944 . . . . 0.0 110.574 -179.952 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 26.7 p -54.84 -38.11 67.01 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 120.968 -1.082 . . . . 0.0 110.582 -179.85 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 . . . . . 0 N--CA 1.494 1.757 0 CA-C-O 117.955 -1.021 . . . . 0.0 110.278 179.982 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.278 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 78.15 -137.19 19.5 Favored Glycine 0 N--CA 1.492 2.413 0 N-CA-C 109.619 -1.392 . . . . 0.0 109.619 -179.976 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 97.8 p -124.5 88.94 52.8 Favored Pre-proline 0 N--CA 1.493 1.717 0 O-C-N 121.186 -1.185 . . . . 0.0 110.235 179.962 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.6 -174.46 1.48 Allowed 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.429 1.226 . . . . 0.0 110.43 -179.998 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -140.14 111.11 6.93 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.224 -0.922 . . . . 0.0 110.189 -179.959 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 45.6 pt -136.3 150.74 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.205 -0.934 . . . . 0.0 110.255 179.976 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 8.5 mptt 52.86 -178.41 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.122 0 O-C-N 120.987 -1.071 . . . . 0.0 110.595 -179.971 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -138.76 103.05 4.73 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.208 -0.933 . . . . 0.0 110.268 179.983 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -116.71 158.14 24.31 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.206 -0.934 . . . . 0.0 110.128 179.968 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 36.6 mtt-85 -122.04 143.0 49.77 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.249 -0.907 . . . . 0.0 110.263 179.983 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -129.97 151.75 50.19 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.317 -0.864 . . . . 0.0 110.147 179.957 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.2 ttmt -130.78 82.53 64.22 Favored Pre-proline 0 N--CA 1.494 1.742 0 O-C-N 121.141 -0.974 . . . . 0.0 110.326 -179.992 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.471 ' O ' ' HB3' ' A' ' 12' ' ' ALA . 47.2 Cg_endo -73.25 157.79 49.61 Favored 'Trans proline' 0 C--N 1.318 -1.058 0 O-C-N 123.395 1.208 . . . . 0.0 110.366 179.98 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.728 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . 61.43 151.5 0.1 Allowed Pre-proline 0 N--CA 1.503 2.188 0 O-C-N 121.334 -0.854 . . . . 0.0 110.475 179.93 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.28 162.5 42.25 Favored 'Trans proline' 0 C--N 1.317 -1.109 0 O-C-N 123.225 1.118 . . . . 0.0 110.794 -179.794 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -48.87 -32.05 8.23 Favored 'General case' 0 N--CA 1.514 2.729 0 O-C-N 121.391 -0.818 . . . . 0.0 111.307 -179.784 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.83 -34.33 44.79 Favored Glycine 0 N--CA 1.499 2.88 0 O-C-N 120.994 -1.066 . . . . 0.0 110.53 179.84 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.441 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 18.0 t80 -55.06 -32.69 62.12 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 120.938 -1.33 . . . . 0.0 110.78 179.873 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -54.65 -37.84 66.19 Favored 'General case' 0 N--CA 1.513 2.69 0 O-C-N 120.933 -1.104 . . . . 0.0 110.21 179.71 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.19 -35.65 71.93 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.29 -0.882 . . . . 0.0 110.252 179.49 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.686 HD12 ' CD1' ' A' ' 23' ' ' LEU . 2.8 pt -115.7 36.05 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 121.068 -1.02 . . . . 0.0 110.563 179.65 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.441 ' HD2' ' CE2' ' A' ' 16' ' ' PHE . 3.5 tptm -82.64 -43.35 0.93 Allowed Pre-proline 0 N--CA 1.508 2.474 0 O-C-N 121.028 -1.045 . . . . 0.0 112.802 -179.506 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.435 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 45.4 Cg_endo -75.76 -37.66 1.59 Allowed 'Trans proline' 0 N--CA 1.486 1.039 0 O-C-N 122.479 0.726 . . . . 0.0 111.345 -178.393 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.865 HG21 ' CE2' ' A' ' 62' ' ' TYR . 72.4 m -61.39 -42.92 99.5 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.071 -1.018 . . . . 0.0 110.125 -179.788 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.686 ' CD1' HD12 ' A' ' 19' ' ' ILE . 3.1 mt -64.48 -41.2 96.62 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.192 -0.943 . . . . 0.0 109.747 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.11 -34.99 72.66 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.088 -1.008 . . . . 0.0 110.149 179.512 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -58.04 -35.46 71.35 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.067 -1.021 . . . . 0.0 110.22 179.505 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.755 ' CD2' HD12 ' A' ' 55' ' ' LEU . 6.7 m-85 -56.73 -44.17 81.39 Favored 'General case' 0 N--CA 1.513 2.687 0 O-C-N 120.972 -1.08 . . . . 0.0 109.999 179.297 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -57.56 -26.52 61.55 Favored 'General case' 0 N--CA 1.506 2.333 0 C-N-CA 119.317 -0.953 . . . . 0.0 110.527 179.419 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 16.6 mm -65.53 -48.61 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.314 0 O-C-N 120.954 -1.091 . . . . 0.0 109.119 179.426 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -67.39 -51.8 47.64 Favored 'General case' 0 N--CA 1.506 2.336 0 C-N-CA 119.251 -0.98 . . . . 0.0 108.72 179.027 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.807 HD21 HG23 ' A' ' 52' ' ' ILE . 0.1 OUTLIER -58.57 -32.37 68.86 Favored 'General case' 0 N--CA 1.508 2.432 0 C-N-CA 119.439 -0.905 . . . . 0.0 109.608 178.65 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.0 mtt-85 -59.82 -43.25 94.62 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 120.967 -1.083 . . . . 0.0 110.077 179.791 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -61.14 -46.04 92.2 Favored 'General case' 0 N--CA 1.508 2.443 0 C-N-CA 119.281 -0.968 . . . . 0.0 109.735 -179.69 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.504 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -70.26 -42.37 72.23 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 119.311 -0.956 . . . . 0.0 108.994 178.984 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.435 ' HG3' HD23 ' A' ' 30' ' ' LEU . 70.2 mt-30 -61.05 -32.22 71.85 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.28 -0.888 . . . . 0.0 110.158 179.341 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.1 mmmt -91.8 -33.94 14.78 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 120.98 -1.075 . . . . 0.0 110.745 179.894 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -56.43 -37.95 70.93 Favored 'General case' 0 N--CA 1.512 2.645 0 O-C-N 121.032 -1.042 . . . . 0.0 110.278 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 36.2 tttt -58.88 -51.67 69.02 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.069 -1.019 . . . . 0.0 110.002 179.916 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 51.74 -168.7 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.058 -1.026 . . . . 0.0 111.018 179.911 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.5 p -113.62 155.41 25.53 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.308 -0.87 . . . . 0.0 109.933 179.833 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 52.58 39.61 28.42 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.021 -1.049 . . . . 0.0 110.455 -179.658 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 tt -149.15 86.17 1.48 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.288 -0.882 . . . . 0.0 110.267 -179.801 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.06 106.08 18.27 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.22 -0.925 . . . . 0.0 110.286 -179.912 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -166.74 116.99 0.91 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.273 -0.892 . . . . 0.0 110.602 -179.977 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 20.0 mmtt 52.94 49.37 20.36 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.04 -1.038 . . . . 0.0 110.36 -179.562 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.8 m -94.92 -36.9 11.42 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.266 -0.896 . . . . 0.0 110.632 -179.907 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -58.17 -40.53 81.7 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.041 -1.037 . . . . 0.0 109.961 179.926 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.412 ' HA ' ' CE3' ' A' ' 50' ' ' TRP . 23.0 mt-10 -67.39 -43.81 80.42 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.166 -0.959 . . . . 0.0 109.268 179.368 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 46.6 tp60 -67.43 -41.17 85.25 Favored 'General case' 0 N--CA 1.505 2.285 0 C-N-CA 119.328 -0.949 . . . . 0.0 109.113 179.095 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.424 HD23 HD12 ' A' ' 52' ' ' ILE . 12.5 mt -60.22 -37.18 79.52 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.236 -0.915 . . . . 0.0 109.713 179.222 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.504 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 51.5 m0 -59.91 -36.03 76.14 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.116 -0.99 . . . . 0.0 109.898 179.474 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.489 ' O ' HD22 ' A' ' 55' ' ' LEU . 5.2 tp10 -62.25 -30.09 70.87 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.037 -1.04 . . . . 0.0 109.986 178.501 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.807 HG23 HD21 ' A' ' 30' ' ' LEU . 63.9 mt -72.25 -58.73 4.42 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.233 0 O-C-N 120.979 -1.076 . . . . 0.0 109.373 179.519 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.6 ptm -57.34 -26.67 61.32 Favored 'General case' 0 N--CA 1.512 2.662 0 C-N-CA 118.298 -1.361 . . . . 0.0 109.814 178.77 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.4 mm-40 -60.6 -36.82 79.51 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 120.753 -1.217 . . . . 0.0 109.314 177.915 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.755 HD12 ' CD2' ' A' ' 26' ' ' PHE . 0.6 OUTLIER -53.0 -34.5 56.53 Favored 'General case' 0 N--CA 1.514 2.771 0 O-C-N 120.981 -1.074 . . . . 0.0 109.522 178.84 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.474 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 33.2 t60 -51.23 -39.04 55.76 Favored 'General case' 0 N--CA 1.511 2.582 0 O-C-N 121.062 -1.024 . . . . 0.0 110.42 179.954 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.529 ' CD2' HD21 ' A' ' 91' ' ' LEU . 6.0 m170 -70.24 -53.21 17.95 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.114 -1.034 . . . . 0.0 109.181 178.945 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.437 ' HB3' ' CE2' ' A' ' 26' ' ' PHE . 35.1 tp60 -60.64 -29.92 69.56 Favored 'General case' 0 N--CA 1.504 2.24 0 C-N-CA 119.395 -0.922 . . . . 0.0 110.119 178.893 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.405 ' HD2' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -74.39 -46.65 38.99 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 120.99 -1.069 . . . . 0.0 109.009 179.163 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 86.8 p -67.05 -37.8 84.7 Favored 'General case' 0 N--CA 1.5 2.046 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.124 178.793 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 7.8 ttm-85 -64.27 -37.96 89.34 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 120.985 -1.072 . . . . 0.0 109.653 179.141 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.865 ' CE2' HG21 ' A' ' 22' ' ' THR . 60.9 t80 -63.4 -50.2 70.8 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.21 -0.931 . . . . 0.0 109.497 179.451 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.901 HD12 ' HB2' ' A' ' 87' ' ' ALA . 80.8 mt -72.82 -40.12 60.21 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.366 0 O-C-N 121.181 -0.949 . . . . 0.0 109.198 179.202 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.471 ' CE1' HG23 ' A' ' 92' ' ' ILE . 46.5 t80 -60.64 -31.19 70.41 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.233 -0.917 . . . . 0.0 109.989 178.878 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 48.6 m -80.87 -36.17 31.68 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.879 -1.138 . . . . 0.0 110.694 -179.904 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.638 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -82.92 -32.71 27.11 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 120.873 -1.142 . . . . 0.0 112.314 -179.078 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.501 ' N ' HD12 ' A' ' 66' ' ' LEU . 77.4 t80 -86.5 -35.75 19.41 Favored 'General case' 0 N--CA 1.511 2.61 0 O-C-N 120.624 -1.297 . . . . 0.0 111.901 -179.281 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -98.36 -21.5 16.58 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.859 -1.15 . . . . 0.0 112.882 -178.324 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.411 ' HE2' ' CD2' ' A' ' 64' ' ' TYR . 0.7 OUTLIER -117.7 -57.99 2.07 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.571 -1.331 . . . . 0.0 111.408 -179.262 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.42 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 1.0 OUTLIER -64.45 -30.81 71.84 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 121.005 -1.059 . . . . 0.0 110.71 -179.83 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp 58.45 43.6 19.34 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.769 -1.207 . . . . 0.0 110.127 -179.708 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -116.04 38.02 3.48 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.383 -0.823 . . . . 0.0 109.744 179.331 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.771 HG13 HD23 ' A' ' 77' ' ' LEU . 13.9 tt -156.47 162.7 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 O-C-N 121.22 -0.925 . . . . 0.0 110.227 -179.644 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 19.5 p -108.11 146.36 32.76 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.076 -1.015 . . . . 0.0 110.078 179.541 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.8 tttt -45.6 -32.82 2.5 Favored 'General case' 0 N--CA 1.516 2.831 0 O-C-N 121.33 -0.856 . . . . 0.0 111.661 -179.78 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -61.54 -49.98 74.49 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.002 -1.061 . . . . 0.0 109.31 179.535 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.771 HD23 HG13 ' A' ' 73' ' ' ILE . 36.6 tp -67.48 -43.09 81.83 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.19 -1.004 . . . . 0.0 108.538 178.765 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.442 ' HB2' ' CD1' ' A' ' 67' ' ' TYR . 17.8 t80 -60.98 -38.14 84.93 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.343 -0.848 . . . . 0.0 109.333 179.008 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.491 ' O ' HG22 ' A' ' 82' ' ' ILE . 9.9 t70 -75.48 -41.05 56.45 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.076 -1.015 . . . . 0.0 108.963 178.75 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.728 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 88.2 t90 -60.21 -38.37 83.1 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.073 -1.017 . . . . 0.0 109.178 178.758 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.468 HD11 ' HG ' ' A' ' 77' ' ' LEU . 16.1 mt -66.37 -54.8 20.27 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.236 -0.915 . . . . 0.0 109.328 179.072 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.491 HG22 ' O ' ' A' ' 79' ' ' ASP . 0.9 OUTLIER -56.03 -27.21 22.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.47 0 O-C-N 121.114 -0.991 . . . . 0.0 110.71 -179.724 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.75 -20.64 24.51 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.96 -1.088 . . . . 0.0 111.533 179.447 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.437 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 68.0 mm-40 -101.48 23.73 10.68 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 120.678 -1.264 . . . . 0.0 111.886 179.936 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.41 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 3.9 ttmm 75.85 71.76 0.08 Allowed 'General case' 0 N--CA 1.511 2.621 0 O-C-N 121.134 -0.979 . . . . 0.0 111.843 179.324 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.658 ' HE2' HD13 ' A' ' 23' ' ' LEU . 31.9 m-85 -134.42 -62.78 0.74 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.418 -0.801 . . . . 0.0 109.2 179.305 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.901 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -131.42 173.54 10.98 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.427 -0.796 . . . . 0.0 109.46 179.478 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.474 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 9.0 t70 -127.6 127.55 44.03 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.028 -1.045 . . . . 0.0 110.711 -179.872 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -73.65 -35.73 65.3 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 121.338 -0.851 . . . . 0.0 110.018 179.43 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.771 HD23 HD13 ' A' ' 106' ' ' LEU . 12.9 tp -60.3 -39.32 86.51 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.09 -1.006 . . . . 0.0 110.157 179.981 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.529 HD21 ' CD2' ' A' ' 57' ' ' HIS . 56.3 tp -72.81 -49.78 28.3 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.018 -1.051 . . . . 0.0 108.526 179.039 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.471 HG23 ' CE1' ' A' ' 64' ' ' TYR . 52.2 mt -59.12 -34.91 54.81 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.425 0 C-N-CA 119.189 -1.004 . . . . 0.0 108.783 178.16 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.81 -37.95 76.44 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.01 -1.057 . . . . 0.0 108.885 177.951 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.439 ' HD2' ' CZ ' ' A' ' 100' ' ' TYR . 5.2 mmtt -56.74 -42.49 79.36 Favored 'General case' 0 N--CA 1.51 2.561 0 O-C-N 121.001 -1.062 . . . . 0.0 109.41 179.17 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.3 m0 -66.7 -37.47 84.78 Favored 'General case' 0 N--CA 1.507 2.383 0 C-N-CA 119.404 -0.918 . . . . 0.0 109.824 179.441 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.37 -35.52 71.14 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.167 -0.958 . . . . 0.0 110.233 179.266 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.1 mmtp -54.21 -176.44 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.693 0 O-C-N 121.117 -0.989 . . . . 0.0 110.536 179.919 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.45 139.34 39.53 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.206 -0.934 . . . . 0.0 109.715 179.158 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 93.68 8.8 60.52 Favored Glycine 0 N--CA 1.495 2.574 0 C-N-CA 120.172 -1.013 . . . . 0.0 111.138 -179.436 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.55 ' HB3' HD23 ' A' ' 103' ' ' LEU . 45.0 m-85 -116.7 70.03 0.76 Allowed 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 119.486 1.643 . . . . 0.0 109.839 179.694 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -98.34 -35.83 10.19 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.163 -0.961 . . . . 0.0 111.091 -179.614 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.66 59.49 0.98 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.931 -1.106 . . . . 0.0 111.032 -179.448 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.55 HD23 ' HB3' ' A' ' 100' ' ' TYR . 1.2 pp -107.88 152.57 24.24 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.027 -1.046 . . . . 0.0 109.616 179.057 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.44 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 26.4 p -113.18 -27.04 8.14 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.113 -0.992 . . . . 0.0 113.628 -178.929 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.639 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 10.3 m -144.62 -167.71 2.72 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 120.137 -1.602 . . . . 0.0 109.877 179.18 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.771 HD13 HD23 ' A' ' 90' ' ' LEU . 12.5 mt -95.87 -39.87 9.6 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.091 -1.006 . . . . 0.0 109.915 178.88 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.9 ttm-85 -101.68 29.11 5.09 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.06 -1.025 . . . . 0.0 110.054 178.392 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.639 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.299 1.8 t -126.79 16.33 7.45 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.037 -1.039 . . . . 0.0 109.065 -179.661 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.479 HG23 ' O ' ' A' ' 108' ' ' CYS . 1.0 OUTLIER -159.31 39.31 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 O-C-N 120.969 -1.082 . . . . 0.0 110.184 -178.903 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.736 ' C ' HG23 ' A' ' 119' ' ' THR . 5.9 tt0 -101.57 97.3 7.75 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 120.918 -1.114 . . . . 0.0 111.19 -178.784 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 12.7 ttmt -112.33 -55.74 2.48 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.378 -0.826 . . . . 0.0 109.942 179.391 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 27.8 m-20 52.55 -178.7 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.08 -1.012 . . . . 0.0 110.924 179.874 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -137.77 155.15 49.36 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.234 -0.916 . . . . 0.0 110.134 179.897 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 5.3 m 52.38 38.33 24.86 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.098 -1.002 . . . . 0.0 110.851 -179.934 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -146.61 -178.32 6.11 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.133 -0.979 . . . . 0.0 110.405 -179.947 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -118.05 162.88 17.46 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.157 -0.965 . . . . 0.0 110.124 179.944 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 140.56 -157.78 25.83 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 109.673 -1.371 . . . . 0.0 109.673 -179.97 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 63.6 m -143.5 145.55 32.66 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.242 -1.152 . . . . 0.0 110.355 -179.972 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.736 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.4 m -119.8 171.44 8.41 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.241 -0.912 . . . . 0.0 110.279 179.945 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.431 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 47.2 t -100.73 155.44 17.9 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.348 -0.845 . . . . 0.0 108.988 178.635 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.72 HG23 ' CE1' ' A' ' 142' ' ' PHE . 14.4 tt -77.8 -29.56 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.441 0 O-C-N 121.078 -1.014 . . . . 0.0 112.099 -179.063 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.487 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 14.1 p -55.05 -34.87 63.92 Favored 'General case' 0 N--CA 1.513 2.688 0 O-C-N 120.586 -1.321 . . . . 0.0 110.382 -179.136 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -27.7 64.01 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.066 -1.021 . . . . 0.0 109.586 177.53 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 49.5 t -73.03 118.75 71.13 Favored Pre-proline 0 N--CA 1.508 2.431 0 O-C-N 120.975 -1.078 . . . . 0.0 110.397 179.845 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.411 ' HB3' ' HB1' ' A' ' 154' ' ' ALA . 37.4 Cg_endo -64.57 171.88 7.59 Favored 'Trans proline' 0 N--CA 1.489 1.234 0 O-C-N 123.053 1.028 . . . . 0.0 110.591 178.646 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.11 -38.44 61.14 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.201 -0.937 . . . . 0.0 110.505 -179.85 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.41 -42.73 92.46 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.115 -0.99 . . . . 0.0 110.082 -179.789 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -64.15 -41.55 97.12 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.214 -0.929 . . . . 0.0 109.551 179.703 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.716 ' O ' HG11 ' A' ' 140' ' ' VAL . 9.4 mt -61.0 -39.76 90.94 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.273 -0.892 . . . . 0.0 109.827 179.662 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -59.32 -39.43 83.08 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.174 -0.954 . . . . 0.0 110.144 -179.929 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.97 -39.02 84.22 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.216 -0.927 . . . . 0.0 110.293 -179.975 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -64.51 -40.41 95.59 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.295 -0.878 . . . . 0.0 110.015 -179.935 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.454 ' HB1' ' HA ' ' A' ' 139' ' ' GLN . . . -67.12 -40.25 86.79 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.128 -0.982 . . . . 0.0 109.914 179.762 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 13.0 ttp85 -67.27 -33.56 75.57 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.166 -0.959 . . . . 0.0 110.403 179.526 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 18.6 mmtp -75.35 -31.6 60.61 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.025 -1.047 . . . . 0.0 111.04 -179.986 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -101.79 23.07 11.87 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 120.896 -1.127 . . . . 0.0 111.845 -179.917 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.84 47.0 48.47 Favored Glycine 0 N--CA 1.5 2.911 0 O-C-N 120.72 -1.238 . . . . 0.0 110.913 179.238 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.445 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 10.1 t -146.07 -162.31 1.49 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.137 -1.214 . . . . 0.0 110.254 179.884 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . 0.454 ' HA ' ' HB1' ' A' ' 133' ' ' ALA . 77.7 mt-30 -132.79 160.61 36.36 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.039 -1.038 . . . . 0.0 110.177 -179.925 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.716 HG11 ' O ' ' A' ' 129' ' ' LEU . 8.8 p -147.56 161.21 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 O-C-N 121.16 -0.962 . . . . 0.0 110.473 -179.794 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 36.1 t -171.62 108.38 0.25 Allowed 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.126 -0.983 . . . . 0.0 111.039 179.727 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.72 ' CE1' HG23 ' A' ' 121' ' ' ILE . 87.0 t80 -104.15 157.07 17.37 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.106 -0.996 . . . . 0.0 110.649 179.906 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.09 -61.9 0.65 Allowed 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 178.662 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -146.43 148.68 32.54 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.54 -0.725 . . . . 0.0 109.164 178.676 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . 0.45 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 28.4 p -91.68 154.89 18.7 Favored 'General case' 0 N--CA 1.508 2.435 0 C-N-CA 119.011 -1.076 . . . . 0.0 110.983 -179.405 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.4 m -72.6 -25.28 22.48 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.5 0 O-C-N 121.367 -0.833 . . . . 0.0 111.735 -179.362 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -49.74 -59.0 4.22 Favored 'General case' 0 N--CA 1.517 2.88 0 O-C-N 120.879 -1.138 . . . . 0.0 110.219 -179.756 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.504 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 22.3 p -128.0 -163.91 1.32 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.218 -0.926 . . . . 0.0 110.319 179.356 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . 0.426 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -101.87 64.26 0.48 Allowed Glycine 0 N--CA 1.491 2.307 0 N-CA-C 107.784 -2.126 . . . . 0.0 107.784 178.278 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 27.6 t -98.95 143.9 28.73 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.36 -1.083 . . . . 0.0 109.724 -179.099 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -100.77 44.3 1.02 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.2 -0.937 . . . . 0.0 109.775 179.41 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 77.69 93.93 0.25 Allowed Glycine 0 N--CA 1.485 1.966 0 N-CA-C 109.872 -1.291 . . . . 0.0 109.872 179.897 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.1 p -108.18 129.01 55.2 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.191 -1.182 . . . . 0.0 110.069 179.67 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . 0.411 ' HB1' ' HB3' ' A' ' 125' ' ' PRO . . . -148.36 148.1 29.99 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.187 -0.946 . . . . 0.0 110.245 -179.316 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -112.86 -58.11 2.2 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.199 -0.938 . . . . 0.0 110.37 179.994 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -156.12 50.26 0.52 Allowed 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.135 -0.978 . . . . 0.0 110.635 -179.889 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 . . . . . 0 N--CA 1.495 1.79 0 CA-C-O 117.893 -1.051 . . . . 0.0 110.134 -179.959 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 N-CA-C 109.491 -1.443 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 118.47 100.29 1.98 Allowed Glycine 0 N--CA 1.492 2.413 0 N-CA-C 109.509 -1.437 . . . . 0.0 109.509 -179.966 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -133.7 92.79 22.34 Favored Pre-proline 0 N--CA 1.494 1.726 0 O-C-N 121.215 -1.168 . . . . 0.0 110.218 179.956 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.55 132.32 18.77 Favored 'Trans proline' 0 C--N 1.317 -1.131 0 O-C-N 123.425 1.224 . . . . 0.0 110.366 179.971 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 13.4 tpp85 -133.39 62.36 1.66 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.136 -0.978 . . . . 0.0 110.161 179.904 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.4 tp -137.15 145.51 29.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.19 -0.944 . . . . 0.0 110.113 -179.964 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.0 mtpt -141.32 137.11 32.18 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.205 -0.934 . . . . 0.0 110.218 179.952 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -124.22 40.16 3.8 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.223 -0.923 . . . . 0.0 110.207 -179.941 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -144.57 -174.6 4.37 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.222 -0.924 . . . . 0.0 110.242 179.949 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 31.9 mtt85 -140.06 73.82 1.44 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.184 -0.947 . . . . 0.0 110.263 -179.953 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 46.7 t -142.92 118.02 10.09 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.267 -0.896 . . . . 0.0 110.157 -179.978 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.5 mttp -144.65 153.17 54.39 Favored Pre-proline 0 N--CA 1.494 1.767 0 O-C-N 121.152 -0.967 . . . . 0.0 110.441 -179.911 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -72.66 158.92 49.84 Favored 'Trans proline' 0 C--N 1.318 -1.044 0 O-C-N 123.407 1.214 . . . . 0.0 110.63 179.877 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.784 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -55.84 145.0 54.72 Favored Pre-proline 0 N--CA 1.513 2.721 0 O-C-N 121.305 -0.872 . . . . 0.0 110.035 -179.945 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -71.91 163.25 39.42 Favored 'Trans proline' 0 C--N 1.318 -1.073 0 O-C-N 123.331 1.174 . . . . 0.0 110.719 -179.889 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -48.36 -32.13 7.09 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.465 -0.772 . . . . 0.0 111.399 -179.784 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -52.75 -33.35 42.17 Favored Glycine 0 N--CA 1.498 2.802 0 O-C-N 120.994 -1.067 . . . . 0.0 110.59 179.73 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -54.04 -32.43 54.43 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 120.884 -1.363 . . . . 0.0 110.723 179.783 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -54.03 -36.39 62.97 Favored 'General case' 0 N--CA 1.512 2.645 0 O-C-N 121.052 -1.03 . . . . 0.0 110.325 179.682 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.9 mtmt -57.12 -35.14 69.11 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.091 -1.005 . . . . 0.0 110.328 179.507 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.688 ' O ' HD12 ' A' ' 23' ' ' LEU . 3.5 pt -118.21 37.16 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 O-C-N 121.072 -1.018 . . . . 0.0 110.57 179.606 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -82.63 -43.58 0.93 Allowed Pre-proline 0 N--CA 1.508 2.46 0 O-C-N 121.063 -1.023 . . . . 0.0 112.989 -179.545 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.8 Cg_endo -75.44 -38.68 1.32 Allowed 'Trans proline' 0 N--CA 1.486 1.048 0 O-C-N 122.577 0.777 . . . . 0.0 111.529 -178.266 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.864 HG21 ' CE2' ' A' ' 62' ' ' TYR . 89.9 m -58.83 -41.77 87.7 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.025 -1.047 . . . . 0.0 109.808 179.898 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.688 HD12 ' O ' ' A' ' 19' ' ' ILE . 1.5 mt -65.24 -38.72 91.25 Favored 'General case' 0 N--CA 1.506 2.366 0 C-N-CA 119.466 -0.894 . . . . 0.0 109.508 179.216 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.2 m -58.3 -35.71 72.26 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.046 -1.034 . . . . 0.0 110.082 179.314 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -56.55 -34.57 67.22 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.098 -1.001 . . . . 0.0 110.427 179.563 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.726 ' CD2' HD12 ' A' ' 55' ' ' LEU . 8.8 m-85 -57.71 -36.18 71.64 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.088 -1.007 . . . . 0.0 110.432 179.829 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -56.64 -35.61 68.55 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.163 -0.961 . . . . 0.0 110.656 -179.638 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.418 ' H ' HD12 ' A' ' 28' ' ' ILE . 3.1 mp -63.84 -42.17 94.98 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.423 0 O-C-N 120.969 -1.082 . . . . 0.0 108.716 179.372 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -67.69 -57.19 6.81 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 119.133 -1.027 . . . . 0.0 108.298 178.521 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.722 HD12 HD23 ' A' ' 55' ' ' LEU . 1.2 tp -54.74 -33.0 60.58 Favored 'General case' 0 N--CA 1.512 2.632 0 C-N-CA 119.363 -0.935 . . . . 0.0 109.75 178.318 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.05 -36.12 70.13 Favored 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.09 -1.006 . . . . 0.0 110.404 179.657 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.68 -52.77 61.99 Favored 'General case' 0 N--CA 1.507 2.381 0 C-N-CA 119.075 -1.05 . . . . 0.0 109.427 179.98 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.612 ' HB1' ' HG2' ' A' ' 48' ' ' GLN . . . -69.39 -42.13 75.54 Favored 'General case' 0 N--CA 1.504 2.236 0 C-N-CA 119.048 -1.061 . . . . 0.0 108.609 178.638 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -61.34 -33.65 73.97 Favored 'General case' 0 N--CA 1.503 2.22 0 C-N-CA 119.525 -0.87 . . . . 0.0 110.069 179.266 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 6.4 mtmt -87.79 -34.48 18.28 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.064 -1.022 . . . . 0.0 110.612 179.754 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -55.16 -35.95 65.32 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.938 -1.101 . . . . 0.0 110.262 179.692 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 14.6 tttp -54.19 -37.73 64.84 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 121.048 -1.032 . . . . 0.0 110.485 179.767 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.3 t -107.51 39.99 1.79 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.135 -0.978 . . . . 0.0 110.063 179.691 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -163.15 101.57 0.97 Allowed 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.195 -0.941 . . . . 0.0 110.634 -179.9 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.5 ttmt 53.29 95.26 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.037 -1.039 . . . . 0.0 110.585 -179.891 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.565 HD21 ' OG ' ' A' ' 45' ' ' SER . 4.5 tp -147.08 83.87 1.58 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.128 -0.983 . . . . 0.0 110.448 -179.947 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -108.92 -53.16 2.68 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.258 -0.901 . . . . 0.0 110.146 179.854 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -120.97 42.4 3.06 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.09 -1.006 . . . . 0.0 110.194 179.935 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -159.24 77.77 0.72 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.337 -0.852 . . . . 0.0 110.752 -179.887 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.565 ' OG ' HD21 ' A' ' 41' ' ' LEU . 1.1 m -115.92 -55.51 2.41 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.113 -0.992 . . . . 0.0 110.616 -179.881 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.446 ' HB3' ' CZ2' ' A' ' 50' ' ' TRP . 74.1 m-80 -56.41 -39.38 72.92 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.124 -0.985 . . . . 0.0 110.014 179.853 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -60.81 -38.55 85.78 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.213 -0.929 . . . . 0.0 109.771 179.482 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.612 ' HG2' ' HB1' ' A' ' 33' ' ' ALA . 4.4 tt0 -57.87 -40.98 81.5 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.077 -1.014 . . . . 0.0 109.894 179.827 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.413 ' HA ' HD23 ' A' ' 49' ' ' LEU . 54.0 mt -75.04 -33.11 61.7 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.256 -0.902 . . . . 0.0 110.502 179.844 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.504 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 45.9 m0 -58.66 -38.85 79.05 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 120.905 -1.122 . . . . 0.0 109.738 179.566 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.45 ' O ' HD22 ' A' ' 55' ' ' LEU . 13.5 mt-10 -66.02 -32.39 73.83 Favored 'General case' 0 N--CA 1.502 2.136 0 C-N-CA 119.035 -1.066 . . . . 0.0 109.371 178.271 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.691 HG23 HD11 ' A' ' 30' ' ' LEU . 4.4 mt -72.44 -55.56 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.214 0 O-C-N 120.981 -1.075 . . . . 0.0 109.7 179.585 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.3 ptm -60.08 -24.36 64.53 Favored 'General case' 0 N--CA 1.509 2.492 0 C-N-CA 118.259 -1.376 . . . . 0.0 110.003 178.883 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -64.98 -35.41 81.08 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 120.756 -1.215 . . . . 0.0 109.76 178.369 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.726 HD12 ' CD2' ' A' ' 26' ' ' PHE . 0.8 OUTLIER -54.62 -35.8 63.8 Favored 'General case' 0 N--CA 1.514 2.73 0 O-C-N 120.846 -1.159 . . . . 0.0 109.834 179.387 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.458 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 26.2 t60 -52.22 -37.15 54.22 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 120.949 -1.095 . . . . 0.0 110.483 -179.746 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.451 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.4 m170 -67.95 -48.53 65.63 Favored 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 119.143 -1.023 . . . . 0.0 109.463 179.494 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -61.81 -37.04 82.93 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 119.286 -0.966 . . . . 0.0 109.594 179.154 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.408 ' HG3' ' CE2' ' A' ' 26' ' ' PHE . 3.0 mtt180 -66.27 -46.48 76.88 Favored 'General case' 0 N--CA 1.508 2.451 0 C-N-CA 119.29 -0.964 . . . . 0.0 109.641 179.364 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.5 p -62.25 -39.53 93.18 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.13 -0.981 . . . . 0.0 109.503 179.526 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 10.7 tpp85 -64.31 -42.61 96.26 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.103 -0.998 . . . . 0.0 109.101 179.307 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.864 ' CE2' HG21 ' A' ' 22' ' ' THR . 59.6 t80 -63.19 -49.04 75.81 Favored 'General case' 0 N--CA 1.507 2.389 0 C-N-CA 119.491 -0.884 . . . . 0.0 109.464 179.422 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.61 HD12 ' HB2' ' A' ' 87' ' ' ALA . 85.2 mt -69.31 -38.74 78.01 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.331 0 C-N-CA 119.305 -0.958 . . . . 0.0 109.238 179.538 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.43 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 9.0 t80 -66.57 -41.7 88.2 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.169 -0.957 . . . . 0.0 108.943 178.978 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.405 ' HA ' ' HD3' ' A' ' 69' ' ' LYS . 86.9 m -60.49 -41.28 93.92 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.126 -0.984 . . . . 0.0 110.366 -179.735 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.593 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.7 pp -83.2 -34.8 25.83 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 118.825 -1.15 . . . . 0.0 112.528 -178.978 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.535 ' N ' HD12 ' A' ' 66' ' ' LEU . 32.9 t80 -86.49 -32.59 20.7 Favored 'General case' 0 N--CA 1.513 2.706 0 O-C-N 120.628 -1.295 . . . . 0.0 112.066 -179.184 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.43 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 7.5 m-85 -98.43 -8.84 26.11 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 120.787 -1.196 . . . . 0.0 113.178 -178.524 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.405 ' HD3' ' HA ' ' A' ' 65' ' ' THR . 5.1 mtpm? -127.8 -58.4 1.23 Allowed 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.373 -1.454 . . . . 0.0 110.69 179.693 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.41 ' HB2' ' HA ' ' A' ' 66' ' ' LEU . 67.7 mtp180 -69.84 -28.82 66.01 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.119 -0.988 . . . . 0.0 110.741 -179.802 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.0 ttmt 58.92 43.5 17.91 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.768 -1.207 . . . . 0.0 109.932 -179.451 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.71 34.47 3.96 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.366 -0.834 . . . . 0.0 109.897 179.288 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.708 HG13 HD23 ' A' ' 77' ' ' LEU . 13.9 tt -153.21 162.34 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.144 -0.973 . . . . 0.0 109.856 -179.962 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.6 p -108.61 147.48 31.77 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.103 -0.998 . . . . 0.0 110.128 179.844 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 24.8 ttmt -46.36 -31.7 2.76 Favored 'General case' 0 N--CA 1.514 2.733 0 O-C-N 121.333 -0.854 . . . . 0.0 111.653 -179.978 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -62.2 -51.3 68.33 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.944 -1.097 . . . . 0.0 109.412 179.566 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.708 HD23 HG13 ' A' ' 73' ' ' ILE . 32.4 tp -65.97 -44.36 85.17 Favored 'General case' 0 N--CA 1.504 2.273 0 C-N-CA 119.168 -1.013 . . . . 0.0 108.538 178.902 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 17.0 t80 -60.77 -39.2 87.91 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.369 -0.832 . . . . 0.0 109.344 179.169 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -72.47 -42.04 65.38 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.141 -0.975 . . . . 0.0 108.876 178.771 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.784 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 88.8 t90 -56.28 -36.65 68.86 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 121.195 -0.941 . . . . 0.0 109.734 178.926 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.782 HD22 ' CD2' ' A' ' 86' ' ' TYR . 62.8 mt -70.14 -46.77 64.07 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.177 -0.952 . . . . 0.0 108.897 178.954 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.427 HD13 ' O ' ' A' ' 87' ' ' ALA . 33.3 mm -55.68 -33.02 32.57 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.669 0 O-C-N 121.24 -0.913 . . . . 0.0 109.83 179.261 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.34 -15.11 34.14 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 120.99 -1.069 . . . . 0.0 112.261 -179.909 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.453 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 64.3 mm-40 -104.94 23.15 14.01 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 120.475 -1.391 . . . . 0.0 112.165 -179.609 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.4 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 7.5 tttt 75.99 68.42 0.07 Allowed 'General case' 0 N--CA 1.511 2.62 0 O-C-N 121.051 -1.031 . . . . 0.0 112.028 179.277 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.782 ' CD2' HD22 ' A' ' 81' ' ' LEU . 31.4 m-85 -131.87 -63.35 0.82 Allowed 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 178.784 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.61 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -137.41 162.07 34.62 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.482 -0.761 . . . . 0.0 109.07 178.914 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.458 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 21.8 t0 -113.71 117.07 30.5 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.084 -1.01 . . . . 0.0 110.403 -179.804 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 6.1 mtpt -58.51 -38.76 78.37 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.206 -0.934 . . . . 0.0 109.86 179.742 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 47.4 tp -59.65 -40.22 87.01 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.101 -0.999 . . . . 0.0 109.756 179.629 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.747 ' HA ' HD21 ' A' ' 106' ' ' LEU . 66.1 tp -67.09 -52.45 41.88 Favored 'General case' 0 N--CA 1.508 2.426 0 C-N-CA 119.271 -0.972 . . . . 0.0 108.643 179.227 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 54.6 mt -58.6 -32.53 46.29 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.396 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.103 178.409 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.48 -42.86 78.06 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.046 -1.034 . . . . 0.0 109.521 178.833 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.458 ' HD3' HD23 ' A' ' 106' ' ' LEU . 7.5 mttp -59.6 -41.22 89.82 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.119 -0.988 . . . . 0.0 110.14 179.465 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 5.3 m0 -65.1 -39.49 93.22 Favored 'General case' 0 N--CA 1.508 2.469 0 C-N-CA 119.125 -1.03 . . . . 0.0 109.836 179.569 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 3.2 mtp85 -75.95 -29.93 58.47 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.268 -0.895 . . . . 0.0 110.566 179.304 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.5 mmtm -54.18 -176.49 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.652 0 O-C-N 120.86 -1.15 . . . . 0.0 110.589 179.771 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 53.7 m -105.07 131.57 52.4 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.166 -0.959 . . . . 0.0 109.772 179.296 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.35 8.33 50.11 Favored Glycine 0 N--CA 1.493 2.489 0 C-N-CA 120.196 -1.002 . . . . 0.0 111.109 -179.449 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -114.75 68.17 0.7 Allowed 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 119.499 1.65 . . . . 0.0 109.946 179.672 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -84.54 -38.53 19.89 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.079 -1.013 . . . . 0.0 109.983 179.787 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.82 90.34 3.31 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.126 -0.984 . . . . 0.0 109.969 179.842 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.927 HD13 HD13 ' A' ' 109' ' ' ILE . 9.9 tp -126.99 134.68 50.31 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.279 -0.888 . . . . 0.0 109.664 -179.647 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.451 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.3 p -108.76 -37.93 5.76 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.201 -0.937 . . . . 0.0 112.356 -179.791 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.828 ' O ' HD11 ' A' ' 103' ' ' LEU . 7.5 m -139.92 -167.93 2.4 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.22 -1.55 . . . . 0.0 109.877 178.905 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.747 HD21 ' HA ' ' A' ' 91' ' ' LEU . 17.3 mt -98.22 -37.76 9.56 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.132 -0.98 . . . . 0.0 110.674 179.493 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 30.8 ttm-85 -102.52 33.33 3.2 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.949 -1.095 . . . . 0.0 109.311 178.055 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.66 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.312 1.7 t -128.61 17.12 6.41 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.322 -0.861 . . . . 0.0 108.838 -179.06 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.927 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -159.1 38.54 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 120.814 -1.179 . . . . 0.0 110.434 -178.904 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.779 ' C ' HG23 ' A' ' 119' ' ' THR . 12.7 mm-40 -103.96 106.83 17.46 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 120.74 -1.225 . . . . 0.0 110.913 -178.769 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.422 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 14.3 ttmt -105.38 -50.51 3.21 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.332 -0.855 . . . . 0.0 110.445 179.688 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -113.69 118.79 35.32 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.129 -0.982 . . . . 0.0 110.309 179.901 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -150.82 -164.87 2.12 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.26 -0.9 . . . . 0.0 110.379 -179.88 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 8.1 p -115.95 163.84 15.3 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.179 -0.951 . . . . 0.0 110.215 179.957 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 64.48 -70.93 0.08 Allowed 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.137 -0.977 . . . . 0.0 110.809 179.917 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -116.21 163.94 15.22 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.95 -1.094 . . . . 0.0 110.299 -179.894 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -141.19 96.48 0.2 Allowed Glycine 0 N--CA 1.493 2.44 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 179.997 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 4.5 m -137.01 132.02 33.69 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.192 -1.181 . . . . 0.0 110.138 179.952 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.779 HG23 ' C ' ' A' ' 110' ' ' GLN . 0.2 OUTLIER -126.88 173.18 9.79 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.137 -0.977 . . . . 0.0 110.527 -179.865 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.439 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 43.3 t -108.02 155.31 20.5 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.436 -0.79 . . . . 0.0 108.922 178.727 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.794 HD12 ' CG ' ' A' ' 142' ' ' PHE . 0.0 OUTLIER -70.62 -37.15 68.48 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.425 0 O-C-N 121.027 -1.045 . . . . 0.0 110.633 -179.404 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.449 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 6.7 p -55.36 -33.6 63.56 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 120.818 -1.176 . . . . 0.0 110.752 -179.29 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.505 ' HG2' HG22 ' A' ' 109' ' ' ILE . 0.0 OUTLIER -58.92 -33.46 70.59 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 120.924 -1.11 . . . . 0.0 109.71 178.325 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 62.0 t -81.17 125.22 79.96 Favored Pre-proline 0 N--CA 1.504 2.269 0 O-C-N 121.163 -0.961 . . . . 0.0 109.725 179.688 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -65.73 170.26 11.63 Favored 'Trans proline' 0 N--CA 1.487 1.111 0 O-C-N 123.119 1.062 . . . . 0.0 110.659 179.582 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 5.9 tpt180 -75.12 -36.42 61.64 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.303 -0.873 . . . . 0.0 110.721 -179.753 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.76 -41.4 81.87 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 120.963 -1.085 . . . . 0.0 110.093 -179.8 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -68.33 -41.34 80.94 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.215 -0.928 . . . . 0.0 109.232 179.275 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.408 HD22 HG21 ' A' ' 140' ' ' VAL . 2.7 mt -63.63 -39.28 93.95 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.249 -0.907 . . . . 0.0 109.676 179.308 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -59.31 -39.66 83.76 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.13 -0.981 . . . . 0.0 109.924 179.716 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -59.88 -37.9 80.68 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.1 -1.0 . . . . 0.0 110.127 179.724 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -61.81 -46.43 89.55 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.178 -0.952 . . . . 0.0 109.869 179.904 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.544 ' HB1' ' HA ' ' A' ' 139' ' ' GLN . . . -61.07 -40.98 95.73 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.218 -0.926 . . . . 0.0 109.906 -179.998 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 19.9 ttt85 -64.98 -30.96 71.99 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.185 -0.947 . . . . 0.0 110.689 179.798 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.43 -29.03 23.16 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 120.95 -1.094 . . . . 0.0 111.361 -179.811 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 23.6 mttt -98.6 24.12 7.84 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 120.783 -1.198 . . . . 0.0 111.724 -179.909 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 50.16 46.74 42.73 Favored Glycine 0 N--CA 1.5 2.952 0 O-C-N 120.771 -1.205 . . . . 0.0 111.077 179.26 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.483 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 9.7 t -148.93 -164.18 1.96 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.069 -1.253 . . . . 0.0 110.533 179.846 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . 0.544 ' HA ' ' HB1' ' A' ' 133' ' ' ALA . 53.5 mt-30 -139.52 149.7 44.24 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.224 -0.923 . . . . 0.0 110.302 -179.867 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.408 HG21 HD22 ' A' ' 129' ' ' LEU . 7.4 p -132.66 161.0 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 O-C-N 121.221 -0.924 . . . . 0.0 110.2 -179.979 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 41.0 t -168.19 85.6 0.2 Allowed 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.167 -0.958 . . . . 0.0 111.099 -179.963 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.794 ' CG ' HD12 ' A' ' 121' ' ' ILE . 50.5 t80 -99.38 160.48 14.25 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.261 -0.899 . . . . 0.0 110.486 -179.926 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 -137.06 -61.29 0.66 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.509 -0.744 . . . . 0.0 109.02 178.967 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -134.69 152.04 51.47 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.428 -0.795 . . . . 0.0 108.95 178.669 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 31.5 p -92.85 152.77 19.23 Favored 'General case' 0 N--CA 1.504 2.267 0 C-N-CA 119.028 -1.069 . . . . 0.0 111.085 -179.552 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.9 m -70.61 -26.38 28.35 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.407 0 O-C-N 121.427 -0.795 . . . . 0.0 111.307 -179.522 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -50.49 -58.49 5.65 Favored 'General case' 0 N--CA 1.516 2.841 0 O-C-N 120.855 -1.153 . . . . 0.0 110.213 -179.993 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.504 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 26.0 p -127.59 -166.71 1.64 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.261 -0.899 . . . . 0.0 110.566 179.656 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . 0.44 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -100.06 57.66 0.8 Allowed Glycine 0 N--CA 1.493 2.442 0 N-CA-C 107.958 -2.057 . . . . 0.0 107.958 178.405 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 19.3 t -101.67 142.61 32.75 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.318 -1.107 . . . . 0.0 109.784 -179.305 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 57.5 mtp85 -95.9 52.45 1.32 Allowed 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.273 -0.892 . . . . 0.0 109.736 179.353 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.89 98.41 0.03 OUTLIER Glycine 0 N--CA 1.488 2.123 0 N-CA-C 109.866 -1.293 . . . . 0.0 109.866 179.956 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 22.6 p -110.44 131.08 55.36 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.266 -1.138 . . . . 0.0 110.356 179.552 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -142.32 141.38 32.37 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.096 -1.003 . . . . 0.0 110.038 -179.802 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . 0.402 ' O ' ' OG1' ' A' ' 156' ' ' THR . 0.7 OUTLIER -108.05 69.38 0.73 Allowed 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.258 -0.901 . . . . 0.0 110.223 179.972 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . 0.402 ' OG1' ' O ' ' A' ' 155' ' ' SER . 80.0 p 46.42 52.61 10.57 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.346 -0.846 . . . . 0.0 111.452 179.896 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.229 179.917 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.344 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 62.69 76.57 0.25 Allowed Glycine 0 N--CA 1.493 2.435 0 N-CA-C 109.534 -1.427 . . . . 0.0 109.534 179.938 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.44 ' OG ' ' HD2' ' A' ' 2' ' ' PRO . 0.1 OUTLIER -135.43 173.03 6.18 Favored Pre-proline 0 N--CA 1.494 1.742 0 O-C-N 121.24 -1.153 . . . . 0.0 110.162 179.977 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.44 ' HD2' ' OG ' ' A' ' 1' ' ' SER . 46.0 Cg_endo -72.68 -38.54 3.14 Favored 'Trans proline' 0 C--N 1.317 -1.117 0 O-C-N 123.443 1.233 . . . . 0.0 110.613 -179.973 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 52.1 mtm-85 -114.28 -172.66 2.14 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.199 -0.938 . . . . 0.0 110.146 -179.995 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 79.6 mt -110.25 -54.82 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.192 -0.943 . . . . 0.0 110.145 179.901 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.5 pttt -157.66 157.0 32.74 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.346 -0.847 . . . . 0.0 110.831 179.869 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.8 t -132.58 157.43 44.76 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.216 -0.927 . . . . 0.0 110.241 -179.972 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.7 mtt85 -143.63 -177.5 5.43 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.288 -0.882 . . . . 0.0 110.359 -179.982 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.21 132.05 56.77 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.234 -0.916 . . . . 0.0 110.106 179.902 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.5 p -134.13 -175.39 3.84 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.165 -0.96 . . . . 0.0 110.288 -179.865 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 24.2 tptt -138.88 107.0 7.49 Favored Pre-proline 0 N--CA 1.494 1.759 0 O-C-N 121.272 -0.893 . . . . 0.0 110.193 -179.96 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.38 157.98 52.28 Favored 'Trans proline' 0 C--N 1.319 -1.016 0 O-C-N 123.186 1.098 . . . . 0.0 110.746 179.969 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.801 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -108.47 153.46 42.07 Favored Pre-proline 0 N--CA 1.498 1.966 0 O-C-N 121.484 -0.76 . . . . 0.0 109.906 179.754 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -69.67 164.79 33.12 Favored 'Trans proline' 0 C--N 1.316 -1.134 0 O-C-N 123.377 1.199 . . . . 0.0 110.869 -179.682 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -47.66 -32.48 5.71 Favored 'General case' 0 N--CA 1.516 2.844 0 O-C-N 121.435 -0.791 . . . . 0.0 111.493 -179.743 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -53.61 -35.39 51.78 Favored Glycine 0 N--CA 1.498 2.812 0 N-CA-C 110.373 -1.091 . . . . 0.0 110.373 179.771 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.46 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 24.3 t80 -55.75 -33.58 64.42 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 120.948 -1.324 . . . . 0.0 110.681 179.713 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -54.99 -38.45 67.87 Favored 'General case' 0 N--CA 1.513 2.676 0 O-C-N 120.993 -1.067 . . . . 0.0 110.106 179.807 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.2 mmtm -58.81 -35.52 73.0 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.359 -0.838 . . . . 0.0 110.192 179.44 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.662 ' O ' HD12 ' A' ' 23' ' ' LEU . 3.2 pt -116.73 36.13 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.135 -0.978 . . . . 0.0 110.616 179.732 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 3.5 tmtt? -82.53 -43.38 0.95 Allowed Pre-proline 0 N--CA 1.509 2.484 0 O-C-N 121.003 -1.06 . . . . 0.0 112.941 -179.43 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 48.8 Cg_endo -76.95 -36.58 1.4 Allowed 'Trans proline' 0 N--CA 1.486 1.08 0 O-C-N 122.639 0.81 . . . . 0.0 111.527 -178.561 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.978 HG21 ' CE2' ' A' ' 62' ' ' TYR . 91.1 m -59.37 -43.45 92.87 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 120.932 -1.105 . . . . 0.0 110.083 -179.664 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.662 HD12 ' O ' ' A' ' 19' ' ' ILE . 1.0 OUTLIER -61.26 -36.33 79.7 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.263 -0.898 . . . . 0.0 110.021 179.642 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.45 -36.52 73.81 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 120.92 -1.112 . . . . 0.0 110.176 179.472 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -58.1 -34.31 70.06 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.049 -1.032 . . . . 0.0 110.379 179.601 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.769 ' CD2' HD12 ' A' ' 55' ' ' LEU . 8.8 m-85 -56.65 -42.49 79.01 Favored 'General case' 0 N--CA 1.512 2.65 0 O-C-N 120.911 -1.118 . . . . 0.0 110.008 179.54 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -57.81 -26.53 62.11 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.367 -0.933 . . . . 0.0 110.453 179.274 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 13.1 mm -67.12 -51.08 57.62 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.291 0 O-C-N 120.945 -1.097 . . . . 0.0 108.485 179.225 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.4 tp60 -64.23 -52.02 60.8 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.227 -0.92 . . . . 0.0 108.546 178.852 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.729 HD12 HD23 ' A' ' 55' ' ' LEU . 1.1 tp -57.03 -36.89 71.0 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.24 -0.913 . . . . 0.0 109.64 178.905 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -57.38 -37.62 72.95 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.084 -1.01 . . . . 0.0 110.123 179.784 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.61 -50.14 72.45 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.11 -0.993 . . . . 0.0 109.517 179.803 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.484 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -68.14 -42.86 79.49 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 119.016 -1.074 . . . . 0.0 108.89 178.96 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -61.3 -32.11 71.96 Favored 'General case' 0 N--CA 1.504 2.266 0 C-N-CA 119.576 -0.849 . . . . 0.0 110.213 179.374 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.5 mmpt? -96.28 -20.46 18.51 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 120.975 -1.078 . . . . 0.0 111.71 -179.96 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.556 ' O ' HD22 ' A' ' 41' ' ' LEU . 20.4 t0 -53.48 -35.13 60.24 Favored 'General case' 0 N--CA 1.513 2.681 0 O-C-N 120.672 -1.268 . . . . 0.0 110.534 -179.966 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.8 tttp -53.71 -47.31 70.64 Favored 'General case' 0 N--CA 1.512 2.661 0 O-C-N 121.091 -1.005 . . . . 0.0 110.378 -179.997 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 52.31 -165.59 0.06 Allowed 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.097 -1.002 . . . . 0.0 110.895 179.908 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.51 -47.73 4.18 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.177 -0.952 . . . . 0.0 110.389 179.965 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.81 83.7 1.84 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.177 -0.952 . . . . 0.0 109.902 179.83 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.556 HD22 ' O ' ' A' ' 36' ' ' ASP . 2.4 tp -148.41 -57.37 0.22 Allowed 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.215 -0.928 . . . . 0.0 110.731 -179.9 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.421 ' O ' ' HB3' ' A' ' 43' ' ' ALA . . . 54.91 176.87 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.014 -1.053 . . . . 0.0 110.593 -179.93 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.421 ' HB3' ' O ' ' A' ' 42' ' ' ALA . . . 58.9 162.25 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.15 -0.968 . . . . 0.0 110.355 -179.879 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.2 mttp 51.28 66.07 1.3 Allowed 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.886 -1.134 . . . . 0.0 110.709 -179.8 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 63.2 m -110.9 -53.24 2.72 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.199 -0.938 . . . . 0.0 110.482 -179.92 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.408 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 18.0 m120 -57.29 -40.96 78.87 Favored 'General case' 0 N--CA 1.51 2.561 0 O-C-N 121.205 -0.934 . . . . 0.0 109.844 179.838 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -59.94 -38.67 83.09 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.219 -0.926 . . . . 0.0 109.941 179.62 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.437 ' HG2' ' HB1' ' A' ' 33' ' ' ALA . 0.5 OUTLIER -59.47 -40.23 86.25 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.17 -0.956 . . . . 0.0 110.265 179.985 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 91.4 mt -74.8 -31.69 61.79 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.227 -0.921 . . . . 0.0 110.716 -179.929 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.486 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 40.2 m0 -57.98 -39.69 78.81 Favored 'General case' 0 N--CA 1.512 2.67 0 O-C-N 120.842 -1.161 . . . . 0.0 109.245 179.134 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.0 -34.74 78.4 Favored 'General case' 0 N--CA 1.499 1.985 0 C-N-CA 119.046 -1.062 . . . . 0.0 108.807 177.626 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.693 HG23 HD11 ' A' ' 30' ' ' LEU . 5.1 mt -71.74 -56.75 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.175 0 O-C-N 121.114 -0.991 . . . . 0.0 109.358 179.106 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.554 ' HE1' ' O ' ' A' ' 147' ' ' HIS . 0.3 OUTLIER -58.22 -25.88 62.18 Favored 'General case' 0 N--CA 1.512 2.633 0 C-N-CA 118.208 -1.397 . . . . 0.0 109.884 178.72 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.5 mt-30 -62.17 -37.14 84.11 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.874 -1.141 . . . . 0.0 109.376 178.165 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.769 HD12 ' CD2' ' A' ' 26' ' ' PHE . 1.0 OUTLIER -53.76 -35.67 61.52 Favored 'General case' 0 N--CA 1.513 2.683 0 O-C-N 120.933 -1.105 . . . . 0.0 109.73 179.099 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.466 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 33.5 t60 -51.51 -36.86 46.49 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.039 -1.038 . . . . 0.0 110.449 179.975 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.453 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 15.3 m170 -71.2 -46.77 60.54 Favored 'General case' 0 N--CA 1.505 2.29 0 C-N-CA 119.225 -0.99 . . . . 0.0 109.088 179.222 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.428 ' HB3' ' CE2' ' A' ' 26' ' ' PHE . 5.6 tt0 -63.2 -35.4 80.18 Favored 'General case' 0 N--CA 1.505 2.284 0 C-N-CA 119.249 -0.98 . . . . 0.0 109.41 178.696 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.46 ' HD3' ' CD2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -68.26 -48.91 63.79 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.138 -0.976 . . . . 0.0 109.292 179.259 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.4 p -63.86 -38.53 91.43 Favored 'General case' 0 N--CA 1.503 2.198 0 C-N-CA 119.356 -0.938 . . . . 0.0 109.231 179.161 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.407 ' O ' ' OG1' ' A' ' 65' ' ' THR . 5.1 ttt-85 -65.73 -42.04 91.52 Favored 'General case' 0 N--CA 1.504 2.275 0 C-N-CA 119.246 -0.982 . . . . 0.0 109.106 179.125 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.978 ' CE2' HG21 ' A' ' 22' ' ' THR . 54.4 t80 -62.8 -48.75 77.75 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.189 -0.944 . . . . 0.0 109.357 179.377 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.677 HD12 ' HB2' ' A' ' 87' ' ' ALA . 89.6 mt -71.02 -39.94 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.328 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.245 179.574 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.424 ' HD2' HD13 ' A' ' 92' ' ' ILE . 10.3 t80 -65.3 -42.12 93.37 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.245 -0.91 . . . . 0.0 108.839 179.027 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.419 HG23 ' HD2' ' A' ' 69' ' ' LYS . 92.0 m -61.27 -41.83 97.6 Favored 'General case' 0 N--CA 1.502 2.135 0 C-N-CA 119.283 -0.967 . . . . 0.0 110.54 -179.614 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.537 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.6 pp -83.09 -32.35 26.82 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 118.811 -1.156 . . . . 0.0 112.323 -178.944 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.426 ' CD2' HG23 ' A' ' 73' ' ' ILE . 31.1 t80 -86.44 -32.53 20.81 Favored 'General case' 0 N--CA 1.511 2.591 0 O-C-N 120.708 -1.245 . . . . 0.0 111.781 -179.454 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.402 ' HB2' ' O ' ' A' ' 64' ' ' TYR . 8.3 m-85 -98.42 -25.38 14.82 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 120.716 -1.24 . . . . 0.0 112.525 -178.661 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.419 ' HD2' HG23 ' A' ' 65' ' ' THR . 63.3 mttt -108.55 -57.52 2.12 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.596 -1.315 . . . . 0.0 110.717 179.968 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.467 HH11 ' HB2' ' A' ' 72' ' ' ALA . 28.4 ttt-85 -72.92 -30.22 63.73 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.242 -0.911 . . . . 0.0 111.009 -179.388 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.5 mttp 56.62 42.39 27.14 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.743 -1.223 . . . . 0.0 110.041 -179.468 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.467 ' HB2' HH11 ' A' ' 70' ' ' ARG . . . -108.84 34.18 3.83 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.423 -0.798 . . . . 0.0 109.845 179.119 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.737 HG13 HD23 ' A' ' 77' ' ' LEU . 13.9 tt -149.21 162.84 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.17 -0.956 . . . . 0.0 109.58 -179.938 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 62.0 m -107.44 144.24 34.64 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.013 -1.054 . . . . 0.0 110.378 179.972 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -45.24 -32.71 2.03 Favored 'General case' 0 N--CA 1.515 2.805 0 O-C-N 121.353 -0.842 . . . . 0.0 111.562 179.988 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -61.82 -51.09 69.66 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 120.908 -1.12 . . . . 0.0 109.19 179.329 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.737 HD23 HG13 ' A' ' 73' ' ' ILE . 37.2 tp -66.13 -43.85 85.91 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.186 -1.006 . . . . 0.0 108.322 178.637 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.683 ' HA ' HD12 ' A' ' 81' ' ' LEU . 15.5 t80 -58.98 -41.45 87.58 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.359 -0.838 . . . . 0.0 109.173 178.956 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -72.32 -42.3 65.59 Favored 'General case' 0 N--CA 1.504 2.271 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 178.222 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.801 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 86.5 t90 -56.12 -36.78 68.6 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.231 -0.918 . . . . 0.0 109.359 178.464 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.683 HD12 ' HA ' ' A' ' 78' ' ' TYR . 11.1 mt -66.59 -59.56 3.51 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.232 -0.917 . . . . 0.0 108.769 178.927 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.46 HG13 ' HB3' ' A' ' 87' ' ' ALA . 2.5 mt -56.27 -27.73 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.584 0 O-C-N 120.907 -1.12 . . . . 0.0 109.927 179.352 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 56.1 tttt -81.5 -21.02 38.91 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.896 -1.127 . . . . 0.0 110.971 178.579 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.442 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 20.3 mm-40 -105.44 22.72 14.96 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 120.809 -1.182 . . . . 0.0 111.979 179.91 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.416 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 4.2 tmtt? 77.3 67.73 0.05 OUTLIER 'General case' 0 N--CA 1.515 2.811 0 O-C-N 121.207 -0.933 . . . . 0.0 112.075 179.167 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.487 ' HE2' HD13 ' A' ' 23' ' ' LEU . 20.8 m-85 -130.28 -62.59 0.93 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.409 -0.807 . . . . 0.0 108.938 178.839 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.677 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -131.26 167.62 18.9 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.406 -0.809 . . . . 0.0 109.581 179.463 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.466 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 13.3 t0 -120.13 114.6 22.2 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.187 -0.945 . . . . 0.0 110.338 179.897 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -58.1 -38.16 75.93 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.24 -0.912 . . . . 0.0 110.028 179.803 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.637 HD23 HD22 ' A' ' 106' ' ' LEU . 13.5 tp -58.69 -38.19 77.72 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.211 -0.931 . . . . 0.0 110.144 179.842 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.584 ' HA ' HD21 ' A' ' 106' ' ' LEU . 62.8 tp -69.42 -52.34 27.83 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.007 -1.058 . . . . 0.0 108.854 179.41 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.424 HD13 ' HD2' ' A' ' 64' ' ' TYR . 69.0 mt -60.33 -32.7 51.57 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.362 0 C-N-CA 119.249 -0.98 . . . . 0.0 108.978 178.33 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.42 -49.27 67.32 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 120.989 -1.069 . . . . 0.0 109.267 178.826 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.491 ' HD3' HD23 ' A' ' 106' ' ' LEU . 11.2 mttp -56.55 -42.11 77.97 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.004 -1.06 . . . . 0.0 109.618 179.243 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.419 ' CZ3' ' HG ' ' A' ' 91' ' ' LEU . 3.8 m0 -62.17 -30.99 71.44 Favored 'General case' 0 N--CA 1.504 2.273 0 C-N-CA 119.142 -1.023 . . . . 0.0 109.634 178.682 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.15 22.58 10.23 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 120.953 -1.092 . . . . 0.0 111.117 179.048 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.458 ' HB2' ' CD2' ' A' ' 100' ' ' TYR . 8.0 mmtp -102.17 -174.06 2.49 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 120.686 -1.259 . . . . 0.0 109.628 179.052 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 56.5 m -102.57 127.43 49.65 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.112 -0.992 . . . . 0.0 109.678 179.244 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.69 9.22 50.37 Favored Glycine 0 N--CA 1.493 2.454 0 C-N-CA 120.187 -1.006 . . . . 0.0 111.038 -179.218 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.458 ' CD2' ' HB2' ' A' ' 97' ' ' LYS . 44.6 m-85 -111.15 48.87 0.91 Allowed 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 119.598 1.699 . . . . 0.0 110.219 179.744 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -59.52 -38.48 81.1 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.112 -0.992 . . . . 0.0 109.988 179.862 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -122.06 121.25 36.56 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.18 -0.95 . . . . 0.0 110.202 -179.966 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.88 HD13 HD13 ' A' ' 109' ' ' ILE . 9.7 tp -153.74 131.3 11.42 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.185 -0.947 . . . . 0.0 110.259 -179.674 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.453 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.4 p -108.98 -37.06 5.93 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.228 -0.92 . . . . 0.0 112.227 179.988 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.79 ' O ' HD11 ' A' ' 103' ' ' LEU . 7.3 m -140.97 -168.62 2.64 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.216 -1.552 . . . . 0.0 110.118 178.943 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.637 HD22 HD23 ' A' ' 90' ' ' LEU . 15.8 mt -97.18 -38.44 9.71 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.97 -1.082 . . . . 0.0 110.368 179.298 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 1.1 ttt85 -101.71 31.57 3.77 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.954 -1.091 . . . . 0.0 109.612 178.195 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.667 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.305 1.7 t -127.72 16.13 6.94 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.123 -0.986 . . . . 0.0 109.021 -179.344 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.88 HD13 HD13 ' A' ' 103' ' ' LEU . 1.1 pt -158.88 38.41 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.369 0 O-C-N 120.937 -1.102 . . . . 0.0 110.423 -178.953 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.746 ' C ' HG23 ' A' ' 119' ' ' THR . 4.2 tt0 -107.49 109.14 20.75 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 120.838 -1.164 . . . . 0.0 111.314 -178.625 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.422 ' HA ' ' OG1' ' A' ' 119' ' ' THR . 14.3 ttmt -111.75 -55.14 2.54 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.332 -0.855 . . . . 0.0 110.114 179.473 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 9.1 t30 53.04 -170.05 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.028 -1.045 . . . . 0.0 110.85 179.951 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -116.48 93.35 4.18 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.226 -0.921 . . . . 0.0 110.071 179.895 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -142.4 -174.04 4.02 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.3 -0.875 . . . . 0.0 110.094 -179.867 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.44 -43.21 7.74 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.213 -0.929 . . . . 0.0 109.915 179.648 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -127.46 49.44 2.11 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.19 -0.944 . . . . 0.0 110.009 179.728 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -65.32 -164.01 1.06 Allowed Glycine 0 N--CA 1.493 2.494 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.927 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 47.2 m -144.15 101.27 3.69 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.233 -1.157 . . . . 0.0 110.366 -179.933 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.746 HG23 ' C ' ' A' ' 110' ' ' GLN . 1.1 m -119.27 172.9 7.27 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.251 -0.906 . . . . 0.0 110.123 179.749 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.428 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 47.2 t -103.93 155.05 18.95 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.361 -0.837 . . . . 0.0 109.113 178.889 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.807 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -71.72 -36.19 58.16 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.372 0 O-C-N 121.056 -1.027 . . . . 0.0 110.77 -179.344 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.451 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.4 p -54.58 -32.55 58.79 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 120.772 -1.205 . . . . 0.0 110.9 -179.108 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.455 ' HG3' HG22 ' A' ' 109' ' ' ILE . 6.7 ttt-85 -58.75 -35.02 72.07 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 120.974 -1.079 . . . . 0.0 109.409 178.123 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 47.3 t -81.39 125.5 78.71 Favored Pre-proline 0 N--CA 1.504 2.253 0 O-C-N 121.282 -0.886 . . . . 0.0 109.669 179.539 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.635 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.3 Cg_endo -66.01 177.93 2.71 Favored 'Trans proline' 0 N--CA 1.489 1.242 0 O-C-N 123.126 1.067 . . . . 0.0 110.698 179.807 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -75.18 -37.78 61.09 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.23 -0.919 . . . . 0.0 110.548 -179.766 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.51 -41.72 86.06 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.062 -1.024 . . . . 0.0 109.967 -179.804 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -68.6 -41.36 79.71 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.22 -0.925 . . . . 0.0 109.209 179.307 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.635 HD12 ' O ' ' A' ' 125' ' ' PRO . 3.5 mt -64.29 -38.78 92.24 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.265 -0.897 . . . . 0.0 109.651 179.278 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -61.65 -40.56 95.35 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.123 -0.986 . . . . 0.0 109.721 179.802 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -60.42 -39.13 86.33 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.214 -0.929 . . . . 0.0 110.099 179.848 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -59.9 -41.07 90.84 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.232 -0.917 . . . . 0.0 110.038 -179.985 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -62.0 -45.17 94.8 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.186 -0.946 . . . . 0.0 109.91 179.911 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 3.5 ttt85 -59.33 -38.49 80.46 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.131 -0.98 . . . . 0.0 109.867 179.46 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -58.54 -35.62 72.6 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.223 -0.923 . . . . 0.0 110.509 179.859 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 13.9 mttp -105.37 18.24 22.6 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 120.98 -1.075 . . . . 0.0 111.908 -179.959 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 56.17 44.95 88.77 Favored Glycine 0 N--CA 1.498 2.775 0 O-C-N 120.601 -1.312 . . . . 0.0 110.312 179.374 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 9.2 t -136.89 -163.0 1.35 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.131 -1.217 . . . . 0.0 109.967 179.848 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -137.12 146.09 44.64 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.075 -1.015 . . . . 0.0 110.276 -179.957 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.556 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.7 p -132.79 161.38 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.226 -0.921 . . . . 0.0 110.117 -179.954 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 42.2 t -167.36 82.1 0.21 Allowed 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.212 -0.93 . . . . 0.0 111.041 179.943 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.794 ' CG ' HD12 ' A' ' 121' ' ' ILE . 44.7 t80 -94.42 161.45 14.23 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.253 -0.904 . . . . 0.0 110.337 179.997 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 -140.67 -60.71 0.51 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.534 -0.728 . . . . 0.0 109.098 179.124 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -131.15 151.56 51.32 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.427 -0.796 . . . . 0.0 109.055 178.871 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 28.1 p -96.73 154.79 17.08 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 121.052 -1.03 . . . . 0.0 110.957 -179.698 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.1 m -73.89 -25.68 20.61 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.464 0 O-C-N 121.382 -0.824 . . . . 0.0 111.813 -179.218 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . 0.554 ' O ' ' HE1' ' A' ' 53' ' ' MET . 4.0 m-70 -49.99 -51.66 39.97 Favored 'General case' 0 N--CA 1.516 2.829 0 O-C-N 120.839 -1.163 . . . . 0.0 110.268 -179.768 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.486 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 28.1 p -134.87 -165.53 1.68 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.198 -0.938 . . . . 0.0 110.606 179.832 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -99.17 58.08 0.87 Allowed Glycine 0 N--CA 1.493 2.441 0 N-CA-C 108.013 -2.035 . . . . 0.0 108.013 178.492 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 27.8 t -103.06 144.05 31.79 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.339 -1.095 . . . . 0.0 109.988 -179.196 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 74.7 mtt85 -99.06 49.02 0.95 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.331 -0.855 . . . . 0.0 109.629 179.298 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.94 98.58 0.05 OUTLIER Glycine 0 N--CA 1.488 2.133 0 N-CA-C 109.866 -1.294 . . . . 0.0 109.866 179.938 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.5 p -111.98 128.01 56.04 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.302 -1.116 . . . . 0.0 110.237 179.652 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . 0.526 ' HB1' ' HD3' ' A' ' 125' ' ' PRO . . . -141.87 146.12 35.41 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.014 -1.054 . . . . 0.0 110.005 -179.626 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -109.21 -57.76 2.12 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.269 -0.894 . . . . 0.0 110.203 -179.901 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 7.5 t -147.28 49.91 1.09 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.286 -0.884 . . . . 0.0 110.439 -179.911 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 . . . . . 0 N--CA 1.494 1.756 0 CA-C-O 117.98 -1.01 . . . . 0.0 110.231 -179.935 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.249 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 69.89 50.85 27.18 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 109.45 -1.46 . . . . 0.0 109.45 179.968 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.2 m -139.03 93.45 10.37 Favored Pre-proline 0 N--CA 1.494 1.756 0 O-C-N 121.201 -1.176 . . . . 0.0 110.243 -179.991 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.42 154.22 55.69 Favored 'Trans proline' 0 C--N 1.317 -1.096 0 O-C-N 123.469 1.247 . . . . 0.0 110.502 -179.946 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -120.37 78.72 1.39 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.146 -0.971 . . . . 0.0 110.212 -179.978 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 55.0 mt -124.71 96.23 3.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.164 -0.96 . . . . 0.0 110.064 -179.964 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.0 mtmt 52.13 -177.14 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.982 -1.074 . . . . 0.0 110.866 179.897 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.8 p -119.53 160.75 21.8 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.232 -0.917 . . . . 0.0 110.18 179.964 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.4 mtt-85 -135.55 152.39 51.24 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.219 -0.925 . . . . 0.0 110.245 -179.983 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 31.0 mtt-85 -119.26 171.17 8.49 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.244 -0.91 . . . . 0.0 110.138 179.941 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -144.77 164.96 29.45 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.246 -0.909 . . . . 0.0 110.314 -179.941 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.5 mmmm -118.08 80.88 15.59 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.142 -0.974 . . . . 0.0 110.205 179.908 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.89 161.3 44.03 Favored 'Trans proline' 0 C--N 1.317 -1.12 0 O-C-N 123.456 1.24 . . . . 0.0 110.741 -179.922 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.865 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -76.95 135.34 67.35 Favored Pre-proline 0 N--CA 1.507 2.4 0 C-N-CA 119.662 -0.815 . . . . 0.0 109.229 179.492 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -76.22 79.14 3.02 Favored 'Trans proline' 0 N--CA 1.487 1.089 0 O-C-N 123.251 1.132 . . . . 0.0 112.168 -178.299 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.9 t70 48.04 90.05 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.332 -0.855 . . . . 0.0 111.826 178.397 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 164.23 -42.19 0.31 Allowed Glycine 0 N--CA 1.501 2.969 0 C-N-CA 119.782 -1.199 . . . . 0.0 110.641 179.58 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.564 ' HE1' HD13 ' A' ' 23' ' ' LEU . 18.7 t80 -55.07 -29.4 57.45 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.183 -1.186 . . . . 0.0 110.801 179.872 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -54.52 -37.81 65.79 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 120.92 -1.113 . . . . 0.0 110.18 179.596 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.08 -35.04 70.82 Favored 'General case' 0 N--CA 1.511 2.585 0 O-C-N 121.231 -0.918 . . . . 0.0 110.376 179.425 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.1 pt -124.4 36.82 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 121.173 -0.954 . . . . 0.0 110.325 179.835 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.43 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -83.81 -42.69 0.79 Allowed Pre-proline 0 N--CA 1.509 2.507 0 O-C-N 121.128 -0.982 . . . . 0.0 113.474 -179.168 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.43 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 44.0 Cg_endo -74.41 -33.8 5.14 Favored 'Trans proline' 0 N--CA 1.488 1.166 0 O-C-N 122.623 0.802 . . . . 0.0 112.04 -177.978 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.884 HG21 ' CE2' ' A' ' 62' ' ' TYR . 93.2 m -58.73 -41.46 86.45 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.791 -1.193 . . . . 0.0 110.044 -179.814 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.564 HD13 ' HE1' ' A' ' 16' ' ' PHE . 0.3 OUTLIER -62.22 -37.27 84.7 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.26 -0.9 . . . . 0.0 110.109 179.636 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -57.43 -37.06 72.18 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 120.964 -1.085 . . . . 0.0 110.22 179.809 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -59.91 -35.38 74.74 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.105 -0.997 . . . . 0.0 110.198 179.592 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.712 ' CD2' HD12 ' A' ' 55' ' ' LEU . 6.9 m-85 -57.37 -43.53 83.64 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 120.987 -1.07 . . . . 0.0 110.071 179.355 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -57.49 -26.55 61.46 Favored 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 119.264 -0.974 . . . . 0.0 110.45 179.259 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.6 mm -65.15 -49.63 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.325 0 O-C-N 120.987 -1.07 . . . . 0.0 109.05 179.402 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -66.96 -52.01 48.12 Favored 'General case' 0 N--CA 1.505 2.323 0 C-N-CA 119.201 -1.0 . . . . 0.0 108.61 179.042 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.819 HD21 HG23 ' A' ' 52' ' ' ILE . 0.1 OUTLIER -57.84 -33.25 68.44 Favored 'General case' 0 N--CA 1.51 2.552 0 C-N-CA 119.331 -0.948 . . . . 0.0 109.738 178.802 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.27 -44.9 96.47 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 120.877 -1.139 . . . . 0.0 110.0 179.875 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.34 -43.33 96.56 Favored 'General case' 0 N--CA 1.508 2.468 0 C-N-CA 119.218 -0.993 . . . . 0.0 109.884 -179.629 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.519 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -71.79 -41.69 68.0 Favored 'General case' 0 N--CA 1.503 2.218 0 C-N-CA 119.247 -0.981 . . . . 0.0 109.093 178.954 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -62.48 -32.72 73.66 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.288 -0.883 . . . . 0.0 110.28 179.474 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.4 mmtt -94.96 -38.37 10.72 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 120.896 -1.128 . . . . 0.0 110.723 179.906 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -58.21 -39.64 79.55 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.055 -1.028 . . . . 0.0 109.984 179.836 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.52 -50.34 73.94 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.195 -0.941 . . . . 0.0 109.789 179.736 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.3 t 50.83 -169.22 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.109 0 O-C-N 120.975 -1.078 . . . . 0.0 111.051 179.832 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.2 p -114.77 152.92 31.27 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.244 -0.91 . . . . 0.0 109.837 179.825 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.1 ttpt 53.28 48.69 21.49 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.019 -1.051 . . . . 0.0 110.545 -179.831 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.8 tp -132.29 77.13 1.74 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.18 -0.95 . . . . 0.0 110.068 -179.925 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.75 104.99 0.17 Allowed 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.151 -0.968 . . . . 0.0 110.361 -179.707 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -169.91 -165.95 0.53 Allowed 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.234 -0.916 . . . . 0.0 110.823 -179.987 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.0 mttt -59.86 89.82 0.02 OUTLIER 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.144 -0.972 . . . . 0.0 109.871 179.791 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.1 m -102.63 -50.24 3.62 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.25 -0.906 . . . . 0.0 110.005 179.788 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.403 ' O ' ' CG ' ' A' ' 50' ' ' TRP . 68.5 m-20 -58.51 -39.02 78.93 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.206 -0.934 . . . . 0.0 109.856 179.483 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -66.32 -45.64 79.57 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.164 -0.96 . . . . 0.0 109.333 179.344 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 49.2 tp60 -66.78 -41.66 87.29 Favored 'General case' 0 N--CA 1.505 2.296 0 C-N-CA 119.341 -0.943 . . . . 0.0 109.015 179.048 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.54 HD23 HD12 ' A' ' 52' ' ' ILE . 12.5 mt -61.0 -37.33 82.15 Favored 'General case' 0 N--CA 1.506 2.332 0 C-N-CA 119.506 -0.878 . . . . 0.0 109.78 179.318 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.5 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 54.4 m0 -58.6 -35.95 73.24 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.947 -1.096 . . . . 0.0 110.259 179.712 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.6 ' O ' HD22 ' A' ' 55' ' ' LEU . 4.3 tt0 -63.92 -29.49 70.66 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.022 -1.049 . . . . 0.0 109.87 178.513 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.819 HG23 HD21 ' A' ' 30' ' ' LEU . 68.1 mt -71.88 -57.9 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.279 0 O-C-N 120.92 -1.112 . . . . 0.0 109.564 179.542 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 ptm -57.93 -26.65 62.52 Favored 'General case' 0 N--CA 1.511 2.602 0 C-N-CA 118.284 -1.366 . . . . 0.0 109.796 178.769 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -62.39 -35.97 80.85 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 120.812 -1.18 . . . . 0.0 109.503 178.19 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.712 HD12 ' CD2' ' A' ' 26' ' ' PHE . 0.5 OUTLIER -53.64 -36.51 62.15 Favored 'General case' 0 N--CA 1.513 2.695 0 O-C-N 120.868 -1.145 . . . . 0.0 109.869 179.378 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.457 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 22.4 t60 -53.14 -38.42 62.69 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.917 -1.114 . . . . 0.0 110.427 -179.684 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.448 ' CD2' HD21 ' A' ' 91' ' ' LEU . 5.5 m170 -67.48 -54.79 17.14 Favored 'General case' 0 N--CA 1.506 2.338 0 C-N-CA 119.207 -0.997 . . . . 0.0 109.318 179.369 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.439 ' HB3' ' CE2' ' A' ' 26' ' ' PHE . 13.7 tt0 -56.76 -32.93 66.1 Favored 'General case' 0 N--CA 1.507 2.381 0 C-N-CA 119.404 -0.918 . . . . 0.0 109.726 178.975 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.407 ' HG3' ' CE2' ' A' ' 26' ' ' PHE . 0.4 OUTLIER -67.18 -52.42 41.54 Favored 'General case' 0 N--CA 1.509 2.475 0 O-C-N 120.965 -1.084 . . . . 0.0 109.184 178.834 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.8 p -63.31 -37.63 88.0 Favored 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 119.253 -0.979 . . . . 0.0 109.318 178.997 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 48.6 ttt85 -65.06 -39.33 93.12 Favored 'General case' 0 N--CA 1.505 2.289 0 C-N-CA 119.251 -0.98 . . . . 0.0 109.355 179.053 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.884 ' CE2' HG21 ' A' ' 22' ' ' THR . 35.7 t80 -62.27 -50.51 71.41 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.013 -1.054 . . . . 0.0 109.375 179.441 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.571 HD12 ' HB2' ' A' ' 87' ' ' ALA . 86.8 mt -71.8 -40.33 69.2 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.34 0 O-C-N 121.188 -0.945 . . . . 0.0 109.232 179.28 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -64.08 -42.59 96.9 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.157 -0.964 . . . . 0.0 109.123 179.272 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.418 ' HA ' ' CD ' ' A' ' 69' ' ' LYS . 94.0 m -61.67 -42.28 98.7 Favored 'General case' 0 N--CA 1.501 2.116 0 C-N-CA 119.3 -0.96 . . . . 0.0 110.297 -179.642 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.56 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.6 pp -83.25 -31.85 26.76 Favored 'General case' 0 N--CA 1.504 2.267 0 C-N-CA 118.828 -1.149 . . . . 0.0 112.485 -179.022 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.456 ' HD1' HG23 ' A' ' 73' ' ' ILE . 66.8 t80 -86.24 -33.16 20.8 Favored 'General case' 0 N--CA 1.514 2.732 0 O-C-N 120.659 -1.275 . . . . 0.0 111.71 -179.508 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -98.37 -18.95 18.03 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 120.813 -1.179 . . . . 0.0 112.726 -178.662 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.418 ' CD ' ' HA ' ' A' ' 65' ' ' THR . 5.6 mttt -120.97 -59.32 1.74 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 120.439 -1.413 . . . . 0.0 110.944 179.844 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.411 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 1.0 OUTLIER -63.1 -30.76 71.85 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.124 -0.985 . . . . 0.0 110.763 -179.648 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 42.0 tttt 57.68 42.35 23.95 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 120.751 -1.218 . . . . 0.0 110.062 -179.554 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -111.9 35.12 3.83 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.406 -0.809 . . . . 0.0 109.879 179.285 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.56 HG21 ' CD1' ' A' ' 66' ' ' LEU . 14.0 tt -154.17 162.48 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 O-C-N 121.234 -0.916 . . . . 0.0 109.895 179.969 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 43.5 m -107.6 145.08 33.75 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.137 -0.977 . . . . 0.0 110.301 179.863 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -46.71 -30.6 2.46 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.293 -0.879 . . . . 0.0 111.772 179.95 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.44 -50.46 73.5 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.781 -1.199 . . . . 0.0 109.462 179.677 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 24.5 tp -69.26 -44.02 72.76 Favored 'General case' 0 N--CA 1.505 2.277 0 C-N-CA 118.918 -1.113 . . . . 0.0 108.232 178.637 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.666 ' HA ' HD12 ' A' ' 81' ' ' LEU . 20.0 t80 -57.41 -38.6 74.59 Favored 'General case' 0 N--CA 1.509 2.475 0 C-N-CA 119.547 -0.861 . . . . 0.0 109.228 178.662 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -74.99 -42.45 57.51 Favored 'General case' 0 N--CA 1.504 2.27 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 177.925 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.865 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 81.4 t90 -55.44 -37.86 68.27 Favored 'General case' 0 N--CA 1.511 2.596 0 O-C-N 121.27 -0.894 . . . . 0.0 109.361 178.444 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.666 HD12 ' HA ' ' A' ' 78' ' ' TYR . 9.2 mt -68.32 -50.2 55.02 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.17 -0.956 . . . . 0.0 108.828 178.917 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.43 ' CD1' ' HB3' ' A' ' 87' ' ' ALA . 36.5 mm -56.4 -30.72 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.647 0 O-C-N 121.271 -0.893 . . . . 0.0 110.115 179.36 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 54.1 mttt -89.09 -22.17 23.03 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.932 -1.105 . . . . 0.0 111.753 -179.999 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.435 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 60.2 mm-40 -98.46 21.58 10.95 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 120.618 -1.301 . . . . 0.0 111.941 -179.97 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.6 tttm 74.39 74.1 0.11 Allowed 'General case' 0 N--CA 1.511 2.624 0 O-C-N 121.062 -1.024 . . . . 0.0 111.765 179.258 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.458 ' CD2' ' CD2' ' A' ' 81' ' ' LEU . 29.7 m-85 -133.22 -62.4 0.79 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.488 -0.757 . . . . 0.0 109.342 179.603 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.571 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -127.65 161.81 28.01 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.423 -0.798 . . . . 0.0 109.402 179.219 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.457 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 8.5 t0 -108.33 111.39 23.3 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.125 -0.984 . . . . 0.0 110.445 -179.853 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.0 mmtp -58.23 -36.81 73.73 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.313 -0.867 . . . . 0.0 110.109 179.707 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.1 tp -58.2 -38.64 77.14 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.075 -1.016 . . . . 0.0 110.131 179.707 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.623 ' HA ' HD21 ' A' ' 106' ' ' LEU . 64.1 tp -70.24 -53.22 17.89 Favored 'General case' 0 N--CA 1.505 2.311 0 C-N-CA 119.196 -1.002 . . . . 0.0 108.751 179.284 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.449 HG22 ' HD2' ' A' ' 96' ' ' ARG . 54.8 mt -59.38 -31.33 46.19 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.47 0 C-N-CA 119.225 -0.99 . . . . 0.0 109.299 178.469 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.5 -45.57 83.03 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 120.962 -1.086 . . . . 0.0 109.733 179.219 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.497 ' HD3' HD23 ' A' ' 106' ' ' LEU . 7.2 mttp -60.89 -45.03 96.2 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.088 -1.007 . . . . 0.0 109.882 179.376 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 4.7 m0 -58.31 -37.6 75.4 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.987 -1.071 . . . . 0.0 109.843 179.366 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.449 ' HD2' HG22 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -77.09 -36.75 55.48 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.204 -0.935 . . . . 0.0 109.743 178.864 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 31.1 mmtt -54.36 -177.12 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.641 0 O-C-N 121.075 -1.016 . . . . 0.0 110.226 179.588 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 33.1 m -108.57 141.03 41.08 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.247 -0.908 . . . . 0.0 109.341 178.807 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 106.5 -29.72 10.57 Favored Glycine 0 N--CA 1.492 2.42 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 -178.987 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 51.9 m-85 -92.64 56.83 2.77 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 120.895 -1.356 . . . . 0.0 110.061 179.747 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -69.44 -39.42 77.82 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 120.939 -1.101 . . . . 0.0 109.707 179.649 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.56 81.54 1.74 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.234 -0.916 . . . . 0.0 110.094 179.923 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.994 HD12 HD13 ' A' ' 109' ' ' ILE . 2.2 tt -113.99 137.14 52.09 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.107 -0.996 . . . . 0.0 110.212 -179.983 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.44 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.0 p -105.56 -30.07 9.75 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.394 -0.816 . . . . 0.0 111.871 179.259 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.671 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 13.1 m -145.28 -168.03 2.84 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 120.323 -1.486 . . . . 0.0 109.444 178.813 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.623 HD21 ' HA ' ' A' ' 91' ' ' LEU . 15.1 mt -99.13 -37.03 9.49 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.119 -0.988 . . . . 0.0 110.492 178.898 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 1.8 ttt-85 -103.95 34.98 2.81 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.851 -1.156 . . . . 0.0 109.417 178.456 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.671 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.309 1.7 t -129.46 21.17 5.62 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -179.39 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.994 HD13 HD12 ' A' ' 103' ' ' LEU . 1.6 pt -156.73 37.08 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.282 0 O-C-N 120.953 -1.092 . . . . 0.0 110.634 -178.626 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.51 ' C ' HG23 ' A' ' 119' ' ' THR . 1.7 mt-30 -65.83 78.39 0.08 Allowed 'General case' 0 N--CA 1.514 2.745 0 O-C-N 120.858 -1.151 . . . . 0.0 110.833 -178.864 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.555 ' HG3' HG21 ' A' ' 119' ' ' THR . 0.0 OUTLIER -149.12 171.55 16.24 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.033 -1.042 . . . . 0.0 110.353 179.451 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -157.12 -58.71 0.09 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.133 -0.979 . . . . 0.0 110.772 179.954 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -161.99 -55.9 0.04 OUTLIER 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.144 -0.972 . . . . 0.0 110.939 -179.993 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -138.62 81.57 1.86 Allowed 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.329 -0.857 . . . . 0.0 110.174 179.972 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 23.3 m-80 -136.57 -59.85 0.71 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.203 -0.936 . . . . 0.0 110.158 179.94 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 4.0 m120 52.97 73.84 0.33 Allowed 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.072 -1.017 . . . . 0.0 110.803 179.953 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -139.44 -84.21 0.1 Allowed Glycine 0 N--CA 1.492 2.422 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 179.961 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 56.0 m -117.05 91.49 3.59 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.258 -1.142 . . . . 0.0 110.055 179.895 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.555 HG21 ' HG3' ' A' ' 111' ' ' LYS . 4.0 m -139.14 166.97 23.13 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.26 -0.9 . . . . 0.0 110.372 -179.835 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 49.5 t -89.32 153.75 20.63 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.242 -0.911 . . . . 0.0 109.183 178.99 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.82 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -74.12 -35.63 41.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 121.048 -1.032 . . . . 0.0 111.184 -178.898 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.458 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 8.7 p -56.05 -35.84 67.37 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 120.886 -1.134 . . . . 0.0 111.058 -178.613 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.519 ' HG3' HG22 ' A' ' 109' ' ' ILE . 0.5 OUTLIER -58.82 -33.96 70.97 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.004 -1.06 . . . . 0.0 109.959 178.662 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.428 HG22 ' CE ' ' A' ' 111' ' ' LYS . 47.2 t -76.51 125.36 87.55 Favored Pre-proline 0 N--CA 1.505 2.28 0 O-C-N 121.065 -1.022 . . . . 0.0 110.077 179.957 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.4 ' HB3' ' CB ' ' A' ' 154' ' ' ALA . 37.9 Cg_endo -65.04 175.64 3.69 Favored 'Trans proline' 0 N--CA 1.488 1.204 0 O-C-N 123.236 1.124 . . . . 0.0 110.801 179.428 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -75.02 -36.66 61.91 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.274 -0.891 . . . . 0.0 110.542 -179.977 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.29 -40.36 77.63 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.035 -1.04 . . . . 0.0 109.989 -179.935 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.21 -42.43 75.77 Favored 'General case' 0 N--CA 1.506 2.356 0 C-N-CA 119.358 -0.937 . . . . 0.0 109.169 179.313 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.579 HD11 HD11 ' A' ' 121' ' ' ILE . 3.5 mt -66.94 -39.68 87.38 Favored 'General case' 0 N--CA 1.505 2.279 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.342 178.989 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -60.51 -38.02 82.99 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.237 -0.915 . . . . 0.0 109.82 179.404 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -57.74 -37.0 72.83 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.17 -0.956 . . . . 0.0 110.372 179.787 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -63.57 -50.38 69.69 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.131 -0.981 . . . . 0.0 109.673 179.862 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.53 -38.35 87.1 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.186 -0.946 . . . . 0.0 109.991 179.745 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 5.1 ttt85 -68.96 -36.53 78.0 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 121.057 -1.027 . . . . 0.0 110.265 179.61 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -79.03 -33.83 44.43 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.01 -1.056 . . . . 0.0 110.587 179.861 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 23.1 mttt -83.97 -19.28 34.88 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.054 -1.029 . . . . 0.0 111.765 179.758 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 89.37 32.73 10.07 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 -179.502 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 7.8 t -135.88 -160.88 1.1 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.031 -1.276 . . . . 0.0 109.738 179.883 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -132.72 142.21 48.93 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.063 -1.023 . . . . 0.0 110.232 179.905 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.7 p -125.6 160.54 31.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 O-C-N 121.246 -0.909 . . . . 0.0 110.027 179.738 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 32.4 t -167.71 83.14 0.2 Allowed 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.223 -0.923 . . . . 0.0 111.277 -179.828 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.752 ' CG ' HD12 ' A' ' 121' ' ' ILE . 46.6 t80 -92.72 159.61 15.35 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.175 -0.953 . . . . 0.0 109.981 179.601 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 20.7 m170 -136.97 -61.31 0.67 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.434 -0.791 . . . . 0.0 109.136 179.245 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -135.63 151.65 50.46 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.48 -0.762 . . . . 0.0 109.227 178.988 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 29.8 p -92.85 154.05 18.47 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.107 -0.996 . . . . 0.0 110.877 -179.761 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 26.8 m -72.05 -25.63 24.02 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.533 0 O-C-N 121.422 -0.799 . . . . 0.0 111.481 -179.487 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -51.32 -55.14 19.98 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 120.811 -1.18 . . . . 0.0 109.94 -179.958 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.5 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 28.4 p -131.39 -170.15 2.32 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.235 -0.915 . . . . 0.0 110.583 179.571 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . 0.4 ' HA2' ' CE3' ' A' ' 50' ' ' TRP . . . -97.7 58.44 1.09 Allowed Glycine 0 N--CA 1.492 2.425 0 N-CA-C 107.937 -2.065 . . . . 0.0 107.937 178.421 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 13.0 t -97.71 146.21 25.58 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.369 -1.077 . . . . 0.0 109.797 -179.157 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 14.9 mmt85 -98.16 50.29 1.01 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.287 -0.883 . . . . 0.0 109.503 179.123 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.95 98.0 0.03 OUTLIER Glycine 0 N--CA 1.486 2.008 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 -179.877 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.0 p -110.48 129.35 55.8 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.298 -1.119 . . . . 0.0 110.336 179.699 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . 0.4 ' CB ' ' HB3' ' A' ' 125' ' ' PRO . . . -143.08 145.75 33.16 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.05 -1.031 . . . . 0.0 110.046 -179.789 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -104.48 -48.38 3.83 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.159 -0.963 . . . . 0.0 110.62 -179.752 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.17 -39.92 70.08 Favored 'General case' 0 N--CA 1.511 2.62 0 O-C-N 120.994 -1.066 . . . . 0.0 110.517 -179.667 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 . . . . . 0 N--CA 1.494 1.768 0 CA-C-O 117.958 -1.02 . . . . 0.0 110.24 179.962 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.343 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -90.21 131.65 10.86 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 -179.965 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.412 ' OG ' ' HD2' ' A' ' 2' ' ' PRO . 28.4 t -119.25 152.92 53.09 Favored Pre-proline 0 N--CA 1.494 1.746 0 O-C-N 121.209 -1.171 . . . . 0.0 110.183 179.93 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.412 ' HD2' ' OG ' ' A' ' 1' ' ' SER . 45.9 Cg_endo -72.22 115.2 4.23 Favored 'Trans proline' 0 C--N 1.316 -1.171 0 O-C-N 123.416 1.219 . . . . 0.0 110.44 -179.977 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -125.27 80.99 1.93 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.188 -0.945 . . . . 0.0 110.213 -179.989 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 82.4 mt -130.91 130.05 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 121.221 -0.925 . . . . 0.0 110.0 179.974 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 8.6 tptt -130.32 122.37 27.79 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.17 -0.956 . . . . 0.0 110.179 179.921 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 39.5 p -126.05 120.98 31.66 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.222 -0.924 . . . . 0.0 110.272 -179.994 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 34.6 mtt180 -134.26 -65.82 0.64 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.239 -0.913 . . . . 0.0 110.186 179.902 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.7 ttt85 -147.51 90.05 1.83 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.142 -0.974 . . . . 0.0 110.358 179.99 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.4 m -131.38 157.88 42.22 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.239 -0.913 . . . . 0.0 110.239 179.998 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.9 tttt -124.26 96.21 42.22 Favored Pre-proline 0 N--CA 1.494 1.73 0 O-C-N 121.253 -0.904 . . . . 0.0 110.273 -179.952 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.64 160.7 45.84 Favored 'Trans proline' 0 C--N 1.317 -1.129 0 O-C-N 123.464 1.244 . . . . 0.0 110.608 179.944 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.865 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -62.56 134.38 95.12 Favored Pre-proline 0 N--CA 1.511 2.579 0 C-N-CA 119.467 -0.893 . . . . 0.0 109.006 179.724 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -83.12 83.08 1.99 Allowed 'Trans proline' 0 C--N 1.318 -1.057 0 O-C-N 123.186 1.098 . . . . 0.0 112.434 -178.131 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 48.81 92.07 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.322 -0.862 . . . . 0.0 111.676 178.473 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.06 -39.58 0.46 Allowed Glycine 0 N--CA 1.5 2.95 0 C-N-CA 119.658 -1.258 . . . . 0.0 110.579 179.554 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.582 ' N ' HD21 ' A' ' 77' ' ' LEU . 18.1 t80 -58.03 -31.47 67.02 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.073 -1.251 . . . . 0.0 110.509 179.812 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -52.69 -33.81 49.21 Favored 'General case' 0 N--CA 1.512 2.671 0 O-C-N 120.968 -1.083 . . . . 0.0 110.218 179.247 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 42.8 mmtt -58.4 -38.2 76.87 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.147 -0.971 . . . . 0.0 110.111 179.525 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.525 HD11 HD21 ' A' ' 81' ' ' LEU . 3.8 pt -116.65 36.94 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.213 -0.929 . . . . 0.0 110.499 179.727 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.427 ' N ' ' HD2' ' A' ' 21' ' ' PRO . 1.4 tmtt? -84.1 -42.64 0.76 Allowed Pre-proline 0 N--CA 1.508 2.447 0 O-C-N 121.173 -0.954 . . . . 0.0 113.523 -178.941 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.427 ' HD2' ' N ' ' A' ' 20' ' ' LYS . 44.6 Cg_endo -74.58 -36.88 2.63 Favored 'Trans proline' 0 N--CA 1.486 1.054 0 O-C-N 122.518 0.746 . . . . 0.0 111.967 -177.971 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.959 HG21 ' CE2' ' A' ' 62' ' ' TYR . 70.4 m -62.22 -48.0 81.91 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 120.96 -1.088 . . . . 0.0 109.786 -179.97 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.428 ' CD1' HD12 ' A' ' 19' ' ' ILE . 5.2 mt -60.09 -35.42 75.16 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.252 -0.905 . . . . 0.0 109.825 179.196 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 25.2 m -55.76 -36.91 67.84 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.026 -1.046 . . . . 0.0 110.11 179.324 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -57.47 -38.42 74.48 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.184 -0.948 . . . . 0.0 109.946 179.554 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.75 ' CD2' HD22 ' A' ' 55' ' ' LEU . 20.5 m-85 -59.34 -40.66 87.08 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.15 -0.969 . . . . 0.0 109.887 179.616 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -58.63 -25.27 62.52 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.299 -0.875 . . . . 0.0 111.321 -179.874 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.537 ' N ' HD12 ' A' ' 28' ' ' ILE . 2.6 mp -79.0 -34.61 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.442 0 O-C-N 120.889 -1.132 . . . . 0.0 109.833 179.705 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -81.85 -36.72 27.95 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.007 -1.058 . . . . 0.0 109.109 178.554 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.737 ' CG ' HG23 ' A' ' 52' ' ' ILE . 0.3 OUTLIER -73.9 -31.98 63.37 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.163 -0.96 . . . . 0.0 110.109 178.81 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.1 ptm180 -69.57 -36.49 76.34 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 120.799 -1.188 . . . . 0.0 109.753 179.354 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.49 -42.19 99.33 Favored 'General case' 0 N--CA 1.508 2.435 0 C-N-CA 119.043 -1.063 . . . . 0.0 109.123 179.316 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.602 ' CB ' HD11 ' A' ' 52' ' ' ILE . . . -69.7 -42.4 74.14 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.373 -0.931 . . . . 0.0 108.839 178.775 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 34.3 mm-40 -58.98 -35.02 72.51 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.308 -0.87 . . . . 0.0 110.138 179.436 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -90.04 -39.45 12.93 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 120.976 -1.077 . . . . 0.0 110.133 179.653 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -57.42 -35.2 69.76 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.2 -0.937 . . . . 0.0 110.308 179.639 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.42 ' HG3' ' OG ' ' A' ' 45' ' ' SER . 9.7 ttpp -84.94 -47.42 10.3 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.017 -1.052 . . . . 0.0 109.827 179.743 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.8 t 51.97 69.46 0.67 Allowed 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.163 -0.96 . . . . 0.0 111.014 179.755 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 51.62 -163.82 0.06 Allowed 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.921 -1.112 . . . . 0.0 110.679 179.774 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 16.5 mtpt -83.79 82.05 8.5 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.124 -0.985 . . . . 0.0 109.8 179.687 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.4 tt -113.37 -54.13 2.64 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.341 -0.849 . . . . 0.0 110.498 -179.778 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -110.96 -163.97 0.88 Allowed 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.136 -0.978 . . . . 0.0 110.122 179.983 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -100.25 -172.3 2.19 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.111 -0.993 . . . . 0.0 110.139 179.834 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.4 tttt 53.02 51.5 15.69 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 120.996 -1.065 . . . . 0.0 110.415 -179.756 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.42 ' OG ' ' HG3' ' A' ' 37' ' ' LYS . 28.3 t -96.69 -37.99 10.1 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.269 -0.894 . . . . 0.0 110.733 -179.933 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.403 ' O ' ' CD1' ' A' ' 50' ' ' TRP . 15.1 m-80 -57.51 -40.62 79.09 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.073 -1.017 . . . . 0.0 109.954 179.918 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -61.23 -40.0 92.37 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.229 -0.92 . . . . 0.0 109.878 179.667 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 25.4 tp60 -68.13 -38.96 82.78 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.123 -0.986 . . . . 0.0 109.858 179.574 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.539 HD23 HD12 ' A' ' 52' ' ' ILE . 63.4 mt -70.19 -33.51 71.81 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.193 -0.942 . . . . 0.0 110.599 179.91 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.487 ' CD1' ' HA ' ' A' ' 148' ' ' CYS . 50.1 m0 -57.43 -40.89 79.37 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 120.865 -1.147 . . . . 0.0 109.85 179.824 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -63.18 -33.83 76.33 Favored 'General case' 0 N--CA 1.504 2.24 0 C-N-CA 119.177 -1.009 . . . . 0.0 109.481 178.413 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.737 HG23 ' CG ' ' A' ' 30' ' ' LEU . 76.1 mt -71.28 -56.04 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.217 0 O-C-N 121.059 -1.025 . . . . 0.0 109.218 179.323 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.3 ptm -63.21 -30.19 71.39 Favored 'General case' 0 N--CA 1.506 2.374 0 C-N-CA 118.547 -1.261 . . . . 0.0 109.883 178.816 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -66.6 -38.97 88.12 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 120.817 -1.177 . . . . 0.0 108.907 178.227 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.75 HD22 ' CD2' ' A' ' 26' ' ' PHE . 11.5 mt -53.63 -33.13 54.01 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 121.105 -0.997 . . . . 0.0 110.117 178.93 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.474 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 69.6 t60 -54.73 -37.9 66.46 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.048 -1.032 . . . . 0.0 109.973 179.668 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.434 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.0 m170 -60.89 -49.38 77.68 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.2 -0.938 . . . . 0.0 109.257 179.437 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.57 -36.21 77.93 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.386 -0.925 . . . . 0.0 109.374 178.74 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.42 ' HG3' ' CE2' ' A' ' 26' ' ' PHE . 0.5 OUTLIER -62.6 -49.76 73.96 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.139 -0.976 . . . . 0.0 109.299 179.229 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 92.3 p -64.65 -39.97 94.63 Favored 'General case' 0 N--CA 1.503 2.199 0 C-N-CA 119.222 -0.991 . . . . 0.0 108.982 179.175 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.1 ttp85 -63.18 -40.25 96.97 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.135 -0.978 . . . . 0.0 109.091 178.927 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.959 ' CE2' HG21 ' A' ' 22' ' ' THR . 43.6 t80 -64.15 -53.76 44.35 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.202 -0.937 . . . . 0.0 109.187 179.293 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.722 HD12 ' HB2' ' A' ' 87' ' ' ALA . 78.6 mt -66.28 -34.71 72.0 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 C-N-CA 119.163 -1.015 . . . . 0.0 109.36 179.292 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.461 ' HD2' HD13 ' A' ' 92' ' ' ILE . 12.4 t80 -68.87 -42.57 76.82 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.993 -1.067 . . . . 0.0 108.797 178.789 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.403 ' HA ' ' HD3' ' A' ' 69' ' ' LYS . 85.4 m -59.45 -39.28 83.08 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.219 -0.926 . . . . 0.0 110.615 -179.608 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.609 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.6 pp -83.02 -34.42 26.29 Favored 'General case' 0 N--CA 1.503 2.224 0 C-N-CA 118.596 -1.241 . . . . 0.0 112.114 -179.08 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.548 ' N ' HD12 ' A' ' 66' ' ' LEU . 36.5 t80 -86.52 -32.09 20.92 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 120.705 -1.247 . . . . 0.0 111.948 -179.395 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.436 ' CD2' ' CE2' ' A' ' 64' ' ' TYR . 9.4 m-85 -98.39 -17.9 18.58 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.764 -1.21 . . . . 0.0 112.943 -178.495 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.403 ' HD3' ' HA ' ' A' ' 65' ' ' THR . 21.0 mtpt -118.29 -57.16 2.1 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.433 -1.417 . . . . 0.0 110.846 -179.962 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.406 ' HB2' ' HA ' ' A' ' 66' ' ' LEU . 46.4 mtp180 -68.8 -29.25 67.57 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.177 -0.952 . . . . 0.0 110.964 -179.581 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.21 42.02 22.66 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 120.881 -1.137 . . . . 0.0 109.896 -179.425 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -112.86 35.25 3.97 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.453 -0.779 . . . . 0.0 109.927 179.286 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.609 HG21 ' CD1' ' A' ' 66' ' ' LEU . 13.4 tt -152.91 162.05 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.2 -0.937 . . . . 0.0 109.775 179.933 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -108.33 149.57 28.5 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.155 -0.966 . . . . 0.0 110.204 -179.916 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.2 ttpt -46.84 -32.23 3.59 Favored 'General case' 0 N--CA 1.514 2.763 0 O-C-N 121.314 -0.866 . . . . 0.0 111.426 179.992 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -64.24 -47.82 78.18 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 120.846 -1.159 . . . . 0.0 109.319 179.349 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.582 HD21 ' N ' ' A' ' 16' ' ' PHE . 0.4 OUTLIER -67.39 -41.01 85.67 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.186 -0.946 . . . . 0.0 108.749 178.869 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.472 ' CE1' HG22 ' A' ' 63' ' ' ILE . 13.2 t80 -66.33 -41.34 89.77 Favored 'General case' 0 N--CA 1.505 2.298 0 C-N-CA 119.565 -0.854 . . . . 0.0 109.263 179.027 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -72.9 -41.78 64.24 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.136 -0.978 . . . . 0.0 108.788 178.78 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.865 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 87.8 t90 -55.8 -37.37 68.53 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.158 -0.964 . . . . 0.0 109.31 178.803 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.525 HD21 HD11 ' A' ' 19' ' ' ILE . 17.2 mt -67.81 -59.76 3.05 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.136 -0.978 . . . . 0.0 108.627 178.869 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.537 HG21 ' HG3' ' A' ' 89' ' ' LYS . 3.8 mt -57.18 -26.91 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 O-C-N 120.924 -1.11 . . . . 0.0 110.026 179.306 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.2 tptm -80.19 -18.74 48.77 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 120.873 -1.142 . . . . 0.0 110.946 178.549 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.44 ' HB2' ' CE1' ' A' ' 86' ' ' TYR . 11.0 mm-40 -109.24 23.89 13.87 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.66 -1.275 . . . . 0.0 112.0 179.982 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.418 ' CB ' ' O ' ' A' ' 84' ' ' GLU . 15.0 tttm 77.17 68.35 0.05 Allowed 'General case' 0 N--CA 1.515 2.775 0 O-C-N 121.212 -0.93 . . . . 0.0 112.133 179.243 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.472 ' CE2' HD23 ' A' ' 81' ' ' LEU . 21.6 m-85 -130.53 -62.4 0.92 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.404 -0.81 . . . . 0.0 109.186 179.196 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.722 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -128.6 173.32 10.38 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.447 -0.783 . . . . 0.0 109.602 179.596 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.474 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 13.7 t0 -120.29 108.54 14.3 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.035 -1.041 . . . . 0.0 110.453 179.965 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.537 ' HG3' HG21 ' A' ' 82' ' ' ILE . 20.8 mtmt -58.84 -39.17 80.46 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.195 -0.941 . . . . 0.0 110.1 179.863 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.574 HD23 HD22 ' A' ' 106' ' ' LEU . 16.5 tp -59.61 -38.58 81.66 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.108 -0.995 . . . . 0.0 110.258 -179.831 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.461 ' N ' HD11 ' A' ' 106' ' ' LEU . 53.6 tp -68.18 -48.76 64.41 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.191 -1.004 . . . . 0.0 109.184 179.482 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.461 HD13 ' HD2' ' A' ' 64' ' ' TYR . 70.8 mt -59.59 -37.91 72.89 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.495 0 O-C-N 121.126 -0.984 . . . . 0.0 108.838 178.658 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -66.76 -38.98 87.67 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.12 -0.988 . . . . 0.0 109.059 178.442 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.616 ' HB3' HD22 ' A' ' 103' ' ' LEU . 9.6 mmtm -57.17 -42.97 82.12 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.116 -0.99 . . . . 0.0 109.493 179.34 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 2.4 m0 -63.52 -33.43 75.57 Favored 'General case' 0 N--CA 1.507 2.418 0 C-N-CA 119.583 -0.847 . . . . 0.0 110.316 179.576 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.8 -33.25 25.0 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.024 -1.048 . . . . 0.0 110.655 179.611 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.8 mmmt -51.31 176.93 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.761 0 O-C-N 120.857 -1.152 . . . . 0.0 110.831 179.907 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -103.5 140.81 37.01 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.196 -0.94 . . . . 0.0 109.321 179.163 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 102.48 -26.91 22.53 Favored Glycine 0 N--CA 1.493 2.451 0 C-N-CA 119.755 -1.212 . . . . 0.0 110.106 -179.099 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.568 ' HB3' HD23 ' A' ' 103' ' ' LEU . 67.6 m-85 -92.29 57.85 3.12 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 120.83 -1.394 . . . . 0.0 110.132 179.815 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -68.66 -36.87 79.13 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 120.936 -1.102 . . . . 0.0 110.009 179.637 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.31 81.75 2.0 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.064 -1.022 . . . . 0.0 110.481 -179.88 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.649 ' HB2' HD13 ' A' ' 109' ' ' ILE . 2.0 pp -116.4 140.23 49.57 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.084 -1.01 . . . . 0.0 110.1 179.703 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.434 ' O ' ' NE2' ' A' ' 57' ' ' HIS . 28.1 p -107.4 -30.21 8.81 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.241 -0.912 . . . . 0.0 112.575 -179.722 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.712 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 10.9 m -146.41 -170.3 3.47 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 120.329 -1.482 . . . . 0.0 109.994 179.23 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.574 HD22 HD23 ' A' ' 90' ' ' LEU . 18.0 mt -99.61 -34.98 10.0 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.337 -0.852 . . . . 0.0 110.445 178.688 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 3.9 ttm180 -104.57 36.05 2.54 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.8 -1.188 . . . . 0.0 109.205 178.275 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.712 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.281 1.6 t -127.68 -59.55 1.2 Allowed 'General case' 0 N--CA 1.497 1.905 0 N-CA-C 105.901 -1.889 . . . . 0.0 105.901 -179.426 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.673 ' O ' HG21 ' A' ' 119' ' ' THR . 9.4 pt -67.81 -23.71 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.699 0 O-C-N 120.925 -1.109 . . . . 0.0 111.052 177.084 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.57 ' C ' HG23 ' A' ' 119' ' ' THR . 27.3 tt0 -122.09 163.71 18.98 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.836 -1.165 . . . . 0.0 110.024 -179.321 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.2 156.96 18.75 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.203 -0.936 . . . . 0.0 110.373 179.978 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 22.9 m-80 -127.38 26.03 6.05 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.132 -0.98 . . . . 0.0 111.549 -179.714 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -106.53 165.53 11.22 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.814 -1.179 . . . . 0.0 110.071 179.89 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 12.3 p -115.28 64.56 0.68 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.207 -0.933 . . . . 0.0 110.282 -179.933 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -142.63 -59.95 0.44 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.154 -0.966 . . . . 0.0 110.135 179.912 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -150.32 171.16 17.42 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.216 -0.927 . . . . 0.0 110.499 -179.969 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -68.66 88.8 0.22 Allowed Glycine 0 N--CA 1.493 2.457 0 N-CA-C 109.391 -1.484 . . . . 0.0 109.391 179.942 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 1.8 m -123.02 99.72 6.52 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.17 -1.194 . . . . 0.0 110.351 -179.843 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.673 HG21 ' O ' ' A' ' 109' ' ' ILE . 1.6 m -113.06 172.05 7.17 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.199 -0.938 . . . . 0.0 110.018 179.755 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 27.4 t -57.97 154.59 12.2 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.134 -0.979 . . . . 0.0 109.952 179.821 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.827 ' O ' HD13 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -75.15 -34.92 32.79 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.471 0 O-C-N 121.14 -0.975 . . . . 0.0 111.239 -179.269 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.469 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 12.1 p -54.42 -33.6 59.74 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.763 -1.21 . . . . 0.0 111.251 -178.485 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.5 -34.99 73.29 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 120.916 -1.115 . . . . 0.0 109.615 178.471 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 47.7 t -79.91 124.87 82.97 Favored Pre-proline 0 N--CA 1.504 2.254 0 O-C-N 121.134 -0.979 . . . . 0.0 109.884 179.786 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.609 ' O ' HD12 ' A' ' 129' ' ' LEU . 38.0 Cg_endo -65.03 176.33 3.17 Favored 'Trans proline' 0 N--CA 1.489 1.233 0 O-C-N 123.113 1.059 . . . . 0.0 110.921 179.499 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -75.04 -37.21 61.77 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.296 -0.877 . . . . 0.0 110.481 -179.837 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.27 -40.75 78.36 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 120.954 -1.091 . . . . 0.0 109.926 179.946 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 9.9 tp60 -70.27 -41.61 73.19 Favored 'General case' 0 N--CA 1.505 2.305 0 C-N-CA 119.378 -0.929 . . . . 0.0 108.998 178.956 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.611 HD11 HD11 ' A' ' 121' ' ' ILE . 2.2 mt -65.09 -39.3 92.97 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.301 -0.875 . . . . 0.0 109.394 179.081 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -60.1 -39.51 86.44 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.134 -0.979 . . . . 0.0 109.905 179.639 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -58.72 -37.2 75.61 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.173 -0.955 . . . . 0.0 110.289 179.755 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -59.97 -43.46 95.05 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.159 -0.963 . . . . 0.0 109.957 179.925 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . 0.662 ' HB1' ' O ' ' A' ' 138' ' ' THR . . . -60.12 -38.96 84.6 Favored 'General case' 0 N--CA 1.51 2.544 0 C-N-CA 119.374 -0.93 . . . . 0.0 109.993 179.879 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 20.9 mtt-85 -67.11 -40.27 86.84 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.142 -0.974 . . . . 0.0 109.822 179.803 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 26.6 mmtp -68.95 -35.99 77.42 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.206 -0.934 . . . . 0.0 110.34 179.714 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . 0.431 ' HB3' HG22 ' A' ' 138' ' ' THR . 2.4 tppt? -85.48 -21.7 28.55 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.045 -1.034 . . . . 0.0 111.446 179.781 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 91.61 31.47 9.44 Favored Glycine 0 N--CA 1.493 2.473 0 N-CA-C 110.069 -1.213 . . . . 0.0 110.069 -179.727 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.662 ' O ' ' HB1' ' A' ' 133' ' ' ALA . 8.9 t -140.64 -161.66 1.24 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.961 -1.317 . . . . 0.0 109.835 179.682 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -123.2 171.54 9.27 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.124 -0.985 . . . . 0.0 110.266 179.997 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 10.1 p -155.18 160.45 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.203 -0.936 . . . . 0.0 110.702 179.801 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 44.2 t -168.51 89.28 0.24 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.288 -0.882 . . . . 0.0 111.086 -179.937 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.73 ' CG ' HD12 ' A' ' 121' ' ' ILE . 50.3 t80 -95.69 159.02 15.19 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.235 -0.915 . . . . 0.0 110.13 179.867 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 8.3 m80 -136.46 -61.4 0.69 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.47 -0.769 . . . . 0.0 109.08 179.179 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . 0.405 ' OE1' ' CZ3' ' A' ' 50' ' ' TRP . 11.5 pt20 -135.74 151.28 49.98 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 178.918 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . 0.425 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 31.3 p -90.13 153.09 20.79 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.155 -1.018 . . . . 0.0 111.008 -179.67 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 22.8 m -71.14 -26.73 27.71 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 C-N-CA 119.715 -0.794 . . . . 0.0 111.496 -179.436 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -51.69 -60.66 2.91 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 120.835 -1.166 . . . . 0.0 110.288 -179.856 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.487 ' HA ' ' CD1' ' A' ' 50' ' ' TRP . 24.3 p -125.29 -170.9 2.25 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.214 -0.929 . . . . 0.0 110.849 179.862 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -95.78 59.41 1.5 Allowed Glycine 0 N--CA 1.493 2.451 0 N-CA-C 108.297 -1.921 . . . . 0.0 108.297 178.752 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 19.3 t -100.91 140.38 35.29 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.372 -1.075 . . . . 0.0 109.849 -179.367 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.6 53.18 1.43 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.282 -0.886 . . . . 0.0 109.563 179.287 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 66.95 98.52 0.03 OUTLIER Glycine 0 N--CA 1.486 2.001 0 N-CA-C 109.81 -1.316 . . . . 0.0 109.81 -179.952 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.8 p -108.75 127.59 54.13 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.303 -1.116 . . . . 0.0 110.451 179.683 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -143.23 147.8 35.42 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.129 -0.982 . . . . 0.0 109.927 -179.68 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -106.08 -49.27 3.41 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.218 -0.926 . . . . 0.0 110.624 -179.709 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 5.9 m -54.44 -38.32 66.19 Favored 'General case' 0 N--CA 1.512 2.671 0 O-C-N 121.029 -1.044 . . . . 0.0 110.624 -179.775 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 . . . . . 0 N--CA 1.494 1.746 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.173 179.908 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 65.12 149.6 0.06 OUTLIER Glycine 0 N--CA 1.493 2.437 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 179.995 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.6 m -126.5 145.0 51.44 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.195 -1.179 . . . . 0.0 110.219 179.994 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -73.71 -171.23 0.81 Allowed 'Trans proline' 0 C--N 1.318 -1.036 0 O-C-N 123.344 1.181 . . . . 0.0 110.332 -179.965 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.75 136.8 17.35 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.176 -0.952 . . . . 0.0 110.618 179.916 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 85.8 mt -117.26 145.87 22.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.228 -0.92 . . . . 0.0 110.077 -179.99 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -125.19 157.04 37.46 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.221 -0.924 . . . . 0.0 110.148 -179.941 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 53.0 -174.45 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.023 -1.048 . . . . 0.0 110.743 -179.972 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.2 mtt85 -140.22 84.34 1.96 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.215 -0.928 . . . . 0.0 110.201 -179.943 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.82 51.88 1.39 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.166 -0.958 . . . . 0.0 110.227 179.984 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.9 p -115.64 96.79 5.79 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.163 -0.961 . . . . 0.0 110.074 179.899 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.5 mttm -132.97 172.86 6.64 Favored Pre-proline 0 N--CA 1.495 1.776 0 O-C-N 121.227 -0.92 . . . . 0.0 110.331 -179.894 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.66 160.18 48.89 Favored 'Trans proline' 0 C--N 1.316 -1.138 0 O-C-N 123.409 1.215 . . . . 0.0 110.676 179.95 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.666 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . . . -84.04 145.32 46.09 Favored Pre-proline 0 N--CA 1.505 2.282 0 O-C-N 121.323 -0.861 . . . . 0.0 109.765 179.75 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -71.21 163.74 38.11 Favored 'Trans proline' 0 C--N 1.316 -1.158 0 O-C-N 123.433 1.228 . . . . 0.0 110.89 -179.669 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -48.72 -31.67 7.25 Favored 'General case' 0 N--CA 1.513 2.715 0 O-C-N 121.416 -0.802 . . . . 0.0 111.463 -179.892 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -51.62 -34.88 36.5 Favored Glycine 0 N--CA 1.499 2.863 0 O-C-N 120.961 -1.087 . . . . 0.0 110.552 179.828 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.405 ' HB2' HD11 ' A' ' 77' ' ' LEU . 28.2 t80 -55.4 -32.79 62.95 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 121.008 -1.289 . . . . 0.0 110.614 179.692 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -54.3 -37.66 65.04 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 121.039 -1.038 . . . . 0.0 110.234 179.695 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 27.9 mttt -57.59 -36.74 72.14 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.303 -0.873 . . . . 0.0 110.177 179.452 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.89 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.1 pt -116.64 35.06 1.13 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.176 -0.952 . . . . 0.0 110.449 179.509 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.431 ' N ' ' CD ' ' A' ' 21' ' ' PRO . 1.2 tmtt? -84.79 -43.04 0.69 Allowed Pre-proline 0 N--CA 1.509 2.511 0 O-C-N 121.122 -0.986 . . . . 0.0 113.172 -179.024 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 20' ' ' LYS . 46.9 Cg_endo -76.22 -37.7 1.37 Allowed 'Trans proline' 0 N--CA 1.487 1.121 0 O-C-N 122.618 0.799 . . . . 0.0 111.571 -178.337 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.759 HG21 ' CE2' ' A' ' 62' ' ' TYR . 88.5 m -59.6 -41.62 90.74 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.031 -1.043 . . . . 0.0 109.959 -179.726 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.89 HD12 ' O ' ' A' ' 19' ' ' ILE . 6.0 mt -65.19 -39.57 93.04 Favored 'General case' 0 N--CA 1.506 2.338 0 C-N-CA 119.484 -0.887 . . . . 0.0 109.461 179.238 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.15 -35.02 69.02 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.073 -1.017 . . . . 0.0 110.235 179.335 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -56.45 -35.82 68.33 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 121.118 -0.988 . . . . 0.0 110.407 179.82 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.571 ' CE2' HD12 ' A' ' 55' ' ' LEU . 15.8 m-85 -57.25 -36.84 71.45 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.074 -1.016 . . . . 0.0 110.673 -179.952 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -60.31 -37.96 82.2 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.149 -0.969 . . . . 0.0 110.893 -178.93 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.409 HD12 ' H ' ' A' ' 28' ' ' ILE . 2.9 mp -63.28 -40.31 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.475 0 C-N-CA 118.992 -1.083 . . . . 0.0 108.961 179.783 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -70.08 -55.98 8.08 Favored 'General case' 0 N--CA 1.505 2.316 0 C-N-CA 119.115 -1.034 . . . . 0.0 108.468 178.63 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.939 HD12 HD23 ' A' ' 55' ' ' LEU . 0.8 OUTLIER -56.67 -31.28 64.27 Favored 'General case' 0 N--CA 1.509 2.508 0 C-N-CA 119.242 -0.983 . . . . 0.0 109.738 178.382 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -57.75 -38.78 75.98 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 120.942 -1.099 . . . . 0.0 110.19 179.891 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -64.32 -50.29 68.4 Favored 'General case' 0 N--CA 1.506 2.351 0 C-N-CA 119.097 -1.041 . . . . 0.0 109.728 -179.902 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.449 ' HB3' ' CG1' ' A' ' 52' ' ' ILE . . . -70.61 -37.59 73.88 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.371 -0.932 . . . . 0.0 109.517 179.183 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 7.2 mm100 -71.55 -30.82 66.31 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 121.164 -0.96 . . . . 0.0 110.206 179.339 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.7 mtpp -91.79 -35.21 14.24 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.905 -1.122 . . . . 0.0 110.552 179.771 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -69.33 -40.18 77.73 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.109 -0.994 . . . . 0.0 109.356 179.377 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.548 ' HA ' HD13 ' A' ' 41' ' ' LEU . 0.7 OUTLIER -59.76 -36.91 77.61 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.16 -0.962 . . . . 0.0 110.114 179.512 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 11.5 p -104.0 39.46 1.63 Allowed 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.084 -1.01 . . . . 0.0 110.188 179.733 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 46.8 t -154.8 -57.99 0.11 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.224 -0.922 . . . . 0.0 110.379 179.909 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.4 mmtp -134.08 103.33 5.74 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.272 -0.892 . . . . 0.0 109.848 179.737 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.548 HD13 ' HA ' ' A' ' 37' ' ' LYS . 8.8 tp -124.33 72.67 1.2 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.282 -0.886 . . . . 0.0 110.286 -179.887 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -108.79 -53.24 2.67 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.147 -0.971 . . . . 0.0 110.095 179.701 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -116.43 145.66 43.11 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.176 -0.953 . . . . 0.0 110.075 179.824 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 28.5 tttt 53.52 89.15 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.139 0 O-C-N 120.962 -1.086 . . . . 0.0 110.652 -179.927 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 38.6 t -115.49 -55.62 2.43 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.206 -0.934 . . . . 0.0 110.496 -179.96 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.5 m-80 -55.87 -39.23 71.23 Favored 'General case' 0 N--CA 1.512 2.642 0 O-C-N 121.208 -0.932 . . . . 0.0 109.91 179.846 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -59.55 -36.79 76.86 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.269 -0.894 . . . . 0.0 110.028 179.524 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -62.08 -47.47 84.49 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.076 -1.015 . . . . 0.0 109.718 179.89 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 49' ' ' LEU . 12.5 mt -58.52 -38.04 76.89 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.187 -0.945 . . . . 0.0 110.127 179.908 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 48.1 m0 -59.23 -34.04 71.73 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.122 -0.986 . . . . 0.0 110.049 179.464 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.666 ' O ' HD22 ' A' ' 55' ' ' LEU . 0.7 OUTLIER -62.76 -31.09 71.98 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.077 -1.015 . . . . 0.0 109.947 178.646 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.745 HG23 HD11 ' A' ' 30' ' ' LEU . 5.7 mt -71.41 -58.89 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.263 0 O-C-N 120.921 -1.112 . . . . 0.0 109.324 179.547 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.52 -25.95 60.62 Favored 'General case' 0 N--CA 1.513 2.717 0 C-N-CA 118.312 -1.355 . . . . 0.0 110.076 178.829 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.6 mm100 -64.07 -40.07 95.46 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 120.742 -1.224 . . . . 0.0 109.405 178.522 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.939 HD23 HD12 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -55.0 -33.93 62.99 Favored 'General case' 0 N--CA 1.513 2.702 0 O-C-N 120.942 -1.099 . . . . 0.0 109.873 179.074 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.47 ' NE2' ' HB2' ' A' ' 88' ' ' ASP . 16.3 t60 -55.54 -39.78 71.02 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 120.972 -1.08 . . . . 0.0 110.291 -179.672 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 57' ' ' HIS . . . . . 0.446 ' NE2' ' O ' ' A' ' 104' ' ' CYS . 6.2 m170 -64.85 -50.96 64.59 Favored 'General case' 0 N--CA 1.507 2.405 0 C-N-CA 119.208 -0.997 . . . . 0.0 109.61 179.45 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 54.1 tp60 -57.11 -34.87 68.78 Favored 'General case' 0 N--CA 1.507 2.423 0 C-N-CA 119.436 -0.905 . . . . 0.0 109.962 179.286 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.456 ' HD3' ' CD1' ' A' ' 26' ' ' PHE . 19.2 mmm-85 -65.16 -50.32 66.43 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.027 -1.046 . . . . 0.0 109.567 179.333 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 53.8 p -60.76 -39.91 90.52 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.375 -0.93 . . . . 0.0 109.695 179.769 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.2 tpt180 -63.97 -41.19 97.63 Favored 'General case' 0 N--CA 1.505 2.314 0 C-N-CA 119.174 -1.01 . . . . 0.0 109.186 179.204 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.759 ' CE2' HG21 ' A' ' 22' ' ' THR . 36.7 t80 -63.23 -49.95 72.16 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.177 -0.952 . . . . 0.0 109.682 179.499 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.881 HD12 ' HB2' ' A' ' 87' ' ' ALA . 74.0 mt -71.61 -36.03 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 O-C-N 121.209 -0.932 . . . . 0.0 109.654 179.585 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.437 ' CD1' ' HB2' ' A' ' 68' ' ' TYR . 10.5 t80 -69.28 -41.64 76.57 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 120.974 -1.079 . . . . 0.0 108.871 178.848 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 87.8 m -61.19 -40.85 95.47 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.046 -1.034 . . . . 0.0 109.876 179.683 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.659 ' CD1' HG21 ' A' ' 73' ' ' ILE . 3.8 pp -83.23 -35.89 25.03 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 120.962 -1.086 . . . . 0.0 112.374 -179.241 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.596 ' N ' HD12 ' A' ' 66' ' ' LEU . 63.9 t80 -86.58 -35.14 19.64 Favored 'General case' 0 N--CA 1.513 2.71 0 O-C-N 120.585 -1.322 . . . . 0.0 111.839 -179.499 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.437 ' HB2' ' CD1' ' A' ' 64' ' ' TYR . 7.6 m-85 -98.26 -3.58 37.03 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 120.837 -1.164 . . . . 0.0 113.17 -178.574 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.76 -58.86 0.61 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.354 -1.466 . . . . 0.0 110.819 179.555 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.408 ' CB ' ' HA ' ' A' ' 66' ' ' LEU . 10.1 tpt180 -63.11 -29.12 70.55 Favored 'General case' 0 N--CA 1.51 2.561 0 O-C-N 121.063 -1.023 . . . . 0.0 110.609 179.956 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt 57.83 43.34 21.85 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 120.855 -1.153 . . . . 0.0 110.163 -179.512 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -115.02 36.86 3.69 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.499 -0.751 . . . . 0.0 109.737 179.213 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.744 HG13 HD23 ' A' ' 77' ' ' LEU . 13.8 tt -156.43 162.39 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.21 -0.931 . . . . 0.0 110.174 -179.83 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 31.8 m -109.93 147.54 33.24 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.163 -0.961 . . . . 0.0 109.971 179.595 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.2 tttm -45.29 -32.61 2.05 Favored 'General case' 0 N--CA 1.516 2.829 0 O-C-N 121.406 -0.809 . . . . 0.0 111.675 -179.866 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -61.72 -50.35 72.79 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 120.95 -1.093 . . . . 0.0 109.324 179.496 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.744 HD23 HG13 ' A' ' 73' ' ' ILE . 25.4 tp -67.27 -43.7 81.16 Favored 'General case' 0 N--CA 1.505 2.281 0 C-N-CA 119.15 -1.02 . . . . 0.0 108.582 178.831 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.491 ' HA ' HD12 ' A' ' 81' ' ' LEU . 16.1 t80 -60.66 -37.97 83.3 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.312 -0.868 . . . . 0.0 109.435 178.913 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.475 ' O ' HG22 ' A' ' 82' ' ' ILE . 10.0 t70 -74.88 -41.38 59.9 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.099 -1.0 . . . . 0.0 108.968 178.786 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.666 ' CH2' ' HB2' ' A' ' 12' ' ' ALA . 82.6 t90 -59.21 -38.45 79.94 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.111 -0.993 . . . . 0.0 109.212 178.816 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.491 HD12 ' HA ' ' A' ' 78' ' ' TYR . 15.1 mt -65.95 -55.8 14.99 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.249 -0.907 . . . . 0.0 109.278 179.116 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.524 HD12 ' HB3' ' A' ' 87' ' ' ALA . 0.8 OUTLIER -56.22 -27.11 23.24 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.429 0 O-C-N 121.16 -0.962 . . . . 0.0 110.852 -179.633 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.18 -18.71 26.57 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.95 -1.094 . . . . 0.0 111.674 179.598 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.446 ' HG3' ' CE2' ' A' ' 80' ' ' TRP . 10.4 mm-40 -103.75 25.19 10.11 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 120.601 -1.312 . . . . 0.0 111.809 179.97 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 7.8 mmpt? 75.25 69.97 0.08 Allowed 'General case' 0 N--CA 1.513 2.72 0 O-C-N 121.319 -0.863 . . . . 0.0 111.989 179.362 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.524 ' HE2' HD13 ' A' ' 23' ' ' LEU . 27.7 m-85 -131.9 -64.0 0.8 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.41 -0.806 . . . . 0.0 109.192 178.997 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.881 ' HB2' HD12 ' A' ' 63' ' ' ILE . . . -129.71 -178.68 4.8 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.339 -0.85 . . . . 0.0 109.734 179.44 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.47 ' HB2' ' NE2' ' A' ' 56' ' ' HIS . 6.4 t70 -131.12 124.24 30.31 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.093 -1.004 . . . . 0.0 110.615 -179.835 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -74.35 -36.75 63.62 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.264 -0.897 . . . . 0.0 109.899 179.349 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.903 HD23 HD13 ' A' ' 106' ' ' LEU . 16.0 tp -60.1 -43.35 95.62 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.022 -1.049 . . . . 0.0 109.763 179.867 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.691 ' HA ' HD21 ' A' ' 106' ' ' LEU . 67.8 tp -67.56 -48.54 66.63 Favored 'General case' 0 N--CA 1.506 2.364 0 C-N-CA 119.16 -1.016 . . . . 0.0 108.511 179.014 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 63.9 mt -58.52 -40.0 77.26 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.473 0 O-C-N 121.112 -0.993 . . . . 0.0 108.628 178.464 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.91 -39.23 91.3 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.18 -0.95 . . . . 0.0 109.459 178.803 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.411 ' HB3' ' CD2' ' A' ' 103' ' ' LEU . 5.8 mmtt -59.0 -45.4 90.77 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.051 -1.031 . . . . 0.0 109.423 179.523 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.498 ' CD1' HD23 ' A' ' 103' ' ' LEU . 8.2 m0 -64.53 -41.93 96.07 Favored 'General case' 0 N--CA 1.506 2.353 0 C-N-CA 119.45 -0.9 . . . . 0.0 109.718 179.639 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 3.0 mtp85 -65.27 -31.73 73.03 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.319 -0.863 . . . . 0.0 110.595 179.58 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 3.1 mmtp -54.26 -177.17 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.668 0 O-C-N 121.018 -1.051 . . . . 0.0 110.524 179.934 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.71 133.3 52.32 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.181 -0.949 . . . . 0.0 109.838 179.405 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.23 4.16 55.3 Favored Glycine 0 N--CA 1.493 2.458 0 C-N-CA 120.149 -1.024 . . . . 0.0 111.184 -179.488 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -110.29 46.86 1.0 Allowed 'General case' 0 N--CA 1.497 1.924 0 CA-C-N 119.658 1.729 . . . . 0.0 110.048 179.696 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -60.85 -39.74 90.25 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.171 -0.956 . . . . 0.0 109.829 179.835 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -116.01 101.89 9.16 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.3 -0.875 . . . . 0.0 109.899 179.906 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.699 HD11 ' O ' ' A' ' 105' ' ' CYS . 1.2 tp -137.98 139.82 39.89 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.247 -0.908 . . . . 0.0 109.452 -179.372 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.681 ' N ' HD12 ' A' ' 103' ' ' LEU . 29.4 p -112.36 -37.76 4.89 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.148 -0.97 . . . . 0.0 112.765 -179.521 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.699 ' O ' HD11 ' A' ' 103' ' ' LEU . 6.4 m -142.57 -169.43 2.98 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 120.209 -1.557 . . . . 0.0 110.361 179.292 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.903 HD13 HD23 ' A' ' 90' ' ' LEU . 18.0 mt -96.69 -38.76 9.79 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.103 -0.998 . . . . 0.0 110.28 179.124 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 8.1 ttm180 -101.03 29.2 4.76 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 120.944 -1.098 . . . . 0.0 109.883 178.012 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.654 ' HB2' ' HB2' ' A' ' 105' ' ' CYS 0.299 1.8 t -126.64 14.35 7.55 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.052 -1.03 . . . . 0.0 109.344 -179.429 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.576 ' CD1' HD13 ' A' ' 103' ' ' LEU . 1.0 OUTLIER -160.07 37.88 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.386 0 O-C-N 120.826 -1.171 . . . . 0.0 110.648 -178.963 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.654 ' O ' HG23 ' A' ' 119' ' ' THR . 25.8 mt-30 -127.91 145.0 51.09 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.678 -1.264 . . . . 0.0 111.552 -178.562 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 7.8 ttmt -121.22 -57.1 1.87 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.341 -0.849 . . . . 0.0 110.234 179.671 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 52.54 28.04 5.66 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 121.011 -1.055 . . . . 0.0 111.695 179.925 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -150.75 -171.46 3.93 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.959 -1.088 . . . . 0.0 110.553 -179.932 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 1.2 p -125.39 137.48 54.02 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.212 -0.93 . . . . 0.0 110.084 179.992 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 64.83 -70.63 0.08 Allowed 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.069 -1.019 . . . . 0.0 110.642 -179.942 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -127.86 114.1 16.78 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.009 -1.057 . . . . 0.0 110.193 -179.981 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -131.8 -144.43 5.36 Favored Glycine 0 N--CA 1.493 2.471 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 -179.978 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 4.1 m -117.53 89.07 3.04 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.241 -1.152 . . . . 0.0 110.208 179.994 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.654 HG23 ' O ' ' A' ' 110' ' ' GLN . 1.7 m -134.34 170.9 15.04 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.233 -0.917 . . . . 0.0 110.255 179.969 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.432 ' HB2' ' HA ' ' A' ' 108' ' ' CYS . 48.1 t -97.7 155.52 16.97 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.319 -0.863 . . . . 0.0 109.068 178.996 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.722 HG23 ' CE1' ' A' ' 142' ' ' PHE . 14.6 tt -77.49 -29.43 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.296 0 O-C-N 120.995 -1.066 . . . . 0.0 112.022 -179.257 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.475 ' HA ' ' CE2' ' A' ' 142' ' ' PHE . 13.3 p -54.76 -35.78 64.15 Favored 'General case' 0 N--CA 1.512 2.643 0 O-C-N 120.517 -1.365 . . . . 0.0 110.2 -179.278 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.86 -29.39 64.97 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.984 -1.072 . . . . 0.0 109.514 177.476 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.525 HG12 ' HG ' ' A' ' 129' ' ' LEU . 51.2 t -73.16 118.37 68.0 Favored Pre-proline 0 N--CA 1.507 2.403 0 O-C-N 121.1 -1.0 . . . . 0.0 110.221 179.764 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.404 ' HB3' ' CB ' ' A' ' 154' ' ' ALA . 37.7 Cg_endo -64.91 168.44 13.66 Favored 'Trans proline' 0 N--CA 1.489 1.221 0 O-C-N 123.088 1.046 . . . . 0.0 110.678 178.736 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 -74.98 -38.9 61.53 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.199 -0.938 . . . . 0.0 110.335 179.983 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.66 -40.62 83.99 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.079 -1.013 . . . . 0.0 110.078 -179.779 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -66.08 -41.65 90.43 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.167 -0.958 . . . . 0.0 109.514 179.604 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.611 ' O ' HG11 ' A' ' 140' ' ' VAL . 58.0 mt -64.15 -40.2 95.64 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.191 -0.943 . . . . 0.0 109.633 179.502 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -60.34 -39.15 86.09 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.211 -0.93 . . . . 0.0 110.126 179.955 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.75 -39.01 93.24 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.059 -1.025 . . . . 0.0 110.184 179.924 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -65.46 -40.42 93.16 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.176 -0.952 . . . . 0.0 109.881 179.879 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -66.54 -41.08 89.24 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.149 -0.969 . . . . 0.0 109.647 179.704 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.26 -33.44 73.55 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.134 -0.979 . . . . 0.0 110.185 179.493 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 22.2 mttt -79.26 -29.22 42.52 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.893 -1.129 . . . . 0.0 111.147 179.975 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 36.9 mttt -97.53 21.96 9.55 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 120.825 -1.172 . . . . 0.0 111.855 -179.941 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 52.18 46.42 56.72 Favored Glycine 0 N--CA 1.499 2.898 0 O-C-N 120.666 -1.271 . . . . 0.0 110.8 179.317 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 7.9 t -149.39 -164.68 2.08 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.203 -1.174 . . . . 0.0 110.404 179.987 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -134.34 162.77 31.29 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.106 -0.996 . . . . 0.0 110.346 -179.902 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.611 HG11 ' O ' ' A' ' 129' ' ' LEU . 7.9 p -151.16 161.43 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.257 -0.902 . . . . 0.0 110.453 -179.85 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 46.5 t -170.38 110.3 0.38 Allowed 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.179 -0.951 . . . . 0.0 111.202 179.789 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.722 ' CE1' HG23 ' A' ' 121' ' ' ILE . 86.0 t80 -105.78 158.78 16.49 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.224 -0.922 . . . . 0.0 110.601 179.741 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 21.9 t-160 -138.42 -60.07 0.62 Allowed 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.673 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -148.05 149.01 31.32 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.42 -0.8 . . . . 0.0 109.175 178.646 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . 0.454 ' HB3' ' HB3' ' A' ' 122' ' ' CYS . 25.0 p -93.46 156.1 16.96 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.007 -1.058 . . . . 0.0 111.105 -179.247 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 14.9 p -73.31 -25.85 21.83 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.447 0 O-C-N 121.43 -0.794 . . . . 0.0 111.679 -179.235 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -49.06 -52.5 25.18 Favored 'General case' 0 N--CA 1.516 2.853 0 O-C-N 120.816 -1.177 . . . . 0.0 110.412 -179.724 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 28.2 p -135.39 -165.02 1.62 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.227 -0.921 . . . . 0.0 110.404 179.72 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -100.34 61.78 0.65 Allowed Glycine 0 N--CA 1.492 2.376 0 N-CA-C 107.867 -2.093 . . . . 0.0 107.867 178.309 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.8 t -103.26 137.38 41.48 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.368 -1.077 . . . . 0.0 109.847 -179.007 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 19.1 mtp85 -96.03 52.8 1.32 Allowed 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.206 -0.934 . . . . 0.0 109.612 179.305 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . 70.52 97.59 0.05 OUTLIER Glycine 0 N--CA 1.488 2.164 0 N-CA-C 109.947 -1.261 . . . . 0.0 109.947 179.924 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.6 p -107.9 126.0 52.15 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.246 -1.149 . . . . 0.0 110.049 179.463 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 154' ' ' ALA . . . . . 0.404 ' CB ' ' HB3' ' A' ' 125' ' ' PRO . . . -139.45 137.52 35.66 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.047 -1.033 . . . . 0.0 109.924 -179.374 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.75 -51.07 2.96 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.124 -0.985 . . . . 0.0 110.485 -179.867 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 156' ' ' THR . . . . . . . . . . . . . 10.7 p -58.51 -40.2 82.17 Favored 'General case' 0 N--CA 1.511 2.575 0 O-C-N 121.064 -1.022 . . . . 0.0 110.279 -179.891 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 . . . . . 0 N--CA 1.496 1.848 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.442 -179.995 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A 1000 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_